NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
571466 |
2m1w   |
18882 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2m1w
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 1692
_Distance_constraint_stats_list.Viol_count 1594
_Distance_constraint_stats_list.Viol_total 826.712
_Distance_constraint_stats_list.Viol_max 0.454
_Distance_constraint_stats_list.Viol_rms 0.0102
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0012
_Distance_constraint_stats_list.Viol_average_violations_only 0.0259
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 PRO 0.001 0.001 15 0 "[ . 1 . 2]"
1 3 LEU 0.008 0.002 13 0 "[ . 1 . 2]"
1 4 GLY 0.007 0.002 13 0 "[ . 1 . 2]"
1 5 SER 0.805 0.279 7 0 "[ . 1 . 2]"
1 6 GLU 0.773 0.279 7 0 "[ . 1 . 2]"
1 7 GLU 0.369 0.021 14 0 "[ . 1 . 2]"
1 8 VAL 0.357 0.024 14 0 "[ . 1 . 2]"
1 9 PHE 0.048 0.034 11 0 "[ . 1 . 2]"
1 10 LEU 0.685 0.072 1 0 "[ . 1 . 2]"
1 11 LYS 0.047 0.029 1 0 "[ . 1 . 2]"
1 12 PHE 0.565 0.072 1 0 "[ . 1 . 2]"
1 13 VAL 0.292 0.206 7 0 "[ . 1 . 2]"
1 14 ILE 0.416 0.076 16 0 "[ . 1 . 2]"
1 15 LEU 0.337 0.045 15 0 "[ . 1 . 2]"
1 16 HIS 0.157 0.054 12 0 "[ . 1 . 2]"
1 17 ALA 0.034 0.010 19 0 "[ . 1 . 2]"
1 18 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 ASP 0.343 0.044 13 0 "[ . 1 . 2]"
1 21 THR 0.727 0.071 15 0 "[ . 1 . 2]"
1 22 ASP 0.956 0.080 10 0 "[ . 1 . 2]"
1 23 GLU 0.352 0.046 13 0 "[ . 1 . 2]"
1 24 ALA 0.583 0.106 16 0 "[ . 1 . 2]"
1 25 LEU 1.665 0.093 20 0 "[ . 1 . 2]"
1 26 ARG 0.843 0.093 20 0 "[ . 1 . 2]"
1 27 VAL 3.118 0.116 12 0 "[ . 1 . 2]"
1 28 GLN 0.179 0.039 16 0 "[ . 1 . 2]"
1 29 ASN 0.640 0.073 17 0 "[ . 1 . 2]"
1 30 LEU 2.910 0.116 12 0 "[ . 1 . 2]"
1 31 LEU 1.148 0.078 15 0 "[ . 1 . 2]"
1 32 GLN 0.076 0.039 19 0 "[ . 1 . 2]"
1 33 ASP 0.119 0.021 19 0 "[ . 1 . 2]"
1 34 ASP 0.169 0.048 19 0 "[ . 1 . 2]"
1 35 PHE 1.123 0.127 17 0 "[ . 1 . 2]"
1 36 GLY 0.177 0.048 19 0 "[ . 1 . 2]"
1 37 ILE 1.376 0.127 17 0 "[ . 1 . 2]"
1 38 LYS 0.172 0.042 6 0 "[ . 1 . 2]"
1 39 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 GLY 0.096 0.030 15 0 "[ . 1 . 2]"
1 41 ILE 0.454 0.034 14 0 "[ . 1 . 2]"
1 42 ILE 1.020 0.060 15 0 "[ . 1 . 2]"
1 43 PHE 0.147 0.045 15 0 "[ . 1 . 2]"
1 44 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 MET 1.156 0.454 9 0 "[ . 1 . 2]"
1 47 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 LEU 0.735 0.169 14 0 "[ . 1 . 2]"
1 54 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ASN 0.011 0.007 8 0 "[ . 1 . 2]"
1 56 LEU 0.085 0.015 16 0 "[ . 1 . 2]"
1 57 ASP 0.013 0.007 20 0 "[ . 1 . 2]"
1 59 ALA 0.025 0.011 2 0 "[ . 1 . 2]"
1 60 VAL 0.138 0.017 1 0 "[ . 1 . 2]"
1 61 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 GLY 0.011 0.009 15 0 "[ . 1 . 2]"
1 63 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 ALA 0.149 0.063 13 0 "[ . 1 . 2]"
1 65 TRP 0.440 0.043 1 0 "[ . 1 . 2]"
1 66 THR 0.877 0.206 7 0 "[ . 1 . 2]"
1 67 ILE 1.246 0.146 16 0 "[ . 1 . 2]"
1 68 LEU 0.213 0.038 12 0 "[ . 1 . 2]"
1 69 LEU 0.476 0.071 15 0 "[ . 1 . 2]"
1 70 LEU 0.779 0.098 10 0 "[ . 1 . 2]"
1 71 THR 0.105 0.030 1 0 "[ . 1 . 2]"
1 72 GLU 0.008 0.003 14 0 "[ . 1 . 2]"
1 73 ASN 0.070 0.021 1 0 "[ . 1 . 2]"
1 74 PHE 0.042 0.007 16 0 "[ . 1 . 2]"
1 75 LEU 0.127 0.025 1 0 "[ . 1 . 2]"
1 76 ARG 0.007 0.007 9 0 "[ . 1 . 2]"
1 77 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 THR 0.116 0.025 1 0 "[ . 1 . 2]"
1 79 TRP 0.189 0.025 1 0 "[ . 1 . 2]"
1 80 CYS 0.026 0.016 20 0 "[ . 1 . 2]"
1 81 ASN 0.010 0.004 8 0 "[ . 1 . 2]"
1 82 PHE 0.084 0.016 20 0 "[ . 1 . 2]"
1 83 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 PHE 0.020 0.020 5 0 "[ . 1 . 2]"
1 85 TYR 0.016 0.005 10 0 "[ . 1 . 2]"
1 86 THR 0.026 0.010 16 0 "[ . 1 . 2]"
1 87 SER 0.005 0.004 8 0 "[ . 1 . 2]"
1 88 LEU 0.161 0.017 1 0 "[ . 1 . 2]"
1 89 MET 0.138 0.014 12 0 "[ . 1 . 2]"
1 90 ASN 0.046 0.012 14 0 "[ . 1 . 2]"
1 91 SER 0.220 0.034 15 0 "[ . 1 . 2]"
1 92 VAL 0.316 0.057 5 0 "[ . 1 . 2]"
1 93 ASN 0.182 0.067 18 0 "[ . 1 . 2]"
1 94 ARG 0.430 0.241 3 0 "[ . 1 . 2]"
1 95 GLN 0.524 0.081 19 0 "[ . 1 . 2]"
1 96 HIS 0.303 0.081 19 0 "[ . 1 . 2]"
1 97 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 TYR 0.141 0.019 6 0 "[ . 1 . 2]"
1 99 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 SER 0.242 0.071 16 0 "[ . 1 . 2]"
1 101 VAL 1.136 0.075 14 0 "[ . 1 . 2]"
1 102 ILE 1.409 0.075 14 0 "[ . 1 . 2]"
1 103 PRO 0.348 0.098 10 0 "[ . 1 . 2]"
1 104 MET 3.425 0.185 8 0 "[ . 1 . 2]"
1 105 ARG 0.268 0.041 13 0 "[ . 1 . 2]"
1 106 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 LEU 2.182 0.125 8 0 "[ . 1 . 2]"
1 108 ASN 0.794 0.119 19 0 "[ . 1 . 2]"
1 109 ASN 0.244 0.044 12 0 "[ . 1 . 2]"
1 110 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 LEU 0.020 0.004 17 0 "[ . 1 . 2]"
1 112 PRO 0.007 0.002 5 0 "[ . 1 . 2]"
1 113 ARG 0.015 0.015 1 0 "[ . 1 . 2]"
1 114 GLU 0.070 0.058 18 0 "[ . 1 . 2]"
1 115 ARG 0.034 0.012 10 0 "[ . 1 . 2]"
1 116 THR 0.655 0.060 10 0 "[ . 1 . 2]"
1 117 PRO 0.114 0.035 5 0 "[ . 1 . 2]"
1 118 PHE 0.148 0.038 1 0 "[ . 1 . 2]"
1 119 ALA 0.842 0.075 4 0 "[ . 1 . 2]"
1 120 LEU 0.123 0.041 4 0 "[ . 1 . 2]"
1 121 GLN 1.333 0.075 4 0 "[ . 1 . 2]"
1 122 THR 0.221 0.050 5 0 "[ . 1 . 2]"
1 123 ILE 0.262 0.050 5 0 "[ . 1 . 2]"
1 124 ASN 0.023 0.011 5 0 "[ . 1 . 2]"
1 125 ALA 0.228 0.040 17 0 "[ . 1 . 2]"
1 126 LEU 1.574 0.073 14 0 "[ . 1 . 2]"
1 127 GLU 0.532 0.073 10 0 "[ . 1 . 2]"
1 128 GLU 0.376 0.099 5 0 "[ . 1 . 2]"
1 129 GLU 0.705 0.169 18 0 "[ . 1 . 2]"
1 130 SER 0.563 0.169 18 0 "[ . 1 . 2]"
1 131 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 133 PHE 1.461 0.079 16 0 "[ . 1 . 2]"
1 134 PRO 2.051 0.311 18 0 "[ . 1 . 2]"
1 135 THR 0.813 0.080 12 0 "[ . 1 . 2]"
1 136 GLN 0.839 0.048 14 0 "[ . 1 . 2]"
1 137 VAL 3.865 0.311 18 0 "[ . 1 . 2]"
1 138 GLU 1.022 0.041 15 0 "[ . 1 . 2]"
1 139 ARG 0.688 0.072 12 0 "[ . 1 . 2]"
1 140 ILE 0.283 0.036 10 0 "[ . 1 . 2]"
1 141 PHE 0.803 0.145 12 0 "[ . 1 . 2]"
1 142 GLN 0.128 0.020 7 0 "[ . 1 . 2]"
1 143 GLU 1.255 0.131 14 0 "[ . 1 . 2]"
1 144 SER 0.002 0.002 16 0 "[ . 1 . 2]"
1 145 VAL 3.857 0.214 11 0 "[ . 1 . 2]"
1 146 TYR 1.557 0.131 14 0 "[ . 1 . 2]"
1 147 LYS 0.046 0.031 13 0 "[ . 1 . 2]"
1 148 THR 0.051 0.012 10 0 "[ . 1 . 2]"
1 149 GLN 0.066 0.017 15 0 "[ . 1 . 2]"
1 150 GLN 0.068 0.037 11 0 "[ . 1 . 2]"
1 151 THR 0.230 0.092 6 0 "[ . 1 . 2]"
1 152 ILE 0.173 0.037 11 0 "[ . 1 . 2]"
1 153 TRP 0.497 0.123 11 0 "[ . 1 . 2]"
1 154 LYS 0.248 0.174 11 0 "[ . 1 . 2]"
1 155 GLU 0.366 0.092 6 0 "[ . 1 . 2]"
1 156 THR 0.283 0.123 11 0 "[ . 1 . 2]"
1 157 ARG 0.192 0.174 11 0 "[ . 1 . 2]"
1 158 ASN 0.092 0.029 11 0 "[ . 1 . 2]"
1 159 MET 0.299 0.164 1 0 "[ . 1 . 2]"
1 160 VAL 0.021 0.021 5 0 "[ . 1 . 2]"
1 161 GLN 0.021 0.021 5 0 "[ . 1 . 2]"
1 163 GLN 0.370 0.187 16 0 "[ . 1 . 2]"
1 164 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 165 ILE 0.005 0.005 14 0 "[ . 1 . 2]"
1 166 ALA 0.005 0.005 14 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 GLY QA 1 2 PRO HD3 . . 2.590 2.151 1.965 2.295 . 0 0 "[ . 1 . 2]" 1
2 1 2 PRO HA 1 3 LEU H . . 2.990 2.391 2.212 2.741 . 0 0 "[ . 1 . 2]" 1
3 1 2 PRO HB3 1 3 LEU H . . 3.780 3.505 3.123 3.781 0.001 15 0 "[ . 1 . 2]" 1
4 1 3 LEU H 1 3 LEU HB3 . . 3.200 2.709 2.530 3.089 . 0 0 "[ . 1 . 2]" 1
5 1 3 LEU H 1 3 LEU QD . . 4.180 3.571 3.053 3.710 . 0 0 "[ . 1 . 2]" 1
6 1 3 LEU H 1 3 LEU HG . . 4.850 4.651 4.410 4.824 . 0 0 "[ . 1 . 2]" 1
7 1 3 LEU HA 1 3 LEU MD1 . . 2.860 2.498 2.042 2.833 . 0 0 "[ . 1 . 2]" 1
8 1 3 LEU HA 1 3 LEU QD . . 2.420 2.037 1.903 2.157 . 0 0 "[ . 1 . 2]" 1
9 1 3 LEU HA 1 3 LEU MD2 . . 2.860 2.235 1.963 2.696 . 0 0 "[ . 1 . 2]" 1
10 1 3 LEU HA 1 3 LEU HG . . 3.850 3.705 3.609 3.765 . 0 0 "[ . 1 . 2]" 1
11 1 3 LEU HB3 1 3 LEU MD1 . . 3.350 2.436 2.279 2.676 . 0 0 "[ . 1 . 2]" 1
12 1 3 LEU HB3 1 3 LEU QD . . 2.930 2.360 2.234 2.526 . 0 0 "[ . 1 . 2]" 1
13 1 3 LEU HB3 1 3 LEU MD2 . . 3.350 3.189 3.102 3.221 . 0 0 "[ . 1 . 2]" 1
14 1 3 LEU HB3 1 4 GLY QA . . 4.490 3.947 3.653 4.492 0.002 4 0 "[ . 1 . 2]" 1
15 1 3 LEU QD 1 4 GLY H . . 4.370 3.030 2.060 3.594 . 0 0 "[ . 1 . 2]" 1
16 1 3 LEU HG 1 4 GLY H . . 4.890 4.664 3.889 4.892 0.002 13 0 "[ . 1 . 2]" 1
17 1 5 SER HA 1 5 SER HB3 . . 2.970 2.737 2.312 2.984 0.014 17 0 "[ . 1 . 2]" 1
18 1 5 SER HA 1 6 GLU H . . 2.920 2.589 2.251 3.199 0.279 7 0 "[ . 1 . 2]" 1
19 1 5 SER HB3 1 6 GLU H . . 3.960 3.659 2.537 4.080 0.120 7 0 "[ . 1 . 2]" 1
20 1 6 GLU H 1 6 GLU HB3 . . 3.540 2.406 2.242 2.952 . 0 0 "[ . 1 . 2]" 1
21 1 6 GLU HA 1 7 GLU H . . 2.520 2.327 2.206 2.495 . 0 0 "[ . 1 . 2]" 1
22 1 6 GLU HB3 1 7 GLU H . . 4.630 4.124 3.595 4.481 . 0 0 "[ . 1 . 2]" 1
23 1 7 GLU H 1 7 GLU HB3 . . 3.520 2.899 2.616 3.441 . 0 0 "[ . 1 . 2]" 1
24 1 7 GLU H 1 8 VAL H . . 4.630 4.418 4.240 4.584 . 0 0 "[ . 1 . 2]" 1
25 1 7 GLU H 1 8 VAL MG1 . . 4.940 4.739 4.048 4.957 0.017 8 0 "[ . 1 . 2]" 1
26 1 7 GLU HA 1 7 GLU HG3 . . 3.340 2.696 1.965 3.345 0.005 10 0 "[ . 1 . 2]" 1
27 1 7 GLU HA 1 8 VAL H . . 2.500 2.284 2.222 2.429 . 0 0 "[ . 1 . 2]" 1
28 1 7 GLU HA 1 8 VAL HB . . 4.570 4.538 4.379 4.584 0.014 7 0 "[ . 1 . 2]" 1
29 1 7 GLU HA 1 8 VAL MG1 . . 3.440 3.366 3.124 3.458 0.018 8 0 "[ . 1 . 2]" 1
30 1 7 GLU HA 1 153 TRP HH2 . . 4.670 4.639 4.362 4.691 0.021 14 0 "[ . 1 . 2]" 1
31 1 7 GLU HB3 1 7 GLU HG3 . . 2.960 2.917 2.757 2.969 0.009 1 0 "[ . 1 . 2]" 1
32 1 7 GLU HB3 1 8 VAL H . . 4.350 3.814 2.957 4.222 . 0 0 "[ . 1 . 2]" 1
33 1 7 GLU HB3 1 153 TRP HH2 . . 5.500 4.391 3.597 5.025 . 0 0 "[ . 1 . 2]" 1
34 1 7 GLU HB3 1 153 TRP HZ2 . . 4.730 4.434 3.448 4.744 0.014 8 0 "[ . 1 . 2]" 1
35 1 7 GLU HG3 1 8 VAL H . . 3.990 3.585 2.523 4.008 0.018 10 0 "[ . 1 . 2]" 1
36 1 7 GLU HG3 1 153 TRP HH2 . . 4.660 3.856 3.408 4.668 0.008 20 0 "[ . 1 . 2]" 1
37 1 8 VAL H 1 8 VAL HB . . 3.650 3.380 3.154 3.661 0.011 4 0 "[ . 1 . 2]" 1
38 1 8 VAL H 1 8 VAL MG1 . . 2.930 2.241 1.927 2.732 . 0 0 "[ . 1 . 2]" 1
39 1 8 VAL H 1 8 VAL MG2 . . 4.110 3.893 3.807 4.020 . 0 0 "[ . 1 . 2]" 1
40 1 8 VAL H 1 153 TRP HH2 . . 4.680 3.161 2.420 3.612 . 0 0 "[ . 1 . 2]" 1
41 1 8 VAL H 1 153 TRP HZ2 . . 4.300 2.762 1.978 3.274 . 0 0 "[ . 1 . 2]" 1
42 1 8 VAL HA 1 8 VAL MG1 . . 3.270 3.210 3.196 3.220 . 0 0 "[ . 1 . 2]" 1
43 1 8 VAL HA 1 8 VAL MG2 . . 2.970 2.365 2.273 2.411 . 0 0 "[ . 1 . 2]" 1
44 1 8 VAL HA 1 9 PHE H . . 2.920 2.412 2.327 2.488 . 0 0 "[ . 1 . 2]" 1
45 1 8 VAL HA 1 9 PHE HA . . 4.560 4.313 4.304 4.332 . 0 0 "[ . 1 . 2]" 1
46 1 8 VAL HA 1 10 LEU H . . 4.460 4.013 3.778 4.201 . 0 0 "[ . 1 . 2]" 1
47 1 8 VAL HA 1 153 TRP HH2 . . 4.200 3.786 3.343 4.210 0.010 8 0 "[ . 1 . 2]" 1
48 1 8 VAL HB 1 9 PHE H . . 4.160 3.869 3.767 3.997 . 0 0 "[ . 1 . 2]" 1
49 1 8 VAL MG1 1 9 PHE H . . 3.920 3.734 3.597 3.928 0.008 4 0 "[ . 1 . 2]" 1
50 1 8 VAL MG1 1 10 LEU H . . 4.390 2.232 1.980 2.655 . 0 0 "[ . 1 . 2]" 1
51 1 8 VAL MG1 1 10 LEU HA . . 4.390 3.933 3.748 4.369 . 0 0 "[ . 1 . 2]" 1
52 1 8 VAL MG1 1 153 TRP HH2 . . 4.590 4.500 4.342 4.598 0.008 11 0 "[ . 1 . 2]" 1
53 1 8 VAL MG1 1 153 TRP HZ2 . . 4.560 4.211 3.636 4.566 0.006 12 0 "[ . 1 . 2]" 1
54 1 8 VAL MG2 1 9 PHE H . . 3.180 1.889 1.818 2.005 . 0 0 "[ . 1 . 2]" 1
55 1 8 VAL MG2 1 10 LEU H . . 4.200 1.947 1.875 2.036 . 0 0 "[ . 1 . 2]" 1
56 1 8 VAL MG2 1 10 LEU HA . . 3.510 3.060 2.915 3.196 . 0 0 "[ . 1 . 2]" 1
57 1 8 VAL MG2 1 10 LEU HG . . 4.760 4.705 3.703 4.784 0.024 14 0 "[ . 1 . 2]" 1
58 1 8 VAL MG2 1 153 TRP HH2 . . 5.070 4.838 4.594 4.998 . 0 0 "[ . 1 . 2]" 1
59 1 9 PHE H 1 10 LEU H . . 4.550 2.909 2.760 3.112 . 0 0 "[ . 1 . 2]" 1
60 1 9 PHE H 1 153 TRP HH2 . . 4.380 4.136 3.550 4.414 0.034 11 0 "[ . 1 . 2]" 1
61 1 10 LEU H 1 10 LEU MD1 . . 4.440 3.662 3.318 4.015 . 0 0 "[ . 1 . 2]" 1
62 1 10 LEU H 1 10 LEU QD . . 3.750 3.457 3.207 3.664 . 0 0 "[ . 1 . 2]" 1
63 1 10 LEU H 1 10 LEU MD2 . . 4.440 4.273 4.192 4.327 . 0 0 "[ . 1 . 2]" 1
64 1 10 LEU H 1 10 LEU HG . . 4.580 4.412 4.107 4.494 . 0 0 "[ . 1 . 2]" 1
65 1 10 LEU HA 1 10 LEU MD1 . . 3.940 2.490 1.990 3.693 . 0 0 "[ . 1 . 2]" 1
66 1 10 LEU HA 1 10 LEU QD . . 2.850 2.421 1.984 2.833 . 0 0 "[ . 1 . 2]" 1
67 1 10 LEU HA 1 10 LEU MD2 . . 3.940 3.812 2.942 3.932 . 0 0 "[ . 1 . 2]" 1
68 1 10 LEU HA 1 12 PHE H . . 4.620 4.544 4.340 4.672 0.052 1 0 "[ . 1 . 2]" 1
69 1 10 LEU QD 1 11 LYS H . . 3.200 2.890 1.866 3.204 0.004 7 0 "[ . 1 . 2]" 1
70 1 10 LEU QD 1 12 PHE H . . 3.460 3.146 1.779 3.472 0.012 17 0 "[ . 1 . 2]" 1
71 1 10 LEU QD 1 13 VAL HA . . 4.050 2.953 2.510 3.257 . 0 0 "[ . 1 . 2]" 1
72 1 10 LEU QD 1 13 VAL QG . . 3.120 2.953 2.705 3.128 0.008 1 0 "[ . 1 . 2]" 1
73 1 10 LEU QD 1 14 ILE H . . 4.980 4.702 4.336 4.930 . 0 0 "[ . 1 . 2]" 1
74 1 10 LEU QD 1 40 GLY H . . 4.580 4.502 4.129 4.610 0.030 15 0 "[ . 1 . 2]" 1
75 1 10 LEU QD 1 41 ILE H . . 3.630 3.314 2.583 3.641 0.011 16 0 "[ . 1 . 2]" 1
76 1 10 LEU QD 1 41 ILE HA . . 4.750 4.536 4.182 4.762 0.012 11 0 "[ . 1 . 2]" 1
77 1 10 LEU QD 1 41 ILE HB . . 5.000 2.856 2.369 3.516 . 0 0 "[ . 1 . 2]" 1
78 1 10 LEU QD 1 46 MET ME . . 3.450 2.951 2.057 3.352 . 0 0 "[ . 1 . 2]" 1
79 1 10 LEU QD 1 63 SER HA . . 4.080 3.441 2.796 3.998 . 0 0 "[ . 1 . 2]" 1
80 1 10 LEU QD 1 64 ALA H . . 4.710 4.571 3.996 4.722 0.012 3 0 "[ . 1 . 2]" 1
81 1 10 LEU MD1 1 11 LYS H . . 4.130 3.161 2.442 4.159 0.029 1 0 "[ . 1 . 2]" 1
82 1 10 LEU MD1 1 12 PHE H . . 4.100 3.933 3.057 4.172 0.072 1 0 "[ . 1 . 2]" 1
83 1 10 LEU MD1 1 13 VAL HA . . 4.670 4.320 3.503 4.637 . 0 0 "[ . 1 . 2]" 1
84 1 10 LEU MD1 1 41 ILE H . . 4.300 3.520 2.614 3.934 . 0 0 "[ . 1 . 2]" 1
85 1 10 LEU MD1 1 46 MET ME . . 4.440 3.911 3.199 4.449 0.009 6 0 "[ . 1 . 2]" 1
86 1 10 LEU MD2 1 11 LYS H . . 4.130 3.650 1.869 4.132 0.002 7 0 "[ . 1 . 2]" 1
87 1 10 LEU MD2 1 12 PHE H . . 4.100 3.380 1.781 4.048 . 0 0 "[ . 1 . 2]" 1
88 1 10 LEU MD2 1 13 VAL HA . . 4.670 3.015 2.571 3.394 . 0 0 "[ . 1 . 2]" 1
89 1 10 LEU MD2 1 41 ILE H . . 4.300 4.156 3.283 4.310 0.010 5 0 "[ . 1 . 2]" 1
90 1 10 LEU MD2 1 46 MET ME . . 4.440 3.115 2.077 4.435 . 0 0 "[ . 1 . 2]" 1
91 1 10 LEU HG 1 11 LYS H . . 5.130 2.173 1.936 2.894 . 0 0 "[ . 1 . 2]" 1
92 1 10 LEU HG 1 12 PHE H . . 4.150 2.789 2.129 4.184 0.034 1 0 "[ . 1 . 2]" 1
93 1 10 LEU HG 1 41 ILE H . . 5.140 4.785 3.993 5.042 . 0 0 "[ . 1 . 2]" 1
94 1 11 LYS H 1 11 LYS HG3 . . 4.840 3.789 1.937 4.618 . 0 0 "[ . 1 . 2]" 1
95 1 11 LYS H 1 12 PHE H . . 3.920 2.418 2.048 2.991 . 0 0 "[ . 1 . 2]" 1
96 1 11 LYS HA 1 11 LYS HG3 . . 3.950 3.040 2.392 3.825 . 0 0 "[ . 1 . 2]" 1
97 1 11 LYS HA 1 64 ALA MB . . 4.060 3.491 3.175 3.706 . 0 0 "[ . 1 . 2]" 1
98 1 11 LYS HE3 1 37 ILE MG . . 4.360 3.415 1.897 4.364 0.004 14 0 "[ . 1 . 2]" 1
99 1 11 LYS HG3 1 12 PHE H . . 5.020 3.798 1.916 5.025 0.005 18 0 "[ . 1 . 2]" 1
100 1 11 LYS HG3 1 37 ILE MG . . 5.150 3.893 2.012 4.858 . 0 0 "[ . 1 . 2]" 1
101 1 12 PHE H 1 41 ILE H . . 5.130 4.844 4.236 5.154 0.024 8 0 "[ . 1 . 2]" 1
102 1 12 PHE H 1 41 ILE MG . . 5.020 4.940 4.771 5.035 0.015 15 0 "[ . 1 . 2]" 1
103 1 12 PHE HA 1 13 VAL QG . . 5.440 3.715 3.487 4.289 . 0 0 "[ . 1 . 2]" 1
104 1 12 PHE QD 1 37 ILE MG . . 3.950 2.880 2.182 3.719 . 0 0 "[ . 1 . 2]" 1
105 1 12 PHE QE 1 14 ILE MD . . 3.760 2.559 2.341 2.800 . 0 0 "[ . 1 . 2]" 1
106 1 12 PHE QE 1 31 LEU QD . . 3.880 2.862 2.554 3.161 . 0 0 "[ . 1 . 2]" 1
107 1 12 PHE QE 1 37 ILE MG . . 3.880 2.441 1.849 3.215 . 0 0 "[ . 1 . 2]" 1
108 1 12 PHE QE 1 67 ILE MD . . 4.200 1.907 1.761 2.240 . 0 0 "[ . 1 . 2]" 1
109 1 12 PHE HZ 1 14 ILE MD . . 4.060 2.454 2.025 2.806 . 0 0 "[ . 1 . 2]" 1
110 1 12 PHE HZ 1 31 LEU MD1 . . 4.660 1.937 1.763 2.312 . 0 0 "[ . 1 . 2]" 1
111 1 12 PHE HZ 1 31 LEU QD . . 3.830 1.935 1.762 2.305 . 0 0 "[ . 1 . 2]" 1
112 1 12 PHE HZ 1 31 LEU MD2 . . 4.660 4.363 4.052 4.707 0.047 15 0 "[ . 1 . 2]" 1
113 1 12 PHE HZ 1 37 ILE MG . . 3.830 3.544 2.832 3.864 0.034 15 0 "[ . 1 . 2]" 1
114 1 12 PHE HZ 1 67 ILE MD . . 3.940 3.617 3.227 3.863 . 0 0 "[ . 1 . 2]" 1
115 1 13 VAL H 1 13 VAL MG1 . . 4.230 2.027 1.871 2.431 . 0 0 "[ . 1 . 2]" 1
116 1 13 VAL H 1 13 VAL QG . . 3.680 2.018 1.865 2.406 . 0 0 "[ . 1 . 2]" 1
117 1 13 VAL H 1 13 VAL MG2 . . 4.230 3.753 3.703 3.834 . 0 0 "[ . 1 . 2]" 1
118 1 13 VAL HA 1 13 VAL MG1 . . 3.590 3.209 3.169 3.221 . 0 0 "[ . 1 . 2]" 1
119 1 13 VAL HA 1 13 VAL QG . . 3.100 2.270 2.118 2.386 . 0 0 "[ . 1 . 2]" 1
120 1 13 VAL HA 1 13 VAL MG2 . . 3.590 2.323 2.151 2.460 . 0 0 "[ . 1 . 2]" 1
121 1 13 VAL HA 1 41 ILE H . . 4.510 3.686 3.230 4.304 . 0 0 "[ . 1 . 2]" 1
122 1 13 VAL HA 1 41 ILE MG . . 3.690 3.212 2.856 3.629 . 0 0 "[ . 1 . 2]" 1
123 1 13 VAL HA 1 46 MET ME . . 3.990 3.819 3.384 4.003 0.013 14 0 "[ . 1 . 2]" 1
124 1 13 VAL HB 1 14 ILE H . . 4.270 3.866 3.738 4.232 . 0 0 "[ . 1 . 2]" 1
125 1 13 VAL HB 1 59 ALA HA . . 4.560 3.927 2.974 4.571 0.011 2 0 "[ . 1 . 2]" 1
126 1 13 VAL QG 1 15 LEU H . . 4.320 3.159 2.966 3.399 . 0 0 "[ . 1 . 2]" 1
127 1 13 VAL QG 1 15 LEU HA . . 4.300 3.498 3.353 3.685 . 0 0 "[ . 1 . 2]" 1
128 1 13 VAL QG 1 15 LEU QD . . 3.790 2.760 1.804 3.302 . 0 0 "[ . 1 . 2]" 1
129 1 13 VAL QG 1 15 LEU HG . . 3.620 2.860 1.992 3.305 . 0 0 "[ . 1 . 2]" 1
130 1 13 VAL QG 1 42 ILE HA . . 3.840 3.312 2.927 3.836 . 0 0 "[ . 1 . 2]" 1
131 1 13 VAL QG 1 43 PHE H . . 3.960 3.702 3.314 3.972 0.012 9 0 "[ . 1 . 2]" 1
132 1 13 VAL QG 1 43 PHE HA . . 3.580 3.268 2.776 3.581 0.001 18 0 "[ . 1 . 2]" 1
133 1 13 VAL QG 1 43 PHE QD . . 3.540 2.454 2.146 2.669 . 0 0 "[ . 1 . 2]" 1
134 1 13 VAL QG 1 43 PHE QE . . 3.680 3.485 3.121 3.680 0.000 19 0 "[ . 1 . 2]" 1
135 1 13 VAL QG 1 46 MET ME . . 3.280 1.727 1.605 1.928 . 0 0 "[ . 1 . 2]" 1
136 1 13 VAL QG 1 59 ALA MB . . 3.400 2.035 1.619 2.741 . 0 0 "[ . 1 . 2]" 1
137 1 13 VAL QG 1 60 VAL HA . . 4.420 3.855 3.147 4.289 . 0 0 "[ . 1 . 2]" 1
138 1 13 VAL QG 1 66 THR HB . . 4.260 3.005 1.774 3.599 . 0 0 "[ . 1 . 2]" 1
139 1 13 VAL QG 1 66 THR MG . . 2.770 1.894 1.608 2.976 0.206 7 0 "[ . 1 . 2]" 1
140 1 13 VAL QG 1 67 ILE H . . 4.740 3.572 3.060 3.916 . 0 0 "[ . 1 . 2]" 1
141 1 13 VAL MG1 1 14 ILE H . . 3.770 3.460 3.091 3.775 0.005 3 0 "[ . 1 . 2]" 1
142 1 13 VAL MG1 1 43 PHE QE . . 4.550 4.275 3.926 4.538 . 0 0 "[ . 1 . 2]" 1
143 1 13 VAL MG1 1 59 ALA HA . . 3.620 2.361 1.930 2.988 . 0 0 "[ . 1 . 2]" 1
144 1 13 VAL MG1 1 59 ALA MB . . 4.130 2.141 1.700 2.874 . 0 0 "[ . 1 . 2]" 1
145 1 13 VAL MG2 1 14 ILE H . . 3.770 1.869 1.785 2.109 . 0 0 "[ . 1 . 2]" 1
146 1 13 VAL MG2 1 43 PHE QE . . 4.550 3.707 3.266 4.001 . 0 0 "[ . 1 . 2]" 1
147 1 13 VAL MG2 1 59 ALA HA . . 3.620 3.115 2.511 3.626 0.006 20 0 "[ . 1 . 2]" 1
148 1 13 VAL MG2 1 59 ALA MB . . 4.130 2.604 1.990 3.462 . 0 0 "[ . 1 . 2]" 1
149 1 14 ILE H 1 14 ILE MD . . 4.040 2.619 2.379 3.054 . 0 0 "[ . 1 . 2]" 1
150 1 14 ILE H 1 14 ILE MG . . 4.200 3.755 3.637 3.822 . 0 0 "[ . 1 . 2]" 1
151 1 14 ILE H 1 15 LEU HA . . 4.800 4.479 4.282 4.666 . 0 0 "[ . 1 . 2]" 1
152 1 14 ILE H 1 15 LEU QD . . 5.440 4.800 3.733 5.219 . 0 0 "[ . 1 . 2]" 1
153 1 14 ILE H 1 41 ILE H . . 5.010 4.800 4.379 5.038 0.028 7 0 "[ . 1 . 2]" 1
154 1 14 ILE H 1 41 ILE MG . . 4.390 4.144 3.771 4.396 0.006 6 0 "[ . 1 . 2]" 1
155 1 14 ILE H 1 42 ILE MG . . 4.350 4.113 3.750 4.362 0.012 4 0 "[ . 1 . 2]" 1
156 1 14 ILE H 1 46 MET ME . . 4.470 3.932 3.601 4.209 . 0 0 "[ . 1 . 2]" 1
157 1 14 ILE HA 1 14 ILE MD . . 4.200 3.292 3.025 3.485 . 0 0 "[ . 1 . 2]" 1
158 1 14 ILE HA 1 14 ILE MG . . 3.640 2.534 2.482 2.628 . 0 0 "[ . 1 . 2]" 1
159 1 14 ILE HA 1 67 ILE H . . 4.510 2.019 1.933 2.308 . 0 0 "[ . 1 . 2]" 1
160 1 14 ILE HA 1 67 ILE HB . . 4.640 2.210 1.986 2.665 . 0 0 "[ . 1 . 2]" 1
161 1 14 ILE HB 1 14 ILE MD . . 3.500 2.012 1.945 2.121 . 0 0 "[ . 1 . 2]" 1
162 1 14 ILE HB 1 42 ILE HA . . 4.680 2.507 2.202 2.858 . 0 0 "[ . 1 . 2]" 1
163 1 14 ILE HB 1 42 ILE MG . . 3.460 2.510 2.102 2.931 . 0 0 "[ . 1 . 2]" 1
164 1 14 ILE MD 1 28 GLN HA . . 3.530 3.422 3.018 3.569 0.039 16 0 "[ . 1 . 2]" 1
165 1 14 ILE MD 1 31 LEU QD . . 3.440 3.335 2.538 3.461 0.021 4 0 "[ . 1 . 2]" 1
166 1 14 ILE MD 1 41 ILE H . . 3.790 3.003 2.688 3.529 . 0 0 "[ . 1 . 2]" 1
167 1 14 ILE MD 1 42 ILE HA . . 4.090 3.013 2.565 3.586 . 0 0 "[ . 1 . 2]" 1
168 1 14 ILE MD 1 67 ILE H . . 4.730 4.494 4.023 4.806 0.076 16 0 "[ . 1 . 2]" 1
169 1 14 ILE MD 1 67 ILE MD . . 4.450 3.942 2.886 4.404 . 0 0 "[ . 1 . 2]" 1
170 1 14 ILE MG 1 15 LEU H . . 3.930 3.413 3.256 3.570 . 0 0 "[ . 1 . 2]" 1
171 1 14 ILE MG 1 15 LEU HA . . 4.600 4.166 4.053 4.252 . 0 0 "[ . 1 . 2]" 1
172 1 14 ILE MG 1 16 HIS HA . . 4.640 4.340 3.967 4.528 . 0 0 "[ . 1 . 2]" 1
173 1 14 ILE MG 1 16 HIS HD2 . . 4.170 3.479 2.964 3.978 . 0 0 "[ . 1 . 2]" 1
174 1 14 ILE MG 1 31 LEU QD . . 4.740 4.245 4.009 4.705 . 0 0 "[ . 1 . 2]" 1
175 1 14 ILE MG 1 67 ILE H . . 4.080 3.711 3.569 4.102 0.022 4 0 "[ . 1 . 2]" 1
176 1 14 ILE MG 1 67 ILE HB . . 3.580 2.064 1.828 2.991 . 0 0 "[ . 1 . 2]" 1
177 1 14 ILE MG 1 67 ILE MD . . 4.700 3.516 3.198 4.093 . 0 0 "[ . 1 . 2]" 1
178 1 14 ILE MG 1 67 ILE MG . . 3.180 2.186 1.834 2.645 . 0 0 "[ . 1 . 2]" 1
179 1 14 ILE MG 1 69 LEU H . . 5.010 4.810 4.455 5.024 0.014 15 0 "[ . 1 . 2]" 1
180 1 15 LEU H 1 15 LEU MD1 . . 4.810 3.356 1.896 4.063 . 0 0 "[ . 1 . 2]" 1
181 1 15 LEU H 1 15 LEU MD2 . . 4.810 4.062 3.562 4.275 . 0 0 "[ . 1 . 2]" 1
182 1 15 LEU H 1 66 THR MG . . 4.920 4.375 3.850 4.944 0.024 16 0 "[ . 1 . 2]" 1
183 1 15 LEU H 1 67 ILE MD . . 5.270 4.859 4.145 5.173 . 0 0 "[ . 1 . 2]" 1
184 1 15 LEU H 1 67 ILE MG . . 4.600 4.083 3.264 4.521 . 0 0 "[ . 1 . 2]" 1
185 1 15 LEU HA 1 15 LEU MD1 . . 4.060 3.679 3.218 3.954 . 0 0 "[ . 1 . 2]" 1
186 1 15 LEU HA 1 15 LEU QD . . 3.550 2.320 1.918 3.026 . 0 0 "[ . 1 . 2]" 1
187 1 15 LEU HA 1 15 LEU MD2 . . 4.060 2.433 1.924 3.594 . 0 0 "[ . 1 . 2]" 1
188 1 15 LEU HA 1 43 PHE QD . . 4.970 3.447 2.885 3.687 . 0 0 "[ . 1 . 2]" 1
189 1 15 LEU QD 1 43 PHE H . . 5.000 4.814 4.443 5.045 0.045 15 0 "[ . 1 . 2]" 1
190 1 15 LEU QD 1 43 PHE QD . . 3.620 2.709 2.017 3.253 . 0 0 "[ . 1 . 2]" 1
191 1 15 LEU QD 1 43 PHE QE . . 3.520 2.606 2.147 3.094 . 0 0 "[ . 1 . 2]" 1
192 1 15 LEU QD 1 43 PHE HZ . . 3.860 3.063 2.404 3.809 . 0 0 "[ . 1 . 2]" 1
193 1 15 LEU QD 1 59 ALA HA . . 4.650 3.798 2.786 4.438 . 0 0 "[ . 1 . 2]" 1
194 1 15 LEU QD 1 66 THR HB . . 5.440 2.578 1.889 4.030 . 0 0 "[ . 1 . 2]" 1
195 1 15 LEU QD 1 66 THR MG . . 3.570 2.860 2.001 3.582 0.012 14 0 "[ . 1 . 2]" 1
196 1 15 LEU QD 1 68 LEU HA . . 5.360 4.113 3.429 4.633 . 0 0 "[ . 1 . 2]" 1
197 1 15 LEU QD 1 68 LEU QD . . 3.190 2.264 1.840 2.838 . 0 0 "[ . 1 . 2]" 1
198 1 15 LEU QD 1 78 THR MG . . 4.110 3.999 3.473 4.135 0.025 1 0 "[ . 1 . 2]" 1
199 1 15 LEU MD1 1 59 ALA MB . . 3.680 1.901 1.686 2.766 . 0 0 "[ . 1 . 2]" 1
200 1 15 LEU MD2 1 59 ALA MB . . 3.680 2.152 1.692 2.760 . 0 0 "[ . 1 . 2]" 1
201 1 15 LEU HG 1 59 ALA MB . . 4.510 2.069 1.841 2.815 . 0 0 "[ . 1 . 2]" 1
202 1 15 LEU HG 1 68 LEU QD . . 4.100 3.973 3.484 4.138 0.038 12 0 "[ . 1 . 2]" 1
203 1 16 HIS HA 1 17 ALA MB . . 4.760 3.876 3.756 3.946 . 0 0 "[ . 1 . 2]" 1
204 1 16 HIS HA 1 69 LEU H . . 4.770 3.101 2.479 3.764 . 0 0 "[ . 1 . 2]" 1
205 1 16 HIS HA 1 69 LEU MD1 . . 4.960 3.964 3.659 4.476 . 0 0 "[ . 1 . 2]" 1
206 1 16 HIS HA 1 69 LEU QD . . 3.680 2.517 1.975 2.914 . 0 0 "[ . 1 . 2]" 1
207 1 16 HIS HA 1 69 LEU MD2 . . 4.960 2.554 1.978 2.984 . 0 0 "[ . 1 . 2]" 1
208 1 16 HIS HB3 1 24 ALA MB . . 4.090 1.862 1.825 1.935 . 0 0 "[ . 1 . 2]" 1
209 1 16 HIS HE1 1 21 THR HA . . 4.460 4.342 3.723 4.514 0.054 12 0 "[ . 1 . 2]" 1
210 1 16 HIS HE1 1 21 THR MG . . 4.300 3.615 2.594 4.310 0.010 14 0 "[ . 1 . 2]" 1
211 1 16 HIS HE1 1 42 ILE MD . . 3.820 3.277 2.200 3.621 . 0 0 "[ . 1 . 2]" 1
212 1 16 HIS HE1 1 43 PHE H . . 4.350 3.159 2.593 4.242 . 0 0 "[ . 1 . 2]" 1
213 1 16 HIS HE1 1 44 ALA H . . 4.450 2.033 1.936 2.636 . 0 0 "[ . 1 . 2]" 1
214 1 16 HIS HE1 1 44 ALA HA . . 4.000 3.353 2.808 3.863 . 0 0 "[ . 1 . 2]" 1
215 1 16 HIS HE1 1 44 ALA MB . . 3.360 2.002 1.770 2.339 . 0 0 "[ . 1 . 2]" 1
216 1 17 ALA H 1 69 LEU QD . . 4.540 2.667 2.099 3.448 . 0 0 "[ . 1 . 2]" 1
217 1 17 ALA HA 1 20 ASP H . . 4.680 4.586 4.439 4.690 0.010 19 0 "[ . 1 . 2]" 1
218 1 17 ALA MB 1 18 GLU H . . 4.110 2.639 2.447 2.879 . 0 0 "[ . 1 . 2]" 1
219 1 17 ALA MB 1 19 ASP H . . 4.380 2.163 1.986 2.409 . 0 0 "[ . 1 . 2]" 1
220 1 17 ALA MB 1 19 ASP HB3 . . 4.350 2.956 2.480 4.082 . 0 0 "[ . 1 . 2]" 1
221 1 17 ALA MB 1 20 ASP H . . 4.090 2.809 2.406 3.151 . 0 0 "[ . 1 . 2]" 1
222 1 17 ALA MB 1 69 LEU QD . . 4.360 3.792 3.313 4.208 . 0 0 "[ . 1 . 2]" 1
223 1 17 ALA MB 1 71 THR MG . . 4.610 4.209 3.533 4.615 0.005 6 0 "[ . 1 . 2]" 1
224 1 17 ALA MB 1 73 ASN HD22 . . 4.180 3.429 2.136 4.181 0.001 5 0 "[ . 1 . 2]" 1
225 1 18 GLU H 1 18 GLU HB3 . . 4.170 2.411 2.206 2.774 . 0 0 "[ . 1 . 2]" 1
226 1 18 GLU H 1 20 ASP H . . 4.660 4.468 4.215 4.578 . 0 0 "[ . 1 . 2]" 1
227 1 18 GLU HA 1 20 ASP H . . 4.910 4.412 3.947 4.559 . 0 0 "[ . 1 . 2]" 1
228 1 18 GLU HB3 1 19 ASP H . . 4.720 3.766 2.998 4.467 . 0 0 "[ . 1 . 2]" 1
229 1 19 ASP H 1 19 ASP HB3 . . 3.750 2.574 2.192 3.428 . 0 0 "[ . 1 . 2]" 1
230 1 19 ASP H 1 20 ASP H . . 3.950 2.430 2.203 2.673 . 0 0 "[ . 1 . 2]" 1
231 1 19 ASP H 1 21 THR H . . 4.570 3.987 3.868 4.241 . 0 0 "[ . 1 . 2]" 1
232 1 19 ASP HB3 1 20 ASP H . . 4.080 2.538 2.419 3.606 . 0 0 "[ . 1 . 2]" 1
233 1 19 ASP HB3 1 73 ASN HD22 . . 4.790 3.168 2.604 4.026 . 0 0 "[ . 1 . 2]" 1
234 1 20 ASP H 1 20 ASP HB3 . . 3.860 3.569 2.923 3.859 . 0 0 "[ . 1 . 2]" 1
235 1 20 ASP H 1 21 THR H . . 3.580 2.813 2.557 3.031 . 0 0 "[ . 1 . 2]" 1
236 1 20 ASP HA 1 21 THR MG . . 5.500 5.234 4.760 5.544 0.044 13 0 "[ . 1 . 2]" 1
237 1 20 ASP HA 1 22 ASP H . . 4.490 3.511 3.165 4.086 . 0 0 "[ . 1 . 2]" 1
238 1 20 ASP HA 1 23 GLU H . . 4.590 3.212 3.066 3.379 . 0 0 "[ . 1 . 2]" 1
239 1 20 ASP HA 1 24 ALA H . . 4.900 4.711 4.388 4.898 . 0 0 "[ . 1 . 2]" 1
240 1 20 ASP HA 1 24 ALA MB . . 5.500 5.415 5.152 5.508 0.008 3 0 "[ . 1 . 2]" 1
241 1 20 ASP HA 1 69 LEU QD . . 4.190 3.979 3.642 4.210 0.020 10 0 "[ . 1 . 2]" 1
242 1 21 THR H 1 21 THR HB . . 3.560 2.074 1.987 2.181 . 0 0 "[ . 1 . 2]" 1
243 1 21 THR H 1 21 THR MG . . 3.700 3.152 2.684 3.473 . 0 0 "[ . 1 . 2]" 1
244 1 21 THR H 1 22 ASP H . . 3.880 2.467 2.372 2.620 . 0 0 "[ . 1 . 2]" 1
245 1 21 THR H 1 69 LEU QD . . 4.800 4.498 4.315 4.871 0.071 15 0 "[ . 1 . 2]" 1
246 1 21 THR HA 1 21 THR MG . . 3.200 2.927 2.728 3.153 . 0 0 "[ . 1 . 2]" 1
247 1 21 THR HA 1 23 GLU H . . 5.500 4.079 3.665 4.453 . 0 0 "[ . 1 . 2]" 1
248 1 21 THR HA 1 24 ALA H . . 4.700 3.660 3.310 3.935 . 0 0 "[ . 1 . 2]" 1
249 1 21 THR HA 1 24 ALA MB . . 3.580 3.125 2.807 3.423 . 0 0 "[ . 1 . 2]" 1
250 1 21 THR HA 1 25 LEU H . . 4.450 4.258 4.052 4.476 0.026 3 0 "[ . 1 . 2]" 1
251 1 21 THR HA 1 42 ILE MD . . 4.410 4.249 3.978 4.470 0.060 15 0 "[ . 1 . 2]" 1
252 1 21 THR HA 1 42 ILE MG . . 5.500 5.095 4.735 5.318 . 0 0 "[ . 1 . 2]" 1
253 1 21 THR HA 1 44 ALA MB . . 4.780 4.463 4.173 4.778 . 0 0 "[ . 1 . 2]" 1
254 1 21 THR HB 1 22 ASP H . . 3.840 3.395 2.861 3.858 0.018 2 0 "[ . 1 . 2]" 1
255 1 21 THR HB 1 42 ILE MD . . 5.430 5.162 4.882 5.445 0.015 16 0 "[ . 1 . 2]" 1
256 1 21 THR MG 1 22 ASP H . . 3.490 2.675 1.923 3.318 . 0 0 "[ . 1 . 2]" 1
257 1 21 THR MG 1 22 ASP HA . . 3.620 3.049 2.851 3.299 . 0 0 "[ . 1 . 2]" 1
258 1 21 THR MG 1 42 ILE MD . . 3.140 2.802 2.374 3.157 0.017 8 0 "[ . 1 . 2]" 1
259 1 21 THR MG 1 44 ALA MB . . 3.130 2.519 1.732 3.043 . 0 0 "[ . 1 . 2]" 1
260 1 22 ASP H 1 22 ASP HB3 . . 3.700 3.297 2.457 3.529 . 0 0 "[ . 1 . 2]" 1
261 1 22 ASP H 1 23 GLU H . . 3.370 2.429 2.268 2.672 . 0 0 "[ . 1 . 2]" 1
262 1 22 ASP H 1 23 GLU HA . . 5.120 4.954 4.799 5.138 0.018 15 0 "[ . 1 . 2]" 1
263 1 22 ASP H 1 24 ALA H . . 4.830 4.481 4.124 4.852 0.022 8 0 "[ . 1 . 2]" 1
264 1 22 ASP H 1 25 LEU QD . . 4.830 4.860 4.834 4.910 0.080 10 0 "[ . 1 . 2]" 1
265 1 22 ASP HA 1 25 LEU H . . 3.870 3.468 3.290 3.630 . 0 0 "[ . 1 . 2]" 1
266 1 22 ASP HA 1 25 LEU HB3 . . 3.580 2.455 2.202 3.022 . 0 0 "[ . 1 . 2]" 1
267 1 22 ASP HA 1 25 LEU QD . . 2.910 2.534 2.366 2.830 . 0 0 "[ . 1 . 2]" 1
268 1 22 ASP HA 1 42 ILE MD . . 4.660 4.222 3.808 4.673 0.013 16 0 "[ . 1 . 2]" 1
269 1 22 ASP HB3 1 23 GLU H . . 3.840 3.691 3.088 3.863 0.023 9 0 "[ . 1 . 2]" 1
270 1 22 ASP HB3 1 25 LEU H . . 5.500 5.267 5.035 5.567 0.067 9 0 "[ . 1 . 2]" 1
271 1 23 GLU H 1 23 GLU HB3 . . 3.710 2.513 2.216 2.916 . 0 0 "[ . 1 . 2]" 1
272 1 23 GLU H 1 24 ALA H . . 3.500 2.761 2.554 3.109 . 0 0 "[ . 1 . 2]" 1
273 1 23 GLU H 1 24 ALA MB . . 4.520 4.210 4.061 4.463 . 0 0 "[ . 1 . 2]" 1
274 1 23 GLU H 1 69 LEU QD . . 4.050 3.924 3.715 4.061 0.011 16 0 "[ . 1 . 2]" 1
275 1 23 GLU HA 1 26 ARG H . . 4.500 3.246 3.016 3.534 . 0 0 "[ . 1 . 2]" 1
276 1 23 GLU HA 1 69 LEU QD . . 4.860 4.683 4.442 4.906 0.046 13 0 "[ . 1 . 2]" 1
277 1 23 GLU HB3 1 24 ALA H . . 3.990 2.371 2.006 2.669 . 0 0 "[ . 1 . 2]" 1
278 1 23 GLU HE2 1 27 VAL QG . . 4.240 2.554 1.944 3.254 . 0 0 "[ . 1 . 2]" 1
279 1 23 GLU HE2 1 69 LEU QD . . 5.370 4.574 4.196 4.912 . 0 0 "[ . 1 . 2]" 1
280 1 23 GLU HE2 1 104 MET ME . . 4.440 4.000 3.593 4.426 . 0 0 "[ . 1 . 2]" 1
281 1 23 GLU HE2 1 107 LEU MD1 . . 4.920 4.730 4.297 4.927 0.007 12 0 "[ . 1 . 2]" 1
282 1 23 GLU HE2 1 107 LEU QD . . 3.960 3.446 2.958 3.967 0.007 9 0 "[ . 1 . 2]" 1
283 1 23 GLU HE2 1 107 LEU MD2 . . 4.920 3.626 2.986 4.656 . 0 0 "[ . 1 . 2]" 1
284 1 24 ALA H 1 24 ALA MB . . 3.090 1.954 1.933 2.019 . 0 0 "[ . 1 . 2]" 1
285 1 24 ALA H 1 25 LEU H . . 3.010 2.681 2.495 2.868 . 0 0 "[ . 1 . 2]" 1
286 1 24 ALA H 1 69 LEU MD1 . . 4.070 3.697 2.686 4.083 0.013 20 0 "[ . 1 . 2]" 1
287 1 24 ALA H 1 69 LEU QD . . 3.470 2.289 1.901 2.720 . 0 0 "[ . 1 . 2]" 1
288 1 24 ALA H 1 69 LEU MD2 . . 4.070 2.368 1.909 3.368 . 0 0 "[ . 1 . 2]" 1
289 1 24 ALA HA 1 26 ARG H . . 5.360 4.613 4.226 4.914 . 0 0 "[ . 1 . 2]" 1
290 1 24 ALA HA 1 27 VAL HB . . 4.070 3.459 2.850 4.176 0.106 16 0 "[ . 1 . 2]" 1
291 1 24 ALA HA 1 27 VAL QG . . 3.750 2.994 1.996 3.688 . 0 0 "[ . 1 . 2]" 1
292 1 24 ALA HA 1 42 ILE MG . . 5.480 4.848 4.410 5.216 . 0 0 "[ . 1 . 2]" 1
293 1 24 ALA HA 1 69 LEU MD1 . . 3.580 3.016 2.577 3.649 0.069 15 0 "[ . 1 . 2]" 1
294 1 24 ALA HA 1 69 LEU MD2 . . 3.580 3.131 2.569 3.597 0.017 20 0 "[ . 1 . 2]" 1
295 1 24 ALA MB 1 25 LEU H . . 3.260 2.955 2.786 3.161 . 0 0 "[ . 1 . 2]" 1
296 1 24 ALA MB 1 25 LEU HA . . 4.350 3.852 3.769 3.942 . 0 0 "[ . 1 . 2]" 1
297 1 24 ALA MB 1 42 ILE HA . . 5.130 4.862 4.502 5.145 0.015 15 0 "[ . 1 . 2]" 1
298 1 24 ALA MB 1 42 ILE HB . . 4.270 3.985 3.672 4.280 0.010 5 0 "[ . 1 . 2]" 1
299 1 24 ALA MB 1 69 LEU QD . . 3.200 1.657 1.559 1.811 . 0 0 "[ . 1 . 2]" 1
300 1 25 LEU H 1 25 LEU HB3 . . 3.440 2.280 2.047 2.898 . 0 0 "[ . 1 . 2]" 1
301 1 25 LEU H 1 25 LEU QD . . 4.130 3.388 3.144 3.712 . 0 0 "[ . 1 . 2]" 1
302 1 25 LEU H 1 25 LEU HG . . 4.680 4.463 4.029 4.624 . 0 0 "[ . 1 . 2]" 1
303 1 25 LEU H 1 26 ARG H . . 3.670 2.484 2.312 2.731 . 0 0 "[ . 1 . 2]" 1
304 1 25 LEU H 1 42 ILE MG . . 3.890 3.587 3.290 3.911 0.021 15 0 "[ . 1 . 2]" 1
305 1 25 LEU HA 1 25 LEU MD1 . . 4.140 3.654 3.522 3.862 . 0 0 "[ . 1 . 2]" 1
306 1 25 LEU HA 1 25 LEU QD . . 2.840 2.230 1.977 2.485 . 0 0 "[ . 1 . 2]" 1
307 1 25 LEU HA 1 25 LEU MD2 . . 4.140 2.251 1.986 2.519 . 0 0 "[ . 1 . 2]" 1
308 1 25 LEU HA 1 25 LEU HG . . 3.960 3.513 2.449 3.924 . 0 0 "[ . 1 . 2]" 1
309 1 25 LEU HA 1 28 GLN H . . 4.640 3.309 3.103 3.488 . 0 0 "[ . 1 . 2]" 1
310 1 25 LEU HA 1 42 ILE MD . . 4.010 3.504 3.219 3.852 . 0 0 "[ . 1 . 2]" 1
311 1 25 LEU HA 1 42 ILE MG . . 3.710 2.123 1.868 2.375 . 0 0 "[ . 1 . 2]" 1
312 1 25 LEU HB3 1 25 LEU MD1 . . 3.280 2.165 2.073 2.421 . 0 0 "[ . 1 . 2]" 1
313 1 25 LEU HB3 1 25 LEU QD . . 2.740 2.094 2.035 2.142 . 0 0 "[ . 1 . 2]" 1
314 1 25 LEU HB3 1 25 LEU MD2 . . 3.280 3.007 2.368 3.205 . 0 0 "[ . 1 . 2]" 1
315 1 25 LEU HB3 1 26 ARG H . . 3.500 2.816 2.416 3.160 . 0 0 "[ . 1 . 2]" 1
316 1 25 LEU QD 1 26 ARG H . . 3.460 2.695 2.282 3.553 0.093 20 0 "[ . 1 . 2]" 1
317 1 25 LEU QD 1 28 GLN H . . 4.930 4.110 3.848 4.480 . 0 0 "[ . 1 . 2]" 1
318 1 25 LEU QD 1 28 GLN HA . . 5.440 5.070 4.835 5.455 0.015 20 0 "[ . 1 . 2]" 1
319 1 25 LEU QD 1 28 GLN HE21 . . 4.550 3.332 2.127 4.220 . 0 0 "[ . 1 . 2]" 1
320 1 25 LEU QD 1 28 GLN HE22 . . 4.550 3.983 3.530 4.319 . 0 0 "[ . 1 . 2]" 1
321 1 25 LEU QD 1 29 ASN H . . 4.250 3.136 2.966 3.551 . 0 0 "[ . 1 . 2]" 1
322 1 25 LEU QD 1 29 ASN HD21 . . 3.790 1.873 1.807 1.978 . 0 0 "[ . 1 . 2]" 1
323 1 25 LEU QD 1 29 ASN HD22 . . 4.120 2.927 2.648 3.063 . 0 0 "[ . 1 . 2]" 1
324 1 25 LEU QD 1 42 ILE HA . . 5.440 5.451 5.410 5.487 0.047 8 0 "[ . 1 . 2]" 1
325 1 25 LEU QD 1 42 ILE HB . . 4.710 4.672 4.528 4.748 0.038 9 0 "[ . 1 . 2]" 1
326 1 25 LEU MD1 1 26 ARG H . . 4.620 2.973 2.307 4.652 0.032 20 0 "[ . 1 . 2]" 1
327 1 25 LEU MD1 1 29 ASN HD21 . . 4.340 2.982 2.302 3.936 . 0 0 "[ . 1 . 2]" 1
328 1 25 LEU MD1 1 29 ASN HD22 . . 4.820 4.010 3.471 4.569 . 0 0 "[ . 1 . 2]" 1
329 1 25 LEU MD2 1 26 ARG H . . 4.620 3.734 3.514 4.069 . 0 0 "[ . 1 . 2]" 1
330 1 25 LEU MD2 1 29 ASN HD21 . . 4.340 1.907 1.810 2.077 . 0 0 "[ . 1 . 2]" 1
331 1 25 LEU MD2 1 29 ASN HD22 . . 4.820 3.024 2.670 3.171 . 0 0 "[ . 1 . 2]" 1
332 1 25 LEU HG 1 42 ILE MD . . 3.160 2.411 1.868 2.762 . 0 0 "[ . 1 . 2]" 1
333 1 25 LEU HG 1 42 ILE MG . . 4.550 3.292 1.979 3.916 . 0 0 "[ . 1 . 2]" 1
334 1 26 ARG H 1 26 ARG HB3 . . 3.530 2.655 2.309 2.981 . 0 0 "[ . 1 . 2]" 1
335 1 26 ARG H 1 27 VAL H . . 3.820 2.831 2.576 2.978 . 0 0 "[ . 1 . 2]" 1
336 1 26 ARG H 1 28 GLN H . . 4.910 4.647 4.238 4.869 . 0 0 "[ . 1 . 2]" 1
337 1 26 ARG HA 1 29 ASN H . . 4.050 3.857 3.739 3.940 . 0 0 "[ . 1 . 2]" 1
338 1 26 ARG HA 1 29 ASN HB3 . . 4.860 3.717 3.421 3.936 . 0 0 "[ . 1 . 2]" 1
339 1 26 ARG HA 1 29 ASN HD21 . . 4.530 3.717 3.621 3.804 . 0 0 "[ . 1 . 2]" 1
340 1 26 ARG HA 1 29 ASN HD22 . . 5.240 5.265 5.183 5.313 0.073 17 0 "[ . 1 . 2]" 1
341 1 26 ARG HB3 1 27 VAL H . . 4.110 2.807 2.459 2.950 . 0 0 "[ . 1 . 2]" 1
342 1 27 VAL H 1 27 VAL HB . . 3.570 2.225 2.033 2.572 . 0 0 "[ . 1 . 2]" 1
343 1 27 VAL H 1 27 VAL MG1 . . 3.730 2.885 1.907 3.534 . 0 0 "[ . 1 . 2]" 1
344 1 27 VAL H 1 27 VAL MG2 . . 3.730 3.285 2.832 3.749 0.019 17 0 "[ . 1 . 2]" 1
345 1 27 VAL H 1 28 GLN H . . 3.890 2.614 2.469 2.753 . 0 0 "[ . 1 . 2]" 1
346 1 27 VAL HA 1 27 VAL MG1 . . 3.280 2.928 2.692 3.219 . 0 0 "[ . 1 . 2]" 1
347 1 27 VAL HA 1 27 VAL QG . . 2.870 2.079 1.958 2.252 . 0 0 "[ . 1 . 2]" 1
348 1 27 VAL HA 1 27 VAL MG2 . . 3.280 2.131 1.979 2.299 . 0 0 "[ . 1 . 2]" 1
349 1 27 VAL HA 1 28 GLN HA . . 5.060 4.825 4.801 4.841 . 0 0 "[ . 1 . 2]" 1
350 1 27 VAL HA 1 30 LEU H . . 3.930 3.130 2.988 3.292 . 0 0 "[ . 1 . 2]" 1
351 1 27 VAL HA 1 30 LEU HB3 . . 3.980 3.005 2.801 3.147 . 0 0 "[ . 1 . 2]" 1
352 1 27 VAL HA 1 30 LEU MD1 . . 3.460 3.521 3.492 3.576 0.116 12 0 "[ . 1 . 2]" 1
353 1 27 VAL HA 1 30 LEU MD2 . . 3.630 2.568 2.301 2.817 . 0 0 "[ . 1 . 2]" 1
354 1 27 VAL HA 1 30 LEU HG . . 5.090 5.134 5.056 5.183 0.093 5 0 "[ . 1 . 2]" 1
355 1 27 VAL HA 1 31 LEU H . . 4.420 4.054 3.944 4.158 . 0 0 "[ . 1 . 2]" 1
356 1 27 VAL HB 1 28 GLN H . . 3.920 3.028 2.486 3.739 . 0 0 "[ . 1 . 2]" 1
357 1 27 VAL QG 1 28 GLN H . . 3.510 1.998 1.726 2.281 . 0 0 "[ . 1 . 2]" 1
358 1 27 VAL QG 1 28 GLN HA . . 3.910 2.767 2.649 2.922 . 0 0 "[ . 1 . 2]" 1
359 1 27 VAL QG 1 30 LEU H . . 4.400 4.003 3.776 4.270 . 0 0 "[ . 1 . 2]" 1
360 1 27 VAL QG 1 31 LEU HA . . 4.680 4.367 4.190 4.584 . 0 0 "[ . 1 . 2]" 1
361 1 27 VAL QG 1 31 LEU QD . . 2.580 1.881 1.746 2.227 . 0 0 "[ . 1 . 2]" 1
362 1 27 VAL QG 1 31 LEU HG . . 3.570 2.041 1.850 2.450 . 0 0 "[ . 1 . 2]" 1
363 1 27 VAL QG 1 67 ILE MD . . 4.430 3.782 3.411 4.184 . 0 0 "[ . 1 . 2]" 1
364 1 27 VAL QG 1 128 GLU HA . . 4.550 4.151 3.893 4.442 . 0 0 "[ . 1 . 2]" 1
365 1 27 VAL QG 1 128 GLU HE2 . . 4.320 2.654 1.840 4.275 . 0 0 "[ . 1 . 2]" 1
366 1 27 VAL QG 1 133 PHE QD . . 4.470 4.012 3.571 4.414 . 0 0 "[ . 1 . 2]" 1
367 1 27 VAL MG1 1 28 GLN H . . 4.080 2.005 1.730 2.295 . 0 0 "[ . 1 . 2]" 1
368 1 27 VAL MG1 1 31 LEU MD1 . . 4.750 2.032 1.791 2.779 . 0 0 "[ . 1 . 2]" 1
369 1 27 VAL MG1 1 31 LEU MD2 . . 4.750 3.175 2.224 4.347 . 0 0 "[ . 1 . 2]" 1
370 1 27 VAL MG1 1 31 LEU HG . . 4.250 2.438 1.853 3.552 . 0 0 "[ . 1 . 2]" 1
371 1 27 VAL MG1 1 104 MET ME . . 2.540 2.174 1.910 2.574 0.034 19 0 "[ . 1 . 2]" 1
372 1 27 VAL MG1 1 133 PHE QD . . 5.370 5.227 4.501 5.449 0.079 16 0 "[ . 1 . 2]" 1
373 1 27 VAL MG2 1 28 GLN H . . 4.080 3.850 3.541 3.993 . 0 0 "[ . 1 . 2]" 1
374 1 27 VAL MG2 1 31 LEU MD1 . . 4.750 3.349 2.012 4.179 . 0 0 "[ . 1 . 2]" 1
375 1 27 VAL MG2 1 31 LEU MD2 . . 4.750 3.390 2.433 4.096 . 0 0 "[ . 1 . 2]" 1
376 1 27 VAL MG2 1 31 LEU HG . . 4.250 3.283 1.963 4.072 . 0 0 "[ . 1 . 2]" 1
377 1 27 VAL MG2 1 104 MET ME . . 2.540 2.017 1.720 2.496 . 0 0 "[ . 1 . 2]" 1
378 1 27 VAL MG2 1 133 PHE QD . . 5.370 4.225 3.620 4.750 . 0 0 "[ . 1 . 2]" 1
379 1 28 GLN H 1 28 GLN HB3 . . 4.160 2.134 2.079 2.226 . 0 0 "[ . 1 . 2]" 1
380 1 28 GLN H 1 29 ASN H . . 3.750 2.859 2.782 2.918 . 0 0 "[ . 1 . 2]" 1
381 1 28 GLN H 1 30 LEU MD2 . . 4.750 4.654 4.501 4.763 0.013 8 0 "[ . 1 . 2]" 1
382 1 28 GLN H 1 31 LEU QD . . 4.740 3.358 3.102 3.690 . 0 0 "[ . 1 . 2]" 1
383 1 28 GLN H 1 42 ILE MG . . 4.610 4.162 3.827 4.547 . 0 0 "[ . 1 . 2]" 1
384 1 28 GLN HA 1 31 LEU MD1 . . 4.470 2.030 1.934 2.383 . 0 0 "[ . 1 . 2]" 1
385 1 28 GLN HA 1 31 LEU QD . . 3.710 2.025 1.929 2.374 . 0 0 "[ . 1 . 2]" 1
386 1 28 GLN HA 1 31 LEU MD2 . . 4.470 4.167 3.831 4.475 0.005 3 0 "[ . 1 . 2]" 1
387 1 28 GLN HA 1 42 ILE MG . . 5.500 4.874 4.479 5.110 . 0 0 "[ . 1 . 2]" 1
388 1 28 GLN HB3 1 29 ASN H . . 4.520 3.908 3.828 4.057 . 0 0 "[ . 1 . 2]" 1
389 1 28 GLN HB3 1 42 ILE MG . . 3.950 2.830 2.376 3.115 . 0 0 "[ . 1 . 2]" 1
390 1 28 GLN HE21 1 42 ILE MD . . 5.030 4.436 3.924 5.044 0.014 6 0 "[ . 1 . 2]" 1
391 1 28 GLN HE22 1 40 GLY H . . 4.880 4.404 4.246 4.592 . 0 0 "[ . 1 . 2]" 1
392 1 28 GLN HE22 1 40 GLY QA . . 4.530 3.146 2.373 3.717 . 0 0 "[ . 1 . 2]" 1
393 1 28 GLN HE22 1 42 ILE MG . . 4.270 3.587 3.161 4.072 . 0 0 "[ . 1 . 2]" 1
394 1 28 GLN HG3 1 29 ASN H . . 4.310 2.316 2.111 2.577 . 0 0 "[ . 1 . 2]" 1
395 1 29 ASN H 1 29 ASN HB3 . . 3.340 2.951 2.907 3.003 . 0 0 "[ . 1 . 2]" 1
396 1 29 ASN H 1 29 ASN HD21 . . 4.350 4.009 3.839 4.123 . 0 0 "[ . 1 . 2]" 1
397 1 29 ASN H 1 29 ASN HD22 . . 5.410 5.334 5.228 5.390 . 0 0 "[ . 1 . 2]" 1
398 1 29 ASN H 1 30 LEU H . . 3.530 2.548 2.381 2.713 . 0 0 "[ . 1 . 2]" 1
399 1 29 ASN H 1 30 LEU MD2 . . 4.340 4.273 4.153 4.374 0.034 19 0 "[ . 1 . 2]" 1
400 1 29 ASN HA 1 29 ASN HD21 . . 4.120 3.677 3.390 3.867 . 0 0 "[ . 1 . 2]" 1
401 1 29 ASN HA 1 29 ASN HD22 . . 4.570 4.085 3.907 4.206 . 0 0 "[ . 1 . 2]" 1
402 1 29 ASN HB3 1 29 ASN HD22 . . 4.070 3.976 3.918 4.050 . 0 0 "[ . 1 . 2]" 1
403 1 29 ASN HB3 1 30 LEU H . . 3.720 2.497 2.171 2.896 . 0 0 "[ . 1 . 2]" 1
404 1 30 LEU H 1 30 LEU HB3 . . 3.450 2.028 1.983 2.100 . 0 0 "[ . 1 . 2]" 1
405 1 30 LEU H 1 30 LEU MD1 . . 4.240 4.096 4.052 4.155 . 0 0 "[ . 1 . 2]" 1
406 1 30 LEU H 1 30 LEU MD2 . . 3.450 2.736 2.680 2.796 . 0 0 "[ . 1 . 2]" 1
407 1 30 LEU H 1 30 LEU HG . . 4.360 4.312 4.217 4.351 . 0 0 "[ . 1 . 2]" 1
408 1 30 LEU H 1 31 LEU H . . 3.760 2.458 2.272 2.616 . 0 0 "[ . 1 . 2]" 1
409 1 30 LEU H 1 31 LEU HA . . 5.100 4.976 4.826 5.127 0.027 3 0 "[ . 1 . 2]" 1
410 1 30 LEU H 1 31 LEU MD1 . . 5.500 5.227 4.607 5.541 0.041 11 0 "[ . 1 . 2]" 1
411 1 30 LEU H 1 31 LEU QD . . 4.790 4.509 4.219 4.767 . 0 0 "[ . 1 . 2]" 1
412 1 30 LEU H 1 31 LEU MD2 . . 5.500 4.942 4.622 5.248 . 0 0 "[ . 1 . 2]" 1
413 1 30 LEU HA 1 30 LEU MD1 . . 4.110 3.965 3.921 3.988 . 0 0 "[ . 1 . 2]" 1
414 1 30 LEU HA 1 30 LEU MD2 . . 3.640 3.508 3.467 3.592 . 0 0 "[ . 1 . 2]" 1
415 1 30 LEU HA 1 30 LEU HG . . 3.430 3.229 3.181 3.262 . 0 0 "[ . 1 . 2]" 1
416 1 30 LEU HA 1 34 ASP H . . 3.850 3.362 3.022 3.566 . 0 0 "[ . 1 . 2]" 1
417 1 30 LEU HB3 1 30 LEU MD1 . . 3.250 2.466 2.450 2.509 . 0 0 "[ . 1 . 2]" 1
418 1 30 LEU HB3 1 30 LEU MD2 . . 3.140 2.324 2.249 2.369 . 0 0 "[ . 1 . 2]" 1
419 1 30 LEU HB3 1 31 LEU H . . 4.110 3.577 3.541 3.606 . 0 0 "[ . 1 . 2]" 1
420 1 30 LEU HB3 1 31 LEU QD . . 4.940 4.616 4.465 4.781 . 0 0 "[ . 1 . 2]" 1
421 1 30 LEU MD1 1 31 LEU H . . 4.950 4.702 4.653 4.783 . 0 0 "[ . 1 . 2]" 1
422 1 30 LEU MD1 1 31 LEU HA . . 5.180 4.897 4.859 4.982 . 0 0 "[ . 1 . 2]" 1
423 1 30 LEU MD1 1 31 LEU QD . . 3.950 3.867 3.759 4.010 0.060 16 0 "[ . 1 . 2]" 1
424 1 30 LEU MD1 1 133 PHE HZ . . 3.890 2.697 1.925 3.712 . 0 0 "[ . 1 . 2]" 1
425 1 30 LEU MD2 1 31 LEU H . . 3.930 2.280 2.141 2.484 . 0 0 "[ . 1 . 2]" 1
426 1 30 LEU MD2 1 31 LEU HA . . 3.950 2.281 2.144 2.534 . 0 0 "[ . 1 . 2]" 1
427 1 30 LEU MD2 1 31 LEU MD1 . . 4.290 3.588 3.237 3.764 . 0 0 "[ . 1 . 2]" 1
428 1 30 LEU MD2 1 31 LEU QD . . 3.230 1.854 1.787 1.948 . 0 0 "[ . 1 . 2]" 1
429 1 30 LEU MD2 1 31 LEU MD2 . . 4.290 1.860 1.791 1.955 . 0 0 "[ . 1 . 2]" 1
430 1 30 LEU MD2 1 33 ASP H . . 5.010 4.856 4.441 5.029 0.019 16 0 "[ . 1 . 2]" 1
431 1 30 LEU MD2 1 34 ASP H . . 4.400 4.091 3.938 4.239 . 0 0 "[ . 1 . 2]" 1
432 1 30 LEU MD2 1 34 ASP HB3 . . 3.340 3.272 2.991 3.365 0.025 6 0 "[ . 1 . 2]" 1
433 1 30 LEU MD2 1 35 PHE H . . 4.770 4.599 4.479 4.768 . 0 0 "[ . 1 . 2]" 1
434 1 30 LEU MD2 1 35 PHE QD . . 3.800 3.733 3.485 3.844 0.044 15 0 "[ . 1 . 2]" 1
435 1 30 LEU MD2 1 35 PHE QE . . 3.130 2.505 1.970 2.891 . 0 0 "[ . 1 . 2]" 1
436 1 30 LEU MD2 1 35 PHE HZ . . 4.420 3.894 3.539 4.487 0.067 19 0 "[ . 1 . 2]" 1
437 1 30 LEU MD2 1 133 PHE HZ . . 4.220 1.941 1.770 2.370 . 0 0 "[ . 1 . 2]" 1
438 1 30 LEU MD2 1 137 VAL QG . . 4.260 3.537 3.219 3.806 . 0 0 "[ . 1 . 2]" 1
439 1 30 LEU HG 1 31 LEU H . . 4.530 4.163 4.040 4.257 . 0 0 "[ . 1 . 2]" 1
440 1 30 LEU HG 1 34 ASP H . . 4.200 3.536 3.399 3.789 . 0 0 "[ . 1 . 2]" 1
441 1 31 LEU H 1 31 LEU MD1 . . 3.920 3.760 3.530 3.851 . 0 0 "[ . 1 . 2]" 1
442 1 31 LEU H 1 31 LEU QD . . 3.410 3.173 3.038 3.276 . 0 0 "[ . 1 . 2]" 1
443 1 31 LEU H 1 31 LEU MD2 . . 3.920 3.429 3.191 3.654 . 0 0 "[ . 1 . 2]" 1
444 1 31 LEU H 1 31 LEU HG . . 4.650 2.530 2.388 2.688 . 0 0 "[ . 1 . 2]" 1
445 1 31 LEU HA 1 31 LEU MD1 . . 3.880 3.797 3.758 3.898 0.018 20 0 "[ . 1 . 2]" 1
446 1 31 LEU HA 1 31 LEU QD . . 3.000 1.959 1.887 2.247 . 0 0 "[ . 1 . 2]" 1
447 1 31 LEU HA 1 31 LEU MD2 . . 3.880 1.965 1.892 2.261 . 0 0 "[ . 1 . 2]" 1
448 1 31 LEU HA 1 31 LEU HG . . 3.730 3.060 2.983 3.164 . 0 0 "[ . 1 . 2]" 1
449 1 31 LEU HA 1 34 ASP H . . 4.450 3.989 3.786 4.124 . 0 0 "[ . 1 . 2]" 1
450 1 31 LEU HA 1 35 PHE H . . 3.730 3.538 3.134 3.695 . 0 0 "[ . 1 . 2]" 1
451 1 31 LEU HA 1 35 PHE QD . . 3.660 2.423 2.119 2.762 . 0 0 "[ . 1 . 2]" 1
452 1 31 LEU HA 1 137 VAL QG . . 5.090 3.600 3.403 3.811 . 0 0 "[ . 1 . 2]" 1
453 1 31 LEU HB3 1 31 LEU MD1 . . 3.410 2.311 2.172 2.433 . 0 0 "[ . 1 . 2]" 1
454 1 31 LEU HB3 1 31 LEU MD2 . . 3.410 2.415 2.231 2.483 . 0 0 "[ . 1 . 2]" 1
455 1 31 LEU HB3 1 32 GLN H . . 4.540 3.527 3.226 4.112 . 0 0 "[ . 1 . 2]" 1
456 1 31 LEU QD 1 32 GLN H . . 4.430 4.150 4.031 4.388 . 0 0 "[ . 1 . 2]" 1
457 1 31 LEU QD 1 34 ASP H . . 5.160 5.015 4.920 5.093 . 0 0 "[ . 1 . 2]" 1
458 1 31 LEU QD 1 34 ASP HB3 . . 4.380 3.829 3.375 4.062 . 0 0 "[ . 1 . 2]" 1
459 1 31 LEU QD 1 35 PHE H . . 4.560 4.293 4.112 4.524 . 0 0 "[ . 1 . 2]" 1
460 1 31 LEU QD 1 35 PHE QD . . 3.460 2.401 2.160 2.646 . 0 0 "[ . 1 . 2]" 1
461 1 31 LEU QD 1 35 PHE QE . . 3.440 1.879 1.761 2.113 . 0 0 "[ . 1 . 2]" 1
462 1 31 LEU QD 1 37 ILE H . . 5.180 4.438 4.147 4.698 . 0 0 "[ . 1 . 2]" 1
463 1 31 LEU QD 1 37 ILE MG . . 3.530 3.089 2.747 3.553 0.023 17 0 "[ . 1 . 2]" 1
464 1 31 LEU QD 1 67 ILE MD . . 3.270 3.234 3.001 3.348 0.078 15 0 "[ . 1 . 2]" 1
465 1 31 LEU QD 1 67 ILE MG . . 4.850 4.479 4.004 4.853 0.003 8 0 "[ . 1 . 2]" 1
466 1 31 LEU QD 1 104 MET ME . . 3.360 3.204 2.674 3.395 0.035 7 0 "[ . 1 . 2]" 1
467 1 31 LEU QD 1 126 LEU QD . . 4.950 3.160 2.900 3.335 . 0 0 "[ . 1 . 2]" 1
468 1 31 LEU QD 1 133 PHE QE . . 4.070 2.616 2.162 3.262 . 0 0 "[ . 1 . 2]" 1
469 1 31 LEU QD 1 134 PRO HA . . 4.900 4.565 4.041 4.928 0.028 1 0 "[ . 1 . 2]" 1
470 1 31 LEU QD 1 137 VAL H . . 5.390 4.996 4.632 5.205 . 0 0 "[ . 1 . 2]" 1
471 1 31 LEU QD 1 137 VAL HA . . 4.490 4.125 3.957 4.357 . 0 0 "[ . 1 . 2]" 1
472 1 31 LEU QD 1 137 VAL HB . . 4.200 3.521 2.915 3.929 . 0 0 "[ . 1 . 2]" 1
473 1 31 LEU QD 1 137 VAL QG . . 2.820 1.733 1.636 1.880 . 0 0 "[ . 1 . 2]" 1
474 1 31 LEU QD 1 141 PHE QD . . 4.240 3.296 2.858 3.762 . 0 0 "[ . 1 . 2]" 1
475 1 31 LEU QD 1 141 PHE QE . . 3.560 2.738 2.355 2.990 . 0 0 "[ . 1 . 2]" 1
476 1 31 LEU QD 1 141 PHE HZ . . 4.230 4.124 3.850 4.286 0.056 12 0 "[ . 1 . 2]" 1
477 1 31 LEU MD1 1 32 GLN H . . 5.090 4.652 4.476 5.056 . 0 0 "[ . 1 . 2]" 1
478 1 31 LEU MD1 1 35 PHE QD . . 4.990 4.709 4.539 4.866 . 0 0 "[ . 1 . 2]" 1
479 1 31 LEU MD1 1 35 PHE QE . . 4.820 4.435 4.294 4.596 . 0 0 "[ . 1 . 2]" 1
480 1 31 LEU MD1 1 37 ILE MG . . 4.380 3.228 2.814 3.764 . 0 0 "[ . 1 . 2]" 1
481 1 31 LEU MD1 1 104 MET ME . . 4.200 3.441 2.764 3.921 . 0 0 "[ . 1 . 2]" 1
482 1 31 LEU MD1 1 137 VAL HA . . 5.240 5.069 4.866 5.254 0.014 4 0 "[ . 1 . 2]" 1
483 1 31 LEU MD1 1 141 PHE QE . . 4.150 2.973 2.504 3.250 . 0 0 "[ . 1 . 2]" 1
484 1 31 LEU MD2 1 32 GLN H . . 5.090 4.668 4.572 4.880 . 0 0 "[ . 1 . 2]" 1
485 1 31 LEU MD2 1 35 PHE QD . . 4.990 2.408 2.164 2.659 . 0 0 "[ . 1 . 2]" 1
486 1 31 LEU MD2 1 35 PHE QE . . 4.820 1.880 1.762 2.116 . 0 0 "[ . 1 . 2]" 1
487 1 31 LEU MD2 1 37 ILE MG . . 4.380 3.986 3.658 4.362 . 0 0 "[ . 1 . 2]" 1
488 1 31 LEU MD2 1 104 MET ME . . 4.200 3.915 3.556 4.225 0.025 17 0 "[ . 1 . 2]" 1
489 1 31 LEU MD2 1 137 VAL HA . . 5.240 4.373 4.125 4.685 . 0 0 "[ . 1 . 2]" 1
490 1 31 LEU MD2 1 141 PHE QE . . 4.150 3.220 2.864 3.588 . 0 0 "[ . 1 . 2]" 1
491 1 31 LEU HG 1 137 VAL QG . . 4.460 3.938 3.793 4.138 . 0 0 "[ . 1 . 2]" 1
492 1 32 GLN H 1 32 GLN HB3 . . 4.020 2.652 2.554 2.735 . 0 0 "[ . 1 . 2]" 1
493 1 32 GLN H 1 32 GLN QE . . 5.320 4.546 4.238 4.696 . 0 0 "[ . 1 . 2]" 1
494 1 32 GLN H 1 32 GLN HG3 . . 4.060 2.751 2.298 3.411 . 0 0 "[ . 1 . 2]" 1
495 1 32 GLN H 1 33 ASP H . . 3.730 3.341 2.299 3.668 . 0 0 "[ . 1 . 2]" 1
496 1 32 GLN HA 1 32 GLN QE . . 5.060 4.329 4.005 4.689 . 0 0 "[ . 1 . 2]" 1
497 1 32 GLN HA 1 33 ASP HA . . 4.620 4.300 4.254 4.501 . 0 0 "[ . 1 . 2]" 1
498 1 32 GLN HA 1 36 GLY H . . 3.950 3.392 3.096 3.906 . 0 0 "[ . 1 . 2]" 1
499 1 32 GLN HA 1 37 ILE H . . 3.910 2.271 1.987 2.911 . 0 0 "[ . 1 . 2]" 1
500 1 32 GLN HA 1 38 LYS HA . . 4.430 4.246 4.063 4.432 0.002 18 0 "[ . 1 . 2]" 1
501 1 32 GLN HB3 1 33 ASP H . . 4.850 4.648 4.206 4.724 . 0 0 "[ . 1 . 2]" 1
502 1 32 GLN HB3 1 38 LYS HA . . 4.270 3.460 3.092 4.309 0.039 19 0 "[ . 1 . 2]" 1
503 1 33 ASP H 1 33 ASP HB3 . . 3.800 3.096 2.578 3.794 . 0 0 "[ . 1 . 2]" 1
504 1 33 ASP H 1 34 ASP H . . 3.440 2.495 2.180 2.663 . 0 0 "[ . 1 . 2]" 1
505 1 33 ASP H 1 36 GLY H . . 4.590 2.335 1.969 3.613 . 0 0 "[ . 1 . 2]" 1
506 1 33 ASP HA 1 36 GLY H . . 3.890 3.804 3.510 3.911 0.021 19 0 "[ . 1 . 2]" 1
507 1 33 ASP HB3 1 34 ASP H . . 3.700 2.207 2.008 2.626 . 0 0 "[ . 1 . 2]" 1
508 1 34 ASP H 1 34 ASP HB3 . . 3.470 2.760 2.593 2.954 . 0 0 "[ . 1 . 2]" 1
509 1 34 ASP H 1 35 PHE H . . 3.490 3.022 2.846 3.315 . 0 0 "[ . 1 . 2]" 1
510 1 34 ASP H 1 36 GLY H . . 4.010 3.842 3.666 4.058 0.048 19 0 "[ . 1 . 2]" 1
511 1 34 ASP HB3 1 35 PHE H . . 4.050 2.260 2.038 2.465 . 0 0 "[ . 1 . 2]" 1
512 1 34 ASP HB3 1 36 GLY H . . 4.340 4.108 3.854 4.314 . 0 0 "[ . 1 . 2]" 1
513 1 35 PHE H 1 36 GLY H . . 3.320 1.955 1.890 2.095 . 0 0 "[ . 1 . 2]" 1
514 1 35 PHE H 1 36 GLY HA2 . . 5.100 4.229 4.128 4.390 . 0 0 "[ . 1 . 2]" 1
515 1 35 PHE H 1 36 GLY QA . . 4.320 3.928 3.842 4.065 . 0 0 "[ . 1 . 2]" 1
516 1 35 PHE H 1 36 GLY HA3 . . 5.100 4.662 4.578 4.798 . 0 0 "[ . 1 . 2]" 1
517 1 35 PHE H 1 37 ILE H . . 4.340 3.518 3.312 3.665 . 0 0 "[ . 1 . 2]" 1
518 1 35 PHE H 1 37 ILE MD . . 4.510 4.459 4.272 4.565 0.055 17 0 "[ . 1 . 2]" 1
519 1 35 PHE HA 1 35 PHE QD . . 3.530 2.960 2.560 3.274 . 0 0 "[ . 1 . 2]" 1
520 1 35 PHE HA 1 36 GLY QA . . 4.640 4.267 4.245 4.284 . 0 0 "[ . 1 . 2]" 1
521 1 35 PHE HA 1 37 ILE H . . 5.360 5.237 4.828 5.373 0.013 18 0 "[ . 1 . 2]" 1
522 1 35 PHE HA 1 37 ILE MD . . 4.900 4.653 4.388 4.921 0.021 17 0 "[ . 1 . 2]" 1
523 1 35 PHE QD 1 37 ILE HA . . 5.500 5.516 5.449 5.627 0.127 17 0 "[ . 1 . 2]" 1
524 1 35 PHE QD 1 37 ILE HB . . 4.510 4.110 3.945 4.287 . 0 0 "[ . 1 . 2]" 1
525 1 35 PHE QD 1 37 ILE MD . . 3.900 3.465 3.150 3.751 . 0 0 "[ . 1 . 2]" 1
526 1 35 PHE QD 1 37 ILE HG13 . . 4.120 2.792 2.313 3.319 . 0 0 "[ . 1 . 2]" 1
527 1 35 PHE QD 1 37 ILE MG . . 5.010 4.686 4.453 4.940 . 0 0 "[ . 1 . 2]" 1
528 1 35 PHE QD 1 137 VAL MG1 . . 4.830 2.847 2.244 3.510 . 0 0 "[ . 1 . 2]" 1
529 1 35 PHE QD 1 137 VAL QG . . 3.840 2.659 2.237 2.840 . 0 0 "[ . 1 . 2]" 1
530 1 35 PHE QD 1 137 VAL MG2 . . 4.830 4.285 2.574 4.896 0.066 19 0 "[ . 1 . 2]" 1
531 1 36 GLY H 1 37 ILE H . . 3.580 2.171 1.968 2.320 . 0 0 "[ . 1 . 2]" 1
532 1 36 GLY H 1 37 ILE HB . . 4.990 4.523 4.229 4.707 . 0 0 "[ . 1 . 2]" 1
533 1 36 GLY H 1 37 ILE MD . . 4.560 4.021 3.826 4.356 . 0 0 "[ . 1 . 2]" 1
534 1 36 GLY H 1 37 ILE HG13 . . 5.150 4.699 4.556 4.894 . 0 0 "[ . 1 . 2]" 1
535 1 37 ILE H 1 37 ILE HB . . 3.620 2.560 2.512 2.600 . 0 0 "[ . 1 . 2]" 1
536 1 37 ILE H 1 37 ILE MD . . 3.670 3.178 2.837 3.398 . 0 0 "[ . 1 . 2]" 1
537 1 37 ILE H 1 37 ILE HG13 . . 3.960 3.427 3.347 3.501 . 0 0 "[ . 1 . 2]" 1
538 1 37 ILE H 1 37 ILE MG . . 3.900 3.744 3.707 3.765 . 0 0 "[ . 1 . 2]" 1
539 1 37 ILE H 1 38 LYS H . . 4.380 3.975 3.768 4.248 . 0 0 "[ . 1 . 2]" 1
540 1 37 ILE HA 1 37 ILE MD . . 3.350 2.085 1.949 2.289 . 0 0 "[ . 1 . 2]" 1
541 1 37 ILE HA 1 37 ILE HG13 . . 4.090 3.822 3.736 3.874 . 0 0 "[ . 1 . 2]" 1
542 1 37 ILE HA 1 37 ILE MG . . 3.360 2.276 2.161 2.406 . 0 0 "[ . 1 . 2]" 1
543 1 37 ILE HA 1 38 LYS H . . 3.300 2.370 2.243 2.487 . 0 0 "[ . 1 . 2]" 1
544 1 37 ILE HB 1 37 ILE MD . . 3.340 3.199 3.184 3.215 . 0 0 "[ . 1 . 2]" 1
545 1 37 ILE MD 1 38 LYS H . . 4.380 4.134 3.871 4.309 . 0 0 "[ . 1 . 2]" 1
546 1 37 ILE MD 1 137 VAL HA . . 5.010 5.029 4.979 5.109 0.099 20 0 "[ . 1 . 2]" 1
547 1 37 ILE MD 1 137 VAL QG . . 3.250 2.882 2.676 3.148 . 0 0 "[ . 1 . 2]" 1
548 1 37 ILE MD 1 138 GLU HA . . 4.520 3.841 3.345 4.407 . 0 0 "[ . 1 . 2]" 1
549 1 37 ILE MD 1 141 PHE H . . 4.860 4.547 4.211 4.835 . 0 0 "[ . 1 . 2]" 1
550 1 37 ILE MD 1 141 PHE HA . . 5.000 4.538 4.044 4.956 . 0 0 "[ . 1 . 2]" 1
551 1 37 ILE MD 1 141 PHE QD . . 3.770 2.939 2.692 3.143 . 0 0 "[ . 1 . 2]" 1
552 1 37 ILE HG13 1 37 ILE MG . . 3.530 2.454 2.286 2.548 . 0 0 "[ . 1 . 2]" 1
553 1 37 ILE HG13 1 137 VAL QG . . 4.060 2.650 2.382 2.886 . 0 0 "[ . 1 . 2]" 1
554 1 37 ILE MG 1 38 LYS H . . 3.800 3.656 3.399 3.842 0.042 6 0 "[ . 1 . 2]" 1
555 1 37 ILE MG 1 38 LYS HA . . 4.370 4.044 3.764 4.215 . 0 0 "[ . 1 . 2]" 1
556 1 37 ILE MG 1 137 VAL QG . . 4.740 3.639 3.283 4.017 . 0 0 "[ . 1 . 2]" 1
557 1 37 ILE MG 1 141 PHE QD . . 3.580 3.235 2.885 3.554 . 0 0 "[ . 1 . 2]" 1
558 1 38 LYS H 1 38 LYS HB3 . . 3.930 3.558 3.349 3.903 . 0 0 "[ . 1 . 2]" 1
559 1 38 LYS HA 1 38 LYS HD3 . . 5.260 4.762 3.574 4.942 . 0 0 "[ . 1 . 2]" 1
560 1 38 LYS HA 1 40 GLY H . . 3.660 2.953 2.248 3.338 . 0 0 "[ . 1 . 2]" 1
561 1 38 LYS HB3 1 39 PRO HA . . 4.430 2.514 1.847 2.788 . 0 0 "[ . 1 . 2]" 1
562 1 39 PRO HB3 1 40 GLY H . . 4.570 3.606 3.407 3.961 . 0 0 "[ . 1 . 2]" 1
563 1 40 GLY H 1 41 ILE H . . 4.580 4.359 4.178 4.460 . 0 0 "[ . 1 . 2]" 1
564 1 40 GLY QA 1 41 ILE MG . . 4.330 3.943 3.483 4.260 . 0 0 "[ . 1 . 2]" 1
565 1 41 ILE H 1 41 ILE MD . . 4.920 4.633 4.409 4.843 . 0 0 "[ . 1 . 2]" 1
566 1 41 ILE H 1 41 ILE MG . . 3.520 2.539 2.146 2.844 . 0 0 "[ . 1 . 2]" 1
567 1 41 ILE H 1 42 ILE H . . 4.480 4.310 4.120 4.435 . 0 0 "[ . 1 . 2]" 1
568 1 41 ILE HA 1 41 ILE MD . . 3.860 3.445 2.844 3.854 . 0 0 "[ . 1 . 2]" 1
569 1 41 ILE HA 1 41 ILE MG . . 3.670 3.175 3.133 3.217 . 0 0 "[ . 1 . 2]" 1
570 1 41 ILE HA 1 42 ILE MG . . 4.380 3.712 3.519 4.066 . 0 0 "[ . 1 . 2]" 1
571 1 41 ILE HB 1 41 ILE MD . . 3.210 2.765 2.344 3.168 . 0 0 "[ . 1 . 2]" 1
572 1 41 ILE HB 1 42 ILE H . . 4.470 4.257 3.922 4.484 0.014 16 0 "[ . 1 . 2]" 1
573 1 41 ILE HB 1 46 MET HA . . 5.500 5.415 5.208 5.518 0.018 10 0 "[ . 1 . 2]" 1
574 1 41 ILE MD 1 41 ILE MG . . 2.400 1.846 1.765 1.939 . 0 0 "[ . 1 . 2]" 1
575 1 41 ILE MD 1 42 ILE H . . 3.800 3.257 2.234 3.834 0.034 14 0 "[ . 1 . 2]" 1
576 1 41 ILE MD 1 45 GLU H . . 4.640 3.680 2.991 4.199 . 0 0 "[ . 1 . 2]" 1
577 1 41 ILE MD 1 46 MET H . . 4.080 2.885 2.328 3.478 . 0 0 "[ . 1 . 2]" 1
578 1 41 ILE MD 1 46 MET HA . . 3.560 1.909 1.760 1.986 . 0 0 "[ . 1 . 2]" 1
579 1 41 ILE MD 1 46 MET HG3 . . 4.560 3.559 2.942 4.477 . 0 0 "[ . 1 . 2]" 1
580 1 41 ILE MD 1 47 PRO HD3 . . 3.980 2.266 1.907 2.571 . 0 0 "[ . 1 . 2]" 1
581 1 41 ILE HG13 1 41 ILE MG . . 3.480 2.992 2.612 3.239 . 0 0 "[ . 1 . 2]" 1
582 1 41 ILE HG13 1 42 ILE H . . 5.150 3.732 2.461 4.665 . 0 0 "[ . 1 . 2]" 1
583 1 41 ILE MG 1 42 ILE H . . 3.960 3.496 3.104 3.729 . 0 0 "[ . 1 . 2]" 1
584 1 41 ILE MG 1 46 MET H . . 4.510 4.104 3.732 4.393 . 0 0 "[ . 1 . 2]" 1
585 1 41 ILE MG 1 46 MET ME . . 2.670 2.376 1.870 2.672 0.002 4 0 "[ . 1 . 2]" 1
586 1 41 ILE MG 1 46 MET HG3 . . 5.040 4.151 3.419 5.052 0.012 9 0 "[ . 1 . 2]" 1
587 1 42 ILE H 1 42 ILE HG13 . . 4.260 2.714 1.948 3.041 . 0 0 "[ . 1 . 2]" 1
588 1 42 ILE H 1 42 ILE MG . . 3.560 2.743 2.543 3.006 . 0 0 "[ . 1 . 2]" 1
589 1 42 ILE H 1 46 MET ME . . 4.950 4.833 4.226 4.959 0.009 14 0 "[ . 1 . 2]" 1
590 1 42 ILE HA 1 42 ILE MD . . 4.270 4.113 4.061 4.138 . 0 0 "[ . 1 . 2]" 1
591 1 42 ILE HA 1 42 ILE MG . . 3.580 2.235 2.179 2.282 . 0 0 "[ . 1 . 2]" 1
592 1 42 ILE HB 1 42 ILE MD . . 3.520 2.234 1.964 2.441 . 0 0 "[ . 1 . 2]" 1
593 1 42 ILE HB 1 43 PHE HA . . 5.000 4.734 4.535 4.937 . 0 0 "[ . 1 . 2]" 1
594 1 42 ILE MD 1 43 PHE H . . 4.290 3.924 3.588 4.298 0.008 12 0 "[ . 1 . 2]" 1
595 1 42 ILE MD 1 44 ALA H . . 4.390 2.784 2.554 3.053 . 0 0 "[ . 1 . 2]" 1
596 1 42 ILE MD 1 44 ALA MB . . 3.180 1.931 1.714 2.154 . 0 0 "[ . 1 . 2]" 1
597 1 42 ILE MD 1 45 GLU H . . 3.930 3.371 2.569 3.603 . 0 0 "[ . 1 . 2]" 1
598 1 42 ILE MD 1 45 GLU HG3 . . 3.670 2.785 2.236 3.385 . 0 0 "[ . 1 . 2]" 1
599 1 42 ILE MD 1 46 MET H . . 5.280 5.074 4.601 5.312 0.032 12 0 "[ . 1 . 2]" 1
600 1 42 ILE HG13 1 45 GLU HG3 . . 4.720 3.081 2.036 3.782 . 0 0 "[ . 1 . 2]" 1
601 1 42 ILE MG 1 43 PHE H . . 4.200 3.633 3.336 3.829 . 0 0 "[ . 1 . 2]" 1
602 1 42 ILE MG 1 45 GLU H . . 4.920 4.631 4.485 4.724 . 0 0 "[ . 1 . 2]" 1
603 1 43 PHE H 1 44 ALA MB . . 4.860 4.047 3.895 4.310 . 0 0 "[ . 1 . 2]" 1
604 1 43 PHE H 1 46 MET ME . . 4.850 4.258 3.722 4.811 . 0 0 "[ . 1 . 2]" 1
605 1 43 PHE HA 1 43 PHE QD . . 3.860 2.411 1.993 2.911 . 0 0 "[ . 1 . 2]" 1
606 1 43 PHE HA 1 46 MET ME . . 3.240 2.467 2.040 2.935 . 0 0 "[ . 1 . 2]" 1
607 1 43 PHE QD 1 46 MET ME . . 3.210 2.644 2.028 3.113 . 0 0 "[ . 1 . 2]" 1
608 1 43 PHE QD 1 59 ALA MB . . 4.110 2.718 2.078 3.134 . 0 0 "[ . 1 . 2]" 1
609 1 43 PHE QE 1 46 MET ME . . 4.000 3.689 3.343 4.008 0.008 20 0 "[ . 1 . 2]" 1
610 1 43 PHE QE 1 59 ALA HA . . 4.050 3.349 1.998 3.896 . 0 0 "[ . 1 . 2]" 1
611 1 43 PHE QE 1 59 ALA MB . . 3.990 2.106 1.786 2.571 . 0 0 "[ . 1 . 2]" 1
612 1 44 ALA MB 1 45 GLU H . . 3.780 3.232 2.562 3.351 . 0 0 "[ . 1 . 2]" 1
613 1 45 GLU H 1 45 GLU HG3 . . 4.430 3.872 2.503 4.235 . 0 0 "[ . 1 . 2]" 1
614 1 45 GLU H 1 46 MET H . . 4.060 2.030 1.918 2.509 . 0 0 "[ . 1 . 2]" 1
615 1 45 GLU HA 1 45 GLU HG3 . . 3.890 3.500 2.904 3.727 . 0 0 "[ . 1 . 2]" 1
616 1 46 MET H 1 46 MET HB3 . . 4.060 2.840 2.514 2.966 . 0 0 "[ . 1 . 2]" 1
617 1 46 MET H 1 46 MET ME . . 3.630 3.425 3.108 3.639 0.009 15 0 "[ . 1 . 2]" 1
618 1 46 MET H 1 46 MET HG3 . . 4.710 4.106 3.066 4.486 . 0 0 "[ . 1 . 2]" 1
619 1 46 MET HA 1 46 MET ME . . 3.280 3.277 3.019 3.734 0.454 9 0 "[ . 1 . 2]" 1
620 1 46 MET ME 1 59 ALA HA . . 3.760 3.541 2.986 3.761 0.001 18 0 "[ . 1 . 2]" 1
621 1 46 MET ME 1 59 ALA MB . . 4.090 3.523 2.898 4.094 0.004 11 0 "[ . 1 . 2]" 1
622 1 48 HIS HE1 1 53 LEU QD . . 4.500 3.402 1.849 4.487 . 0 0 "[ . 1 . 2]" 1
623 1 52 HIS HA 1 52 HIS HD2 . . 4.330 3.549 2.203 4.329 . 0 0 "[ . 1 . 2]" 1
624 1 53 LEU H 1 53 LEU HB3 . . 4.010 3.041 2.151 3.750 . 0 0 "[ . 1 . 2]" 1
625 1 53 LEU H 1 53 LEU MD1 . . 4.040 2.343 1.768 4.096 0.056 4 0 "[ . 1 . 2]" 1
626 1 53 LEU H 1 53 LEU MD2 . . 4.040 2.886 1.780 4.092 0.052 20 0 "[ . 1 . 2]" 1
627 1 53 LEU H 1 53 LEU HG . . 4.350 3.658 3.013 4.222 . 0 0 "[ . 1 . 2]" 1
628 1 53 LEU HA 1 53 LEU MD1 . . 3.700 3.293 1.998 3.869 0.169 14 0 "[ . 1 . 2]" 1
629 1 53 LEU HA 1 53 LEU MD2 . . 3.700 3.405 1.998 3.803 0.103 4 0 "[ . 1 . 2]" 1
630 1 53 LEU QD 1 54 GLN H . . 4.100 3.157 1.904 4.045 . 0 0 "[ . 1 . 2]" 1
631 1 54 GLN H 1 54 GLN HG3 . . 4.560 3.490 1.997 4.539 . 0 0 "[ . 1 . 2]" 1
632 1 55 ASN HA 1 56 LEU QD . . 4.370 3.782 3.009 4.377 0.007 8 0 "[ . 1 . 2]" 1
633 1 56 LEU HA 1 56 LEU MD1 . . 4.230 3.599 1.941 4.005 . 0 0 "[ . 1 . 2]" 1
634 1 56 LEU HA 1 56 LEU QD . . 3.550 3.203 1.930 3.440 . 0 0 "[ . 1 . 2]" 1
635 1 56 LEU HA 1 56 LEU MD2 . . 4.230 3.786 2.324 4.123 . 0 0 "[ . 1 . 2]" 1
636 1 56 LEU QD 1 57 ASP H . . 3.910 2.748 1.929 3.725 . 0 0 "[ . 1 . 2]" 1
637 1 56 LEU QD 1 57 ASP HA . . 5.130 3.467 2.525 5.078 . 0 0 "[ . 1 . 2]" 1
638 1 56 LEU QD 1 78 THR HA . . 4.590 3.195 2.259 4.004 . 0 0 "[ . 1 . 2]" 1
639 1 56 LEU QD 1 81 ASN H . . 4.690 4.426 3.680 4.694 0.004 8 0 "[ . 1 . 2]" 1
640 1 56 LEU QD 1 81 ASN HA . . 4.920 4.190 3.091 4.622 . 0 0 "[ . 1 . 2]" 1
641 1 56 LEU QD 1 81 ASN QD . . 4.370 2.356 1.657 3.254 . 0 0 "[ . 1 . 2]" 1
642 1 56 LEU QD 1 82 PHE HA . . 4.420 4.044 2.831 4.435 0.015 16 0 "[ . 1 . 2]" 1
643 1 56 LEU QD 1 82 PHE QD . . 3.290 2.928 2.162 3.188 . 0 0 "[ . 1 . 2]" 1
644 1 56 LEU QD 1 82 PHE QE . . 3.590 2.257 1.719 2.789 . 0 0 "[ . 1 . 2]" 1
645 1 56 LEU QD 1 82 PHE HZ . . 4.420 3.846 2.599 4.421 0.001 4 0 "[ . 1 . 2]" 1
646 1 56 LEU QD 1 88 LEU QD . . 3.370 1.943 1.451 2.665 . 0 0 "[ . 1 . 2]" 1
647 1 56 LEU MD1 1 57 ASP H . . 4.710 3.267 1.932 4.606 . 0 0 "[ . 1 . 2]" 1
648 1 56 LEU MD1 1 81 ASN QD . . 5.270 3.584 2.250 5.174 . 0 0 "[ . 1 . 2]" 1
649 1 56 LEU MD1 1 82 PHE QD . . 3.940 3.680 2.205 3.947 0.007 19 0 "[ . 1 . 2]" 1
650 1 56 LEU MD2 1 57 ASP H . . 4.710 4.067 2.709 4.717 0.007 20 0 "[ . 1 . 2]" 1
651 1 56 LEU MD2 1 81 ASN QD . . 5.270 2.545 1.706 4.315 . 0 0 "[ . 1 . 2]" 1
652 1 56 LEU MD2 1 82 PHE QD . . 3.940 3.160 2.604 3.927 . 0 0 "[ . 1 . 2]" 1
653 1 57 ASP HA 1 60 VAL H . . 4.450 3.057 2.627 3.410 . 0 0 "[ . 1 . 2]" 1
654 1 57 ASP HA 1 60 VAL MG1 . . 4.640 3.714 2.923 4.258 . 0 0 "[ . 1 . 2]" 1
655 1 57 ASP HA 1 60 VAL QG . . 3.940 2.726 1.827 3.466 . 0 0 "[ . 1 . 2]" 1
656 1 57 ASP HA 1 60 VAL MG2 . . 4.640 2.893 1.830 3.759 . 0 0 "[ . 1 . 2]" 1
657 1 59 ALA MB 1 60 VAL H . . 3.870 2.905 2.417 3.207 . 0 0 "[ . 1 . 2]" 1
658 1 59 ALA MB 1 60 VAL HA . . 4.660 3.922 3.855 3.984 . 0 0 "[ . 1 . 2]" 1
659 1 59 ALA MB 1 66 THR MG . . 3.880 2.832 2.308 3.358 . 0 0 "[ . 1 . 2]" 1
660 1 60 VAL H 1 66 THR MG . . 4.530 3.962 3.363 4.425 . 0 0 "[ . 1 . 2]" 1
661 1 60 VAL HA 1 66 THR HB . . 4.790 4.553 3.854 4.793 0.003 4 0 "[ . 1 . 2]" 1
662 1 60 VAL HA 1 66 THR MG . . 3.480 2.362 1.783 3.478 . 0 0 "[ . 1 . 2]" 1
663 1 60 VAL HA 1 88 LEU QD . . 5.390 4.826 4.322 5.399 0.009 12 0 "[ . 1 . 2]" 1
664 1 60 VAL HA 1 101 VAL QG . . 4.560 4.190 3.300 4.540 . 0 0 "[ . 1 . 2]" 1
665 1 60 VAL QG 1 61 ASN H . . 4.230 3.705 3.483 3.791 . 0 0 "[ . 1 . 2]" 1
666 1 60 VAL QG 1 61 ASN HA . . 4.170 3.860 3.519 4.048 . 0 0 "[ . 1 . 2]" 1
667 1 60 VAL QG 1 66 THR MG . . 4.670 2.555 1.828 3.233 . 0 0 "[ . 1 . 2]" 1
668 1 60 VAL QG 1 88 LEU HA . . 3.560 3.417 2.608 3.577 0.017 1 0 "[ . 1 . 2]" 1
669 1 60 VAL QG 1 88 LEU QD . . 3.180 1.938 1.686 2.525 . 0 0 "[ . 1 . 2]" 1
670 1 60 VAL QG 1 91 SER H . . 5.130 4.505 3.931 5.075 . 0 0 "[ . 1 . 2]" 1
671 1 60 VAL QG 1 91 SER HG . . 5.040 2.619 1.933 4.218 . 0 0 "[ . 1 . 2]" 1
672 1 60 VAL QG 1 100 SER H . . 4.910 4.595 3.950 4.925 0.015 20 0 "[ . 1 . 2]" 1
673 1 60 VAL QG 1 101 VAL H . . 5.440 5.089 3.811 5.401 . 0 0 "[ . 1 . 2]" 1
674 1 60 VAL QG 1 101 VAL QG . . 3.320 2.414 1.748 2.752 . 0 0 "[ . 1 . 2]" 1
675 1 60 VAL MG1 1 88 LEU HA . . 4.260 3.894 2.659 4.273 0.013 2 0 "[ . 1 . 2]" 1
676 1 60 VAL MG2 1 88 LEU HA . . 4.260 3.892 3.048 4.253 . 0 0 "[ . 1 . 2]" 1
677 1 62 GLY QA 1 153 TRP HE1 . . 3.840 2.613 1.942 3.849 0.009 15 0 "[ . 1 . 2]" 1
678 1 63 SER HB3 1 64 ALA H . . 4.600 2.796 2.125 4.042 . 0 0 "[ . 1 . 2]" 1
679 1 63 SER HB3 1 65 TRP H . . 4.760 3.557 2.374 4.469 . 0 0 "[ . 1 . 2]" 1
680 1 64 ALA H 1 64 ALA MB . . 3.410 2.257 2.150 2.382 . 0 0 "[ . 1 . 2]" 1
681 1 64 ALA H 1 65 TRP H . . 4.350 2.104 1.882 2.701 . 0 0 "[ . 1 . 2]" 1
682 1 64 ALA HA 1 99 ASN HA . . 4.420 3.229 2.013 3.875 . 0 0 "[ . 1 . 2]" 1
683 1 64 ALA MB 1 65 TRP H . . 3.720 2.716 1.916 3.238 . 0 0 "[ . 1 . 2]" 1
684 1 64 ALA MB 1 65 TRP HA . . 4.790 4.329 4.066 4.425 . 0 0 "[ . 1 . 2]" 1
685 1 64 ALA MB 1 65 TRP HB3 . . 4.970 4.864 4.725 5.000 0.030 4 0 "[ . 1 . 2]" 1
686 1 64 ALA MB 1 65 TRP HE3 . . 4.020 2.442 2.182 2.823 . 0 0 "[ . 1 . 2]" 1
687 1 64 ALA MB 1 65 TRP HH2 . . 3.840 3.153 2.856 3.857 0.017 4 0 "[ . 1 . 2]" 1
688 1 64 ALA MB 1 65 TRP HZ2 . . 4.520 3.409 3.070 4.382 . 0 0 "[ . 1 . 2]" 1
689 1 64 ALA MB 1 146 TYR HA . . 3.970 3.661 3.201 3.963 . 0 0 "[ . 1 . 2]" 1
690 1 64 ALA MB 1 146 TYR QD . . 3.860 3.280 2.450 3.923 0.063 13 0 "[ . 1 . 2]" 1
691 1 64 ALA MB 1 149 GLN H . . 5.500 5.028 4.633 5.453 . 0 0 "[ . 1 . 2]" 1
692 1 65 TRP H 1 65 TRP HB3 . . 4.140 3.965 3.797 4.026 . 0 0 "[ . 1 . 2]" 1
693 1 65 TRP H 1 65 TRP HE3 . . 4.380 2.890 2.115 3.830 . 0 0 "[ . 1 . 2]" 1
694 1 65 TRP HA 1 65 TRP HD1 . . 4.680 3.327 2.815 3.545 . 0 0 "[ . 1 . 2]" 1
695 1 65 TRP HA 1 65 TRP HE1 . . 5.500 5.383 4.968 5.543 0.043 1 0 "[ . 1 . 2]" 1
696 1 65 TRP HA 1 100 SER H . . 4.070 2.262 1.938 3.403 . 0 0 "[ . 1 . 2]" 1
697 1 65 TRP HA 1 102 ILE MD . . 4.680 4.003 3.285 4.705 0.025 14 0 "[ . 1 . 2]" 1
698 1 65 TRP HB3 1 66 THR H . . 4.230 2.561 2.260 2.876 . 0 0 "[ . 1 . 2]" 1
699 1 65 TRP HB3 1 67 ILE MD . . 4.620 4.179 3.561 4.617 . 0 0 "[ . 1 . 2]" 1
700 1 65 TRP HB3 1 102 ILE MD . . 4.110 2.963 1.950 3.738 . 0 0 "[ . 1 . 2]" 1
701 1 65 TRP HB3 1 102 ILE MG . . 4.670 4.197 3.863 4.678 0.008 13 0 "[ . 1 . 2]" 1
702 1 65 TRP HB3 1 141 PHE HZ . . 4.890 4.639 3.945 4.915 0.025 12 0 "[ . 1 . 2]" 1
703 1 65 TRP HD1 1 100 SER H . . 5.200 4.541 4.014 5.076 . 0 0 "[ . 1 . 2]" 1
704 1 65 TRP HD1 1 100 SER HB3 . . 4.270 2.219 1.978 3.047 . 0 0 "[ . 1 . 2]" 1
705 1 65 TRP HD1 1 102 ILE MD . . 3.620 2.591 1.965 3.116 . 0 0 "[ . 1 . 2]" 1
706 1 65 TRP HD1 1 102 ILE MG . . 5.500 5.252 4.615 5.518 0.018 7 0 "[ . 1 . 2]" 1
707 1 65 TRP HD1 1 140 ILE MG . . 4.410 2.815 2.410 3.438 . 0 0 "[ . 1 . 2]" 1
708 1 65 TRP HE1 1 100 SER HB3 . . 4.430 4.224 3.655 4.463 0.033 9 0 "[ . 1 . 2]" 1
709 1 65 TRP HE1 1 102 ILE MD . . 4.750 4.374 3.608 4.750 0.000 16 0 "[ . 1 . 2]" 1
710 1 65 TRP HE1 1 140 ILE MG . . 3.720 3.226 2.935 3.547 . 0 0 "[ . 1 . 2]" 1
711 1 65 TRP HE1 1 141 PHE HA . . 4.940 4.357 4.019 4.944 0.004 3 0 "[ . 1 . 2]" 1
712 1 65 TRP HE1 1 145 VAL MG1 . . 4.860 2.382 1.867 3.003 . 0 0 "[ . 1 . 2]" 1
713 1 65 TRP HE1 1 145 VAL QG . . 3.740 2.370 1.864 2.976 . 0 0 "[ . 1 . 2]" 1
714 1 65 TRP HE1 1 145 VAL MG2 . . 4.860 4.388 4.018 4.879 0.019 8 0 "[ . 1 . 2]" 1
715 1 65 TRP HZ2 1 145 VAL HB . . 4.790 2.970 2.461 3.495 . 0 0 "[ . 1 . 2]" 1
716 1 65 TRP HZ2 1 145 VAL QG . . 3.360 1.833 1.762 1.914 . 0 0 "[ . 1 . 2]" 1
717 1 66 THR H 1 66 THR HB . . 3.850 3.751 3.444 3.887 0.037 13 0 "[ . 1 . 2]" 1
718 1 66 THR H 1 66 THR MG . . 3.520 3.069 2.421 3.359 . 0 0 "[ . 1 . 2]" 1
719 1 66 THR H 1 67 ILE H . . 5.070 4.283 4.114 4.482 . 0 0 "[ . 1 . 2]" 1
720 1 66 THR H 1 100 SER H . . 4.860 4.236 3.876 4.931 0.071 16 0 "[ . 1 . 2]" 1
721 1 66 THR H 1 101 VAL HA . . 4.470 2.626 1.835 3.060 . 0 0 "[ . 1 . 2]" 1
722 1 66 THR HA 1 66 THR MG . . 3.330 2.366 2.171 3.247 . 0 0 "[ . 1 . 2]" 1
723 1 66 THR HA 1 67 ILE MD . . 4.740 3.816 3.148 4.230 . 0 0 "[ . 1 . 2]" 1
724 1 66 THR HA 1 101 VAL QG . . 5.440 5.041 4.673 5.232 . 0 0 "[ . 1 . 2]" 1
725 1 66 THR HB 1 68 LEU QD . . 4.920 2.875 2.485 4.344 . 0 0 "[ . 1 . 2]" 1
726 1 66 THR HB 1 101 VAL HA . . 4.390 4.104 3.811 4.381 . 0 0 "[ . 1 . 2]" 1
727 1 66 THR HB 1 101 VAL QG . . 4.160 3.819 3.552 4.209 0.049 7 0 "[ . 1 . 2]" 1
728 1 66 THR MG 1 67 ILE H . . 4.040 3.974 3.613 4.186 0.146 16 0 "[ . 1 . 2]" 1
729 1 66 THR MG 1 100 SER H . . 4.630 3.600 2.988 4.043 . 0 0 "[ . 1 . 2]" 1
730 1 67 ILE H 1 67 ILE MD . . 3.850 3.034 2.204 3.608 . 0 0 "[ . 1 . 2]" 1
731 1 67 ILE H 1 67 ILE MG . . 4.250 3.651 3.362 3.841 . 0 0 "[ . 1 . 2]" 1
732 1 67 ILE HA 1 67 ILE MD . . 3.540 2.334 1.955 3.040 . 0 0 "[ . 1 . 2]" 1
733 1 67 ILE HA 1 67 ILE MG . . 3.440 2.429 2.180 2.787 . 0 0 "[ . 1 . 2]" 1
734 1 67 ILE HA 1 68 LEU QD . . 4.410 3.522 2.463 4.410 0.000 12 0 "[ . 1 . 2]" 1
735 1 67 ILE HA 1 102 ILE H . . 4.460 3.689 3.420 3.902 . 0 0 "[ . 1 . 2]" 1
736 1 67 ILE HA 1 102 ILE HB . . 4.630 3.917 2.855 4.454 . 0 0 "[ . 1 . 2]" 1
737 1 67 ILE HA 1 102 ILE MG . . 4.290 3.369 2.404 4.306 0.016 13 0 "[ . 1 . 2]" 1
738 1 67 ILE HB 1 67 ILE MD . . 3.360 2.811 2.020 3.203 . 0 0 "[ . 1 . 2]" 1
739 1 67 ILE MD 1 67 ILE MG . . 3.310 2.416 1.881 3.227 . 0 0 "[ . 1 . 2]" 1
740 1 67 ILE MD 1 68 LEU H . . 4.980 4.036 3.468 4.826 . 0 0 "[ . 1 . 2]" 1
741 1 67 ILE MD 1 104 MET ME . . 4.300 3.819 3.340 4.228 . 0 0 "[ . 1 . 2]" 1
742 1 67 ILE MD 1 126 LEU QD . . 3.780 3.435 3.025 3.788 0.008 6 0 "[ . 1 . 2]" 1
743 1 67 ILE MD 1 141 PHE QE . . 3.510 3.116 2.859 3.467 . 0 0 "[ . 1 . 2]" 1
744 1 67 ILE MD 1 141 PHE HZ . . 3.350 2.379 1.929 2.832 . 0 0 "[ . 1 . 2]" 1
745 1 67 ILE MG 1 68 LEU H . . 3.820 2.565 2.060 3.501 . 0 0 "[ . 1 . 2]" 1
746 1 67 ILE MG 1 102 ILE H . . 5.500 5.483 5.302 5.567 0.067 19 0 "[ . 1 . 2]" 1
747 1 67 ILE MG 1 104 MET H . . 4.330 2.721 2.335 3.189 . 0 0 "[ . 1 . 2]" 1
748 1 67 ILE MG 1 104 MET HA . . 4.710 4.139 3.843 4.530 . 0 0 "[ . 1 . 2]" 1
749 1 67 ILE MG 1 104 MET HG3 . . 4.140 3.909 3.453 4.155 0.015 17 0 "[ . 1 . 2]" 1
750 1 68 LEU H 1 68 LEU HB3 . . 4.170 3.676 3.214 3.854 . 0 0 "[ . 1 . 2]" 1
751 1 68 LEU H 1 68 LEU MD1 . . 4.650 4.038 2.100 4.411 . 0 0 "[ . 1 . 2]" 1
752 1 68 LEU H 1 68 LEU QD . . 4.000 2.950 2.001 3.575 . 0 0 "[ . 1 . 2]" 1
753 1 68 LEU H 1 68 LEU MD2 . . 4.650 3.150 2.019 4.001 . 0 0 "[ . 1 . 2]" 1
754 1 68 LEU H 1 101 VAL QG . . 5.330 4.755 4.188 5.195 . 0 0 "[ . 1 . 2]" 1
755 1 68 LEU H 1 103 PRO HA . . 4.460 2.374 1.941 2.830 . 0 0 "[ . 1 . 2]" 1
756 1 68 LEU H 1 104 MET H . . 4.270 2.123 1.876 2.904 . 0 0 "[ . 1 . 2]" 1
757 1 68 LEU HA 1 68 LEU MD1 . . 4.460 3.152 1.953 3.994 . 0 0 "[ . 1 . 2]" 1
758 1 68 LEU HA 1 68 LEU QD . . 3.590 2.006 1.876 2.662 . 0 0 "[ . 1 . 2]" 1
759 1 68 LEU HA 1 68 LEU MD2 . . 4.460 2.276 1.881 3.851 . 0 0 "[ . 1 . 2]" 1
760 1 68 LEU HB3 1 69 LEU H . . 4.290 4.009 3.709 4.259 . 0 0 "[ . 1 . 2]" 1
761 1 68 LEU QD 1 69 LEU H . . 4.330 3.687 3.272 4.294 . 0 0 "[ . 1 . 2]" 1
762 1 68 LEU QD 1 74 PHE QE . . 3.790 2.829 1.805 3.790 0.000 4 0 "[ . 1 . 2]" 1
763 1 68 LEU QD 1 101 VAL HA . . 4.830 3.585 2.798 4.492 . 0 0 "[ . 1 . 2]" 1
764 1 68 LEU QD 1 103 PRO HA . . 3.760 3.348 1.955 3.786 0.026 12 0 "[ . 1 . 2]" 1
765 1 68 LEU QD 1 120 LEU QD . . 3.720 2.790 1.770 3.724 0.004 20 0 "[ . 1 . 2]" 1
766 1 68 LEU MD1 1 103 PRO HA . . 4.740 3.917 2.886 4.741 0.001 13 0 "[ . 1 . 2]" 1
767 1 68 LEU MD2 1 103 PRO HA . . 4.740 3.992 1.959 4.675 . 0 0 "[ . 1 . 2]" 1
768 1 68 LEU HG 1 101 VAL MG1 . . 4.960 2.953 1.945 4.890 . 0 0 "[ . 1 . 2]" 1
769 1 68 LEU HG 1 101 VAL QG . . 3.480 2.764 1.943 3.506 0.026 6 0 "[ . 1 . 2]" 1
770 1 68 LEU HG 1 101 VAL MG2 . . 4.960 4.441 2.980 4.981 0.021 1 0 "[ . 1 . 2]" 1
771 1 69 LEU H 1 69 LEU MD1 . . 4.120 2.849 2.290 4.098 . 0 0 "[ . 1 . 2]" 1
772 1 69 LEU H 1 69 LEU QD . . 3.590 2.593 2.148 3.190 . 0 0 "[ . 1 . 2]" 1
773 1 69 LEU H 1 69 LEU MD2 . . 4.120 3.479 2.156 3.992 . 0 0 "[ . 1 . 2]" 1
774 1 69 LEU H 1 70 LEU H . . 4.390 4.265 4.163 4.402 0.012 19 0 "[ . 1 . 2]" 1
775 1 69 LEU H 1 70 LEU QD . . 5.380 4.690 4.113 5.362 . 0 0 "[ . 1 . 2]" 1
776 1 69 LEU H 1 74 PHE QE . . 4.550 3.551 2.827 4.386 . 0 0 "[ . 1 . 2]" 1
777 1 69 LEU HA 1 69 LEU MD1 . . 4.000 1.963 1.869 2.467 . 0 0 "[ . 1 . 2]" 1
778 1 69 LEU HA 1 69 LEU QD . . 2.990 1.906 1.865 1.995 . 0 0 "[ . 1 . 2]" 1
779 1 69 LEU HA 1 69 LEU MD2 . . 4.000 3.573 1.978 3.776 . 0 0 "[ . 1 . 2]" 1
780 1 69 LEU HA 1 69 LEU HG . . 4.150 2.928 2.780 3.696 . 0 0 "[ . 1 . 2]" 1
781 1 69 LEU HA 1 70 LEU QD . . 5.030 4.199 3.644 4.881 . 0 0 "[ . 1 . 2]" 1
782 1 69 LEU QD 1 70 LEU H . . 3.740 3.539 3.247 3.685 . 0 0 "[ . 1 . 2]" 1
783 1 69 LEU QD 1 104 MET H . . 4.520 3.800 3.530 4.198 . 0 0 "[ . 1 . 2]" 1
784 1 69 LEU QD 1 104 MET HB3 . . 3.140 2.515 2.021 3.101 . 0 0 "[ . 1 . 2]" 1
785 1 69 LEU QD 1 105 ARG HA . . 4.470 4.238 3.842 4.493 0.023 6 0 "[ . 1 . 2]" 1
786 1 70 LEU H 1 70 LEU HB3 . . 4.160 3.287 2.838 3.557 . 0 0 "[ . 1 . 2]" 1
787 1 70 LEU H 1 70 LEU MD1 . . 4.200 3.305 2.520 3.943 . 0 0 "[ . 1 . 2]" 1
788 1 70 LEU H 1 70 LEU QD . . 3.550 2.802 2.183 3.344 . 0 0 "[ . 1 . 2]" 1
789 1 70 LEU H 1 70 LEU MD2 . . 4.200 3.334 2.203 4.063 . 0 0 "[ . 1 . 2]" 1
790 1 70 LEU H 1 70 LEU HG . . 4.740 3.890 2.143 4.560 . 0 0 "[ . 1 . 2]" 1
791 1 70 LEU H 1 104 MET HB3 . . 4.730 4.547 4.217 4.769 0.039 4 0 "[ . 1 . 2]" 1
792 1 70 LEU H 1 106 PRO HD3 . . 4.500 2.791 2.455 3.191 . 0 0 "[ . 1 . 2]" 1
793 1 70 LEU HA 1 70 LEU MD1 . . 4.060 2.364 1.819 3.847 . 0 0 "[ . 1 . 2]" 1
794 1 70 LEU HA 1 70 LEU QD . . 3.100 1.895 1.808 1.961 . 0 0 "[ . 1 . 2]" 1
795 1 70 LEU HA 1 70 LEU MD2 . . 4.060 3.153 1.905 3.748 . 0 0 "[ . 1 . 2]" 1
796 1 70 LEU HB3 1 70 LEU MD1 . . 3.420 2.835 2.158 3.210 . 0 0 "[ . 1 . 2]" 1
797 1 70 LEU HB3 1 70 LEU MD2 . . 3.420 2.649 2.433 3.163 . 0 0 "[ . 1 . 2]" 1
798 1 70 LEU QD 1 71 THR H . . 4.160 3.355 2.867 3.687 . 0 0 "[ . 1 . 2]" 1
799 1 70 LEU QD 1 74 PHE QD . . 3.420 3.254 2.920 3.423 0.003 13 0 "[ . 1 . 2]" 1
800 1 70 LEU QD 1 74 PHE QE . . 3.760 3.523 2.947 3.767 0.007 16 0 "[ . 1 . 2]" 1
801 1 70 LEU QD 1 75 LEU HA . . 4.510 3.656 2.990 4.363 . 0 0 "[ . 1 . 2]" 1
802 1 70 LEU QD 1 75 LEU QD . . 3.650 2.909 2.411 3.555 . 0 0 "[ . 1 . 2]" 1
803 1 70 LEU QD 1 103 PRO HA . . 4.090 3.470 2.757 4.058 . 0 0 "[ . 1 . 2]" 1
804 1 70 LEU QD 1 104 MET H . . 4.730 4.078 3.236 4.656 . 0 0 "[ . 1 . 2]" 1
805 1 70 LEU QD 1 111 LEU QD . . 3.830 2.791 2.058 3.463 . 0 0 "[ . 1 . 2]" 1
806 1 70 LEU QD 1 116 THR HA . . 3.950 3.371 3.072 3.737 . 0 0 "[ . 1 . 2]" 1
807 1 70 LEU QD 1 116 THR MG . . 3.240 2.014 1.699 2.837 . 0 0 "[ . 1 . 2]" 1
808 1 70 LEU QD 1 117 PRO HG3 . . 3.800 3.581 2.771 3.835 0.035 5 0 "[ . 1 . 2]" 1
809 1 70 LEU QD 1 120 LEU QD . . 3.480 1.900 1.726 2.230 . 0 0 "[ . 1 . 2]" 1
810 1 70 LEU QD 1 125 ALA HA . . 5.440 5.137 4.592 5.456 0.016 6 0 "[ . 1 . 2]" 1
811 1 70 LEU QD 1 125 ALA MB . . 4.080 3.420 3.118 3.769 . 0 0 "[ . 1 . 2]" 1
812 1 70 LEU MD1 1 71 THR H . . 5.420 3.809 2.889 5.346 . 0 0 "[ . 1 . 2]" 1
813 1 70 LEU MD1 1 103 PRO HA . . 4.740 4.177 3.306 4.838 0.098 10 0 "[ . 1 . 2]" 1
814 1 70 LEU MD1 1 104 MET H . . 5.410 4.896 4.044 5.460 0.050 19 0 "[ . 1 . 2]" 1
815 1 70 LEU MD1 1 116 THR HA . . 4.560 3.956 3.118 4.568 0.008 12 0 "[ . 1 . 2]" 1
816 1 70 LEU MD1 1 116 THR MG . . 3.920 3.034 1.777 3.785 . 0 0 "[ . 1 . 2]" 1
817 1 70 LEU MD2 1 71 THR H . . 5.420 4.774 3.473 5.400 . 0 0 "[ . 1 . 2]" 1
818 1 70 LEU MD2 1 103 PRO HA . . 4.740 3.931 2.775 4.754 0.014 12 0 "[ . 1 . 2]" 1
819 1 70 LEU MD2 1 104 MET H . . 5.410 4.554 3.260 5.334 . 0 0 "[ . 1 . 2]" 1
820 1 70 LEU MD2 1 116 THR HA . . 4.560 3.991 3.290 4.620 0.060 10 0 "[ . 1 . 2]" 1
821 1 70 LEU MD2 1 116 THR MG . . 3.920 2.510 1.705 3.935 0.015 7 0 "[ . 1 . 2]" 1
822 1 70 LEU HG 1 71 THR H . . 5.410 4.679 3.997 5.440 0.030 1 0 "[ . 1 . 2]" 1
823 1 71 THR H 1 71 THR MG . . 4.200 3.924 3.873 3.963 . 0 0 "[ . 1 . 2]" 1
824 1 71 THR HA 1 71 THR MG . . 2.770 2.196 2.102 2.346 . 0 0 "[ . 1 . 2]" 1
825 1 71 THR HA 1 111 LEU QD . . 4.050 2.530 2.162 3.001 . 0 0 "[ . 1 . 2]" 1
826 1 71 THR MG 1 72 GLU H . . 4.090 2.076 1.826 2.603 . 0 0 "[ . 1 . 2]" 1
827 1 71 THR MG 1 73 ASN H . . 3.630 2.426 2.194 2.568 . 0 0 "[ . 1 . 2]" 1
828 1 71 THR MG 1 73 ASN HA . . 5.020 4.957 4.780 5.041 0.021 1 0 "[ . 1 . 2]" 1
829 1 71 THR MG 1 73 ASN HB3 . . 5.010 4.257 3.860 4.493 . 0 0 "[ . 1 . 2]" 1
830 1 71 THR MG 1 73 ASN HD21 . . 4.550 3.363 1.973 4.505 . 0 0 "[ . 1 . 2]" 1
831 1 71 THR MG 1 73 ASN HD22 . . 3.670 2.663 1.770 3.495 . 0 0 "[ . 1 . 2]" 1
832 1 71 THR MG 1 74 PHE H . . 3.370 3.077 2.921 3.258 . 0 0 "[ . 1 . 2]" 1
833 1 71 THR MG 1 74 PHE HB3 . . 4.260 3.772 3.726 3.886 . 0 0 "[ . 1 . 2]" 1
834 1 71 THR MG 1 109 ASN HB3 . . 3.880 2.713 1.985 3.809 . 0 0 "[ . 1 . 2]" 1
835 1 71 THR MG 1 111 LEU QD . . 3.870 3.499 3.097 3.805 . 0 0 "[ . 1 . 2]" 1
836 1 72 GLU H 1 72 GLU HG3 . . 4.500 2.297 1.939 2.795 . 0 0 "[ . 1 . 2]" 1
837 1 72 GLU H 1 73 ASN H . . 4.160 2.617 2.327 2.918 . 0 0 "[ . 1 . 2]" 1
838 1 72 GLU H 1 74 PHE H . . 4.490 4.016 3.382 4.407 . 0 0 "[ . 1 . 2]" 1
839 1 72 GLU H 1 111 LEU QD . . 4.430 2.730 1.939 3.237 . 0 0 "[ . 1 . 2]" 1
840 1 72 GLU HA 1 72 GLU HG3 . . 4.000 2.723 2.453 3.502 . 0 0 "[ . 1 . 2]" 1
841 1 72 GLU HA 1 75 LEU H . . 4.990 3.839 3.405 4.070 . 0 0 "[ . 1 . 2]" 1
842 1 72 GLU HA 1 75 LEU HB3 . . 3.980 3.233 2.852 3.710 . 0 0 "[ . 1 . 2]" 1
843 1 72 GLU HA 1 111 LEU MD1 . . 4.640 4.534 3.566 4.643 0.003 14 0 "[ . 1 . 2]" 1
844 1 72 GLU HA 1 111 LEU QD . . 3.120 2.573 1.955 3.095 . 0 0 "[ . 1 . 2]" 1
845 1 72 GLU HA 1 111 LEU MD2 . . 4.640 2.589 1.964 3.148 . 0 0 "[ . 1 . 2]" 1
846 1 72 GLU HB3 1 73 ASN H . . 4.380 3.860 3.618 4.071 . 0 0 "[ . 1 . 2]" 1
847 1 73 ASN H 1 73 ASN HB3 . . 3.940 2.790 2.538 2.941 . 0 0 "[ . 1 . 2]" 1
848 1 73 ASN H 1 73 ASN HD21 . . 4.010 3.113 1.901 3.998 . 0 0 "[ . 1 . 2]" 1
849 1 73 ASN H 1 74 PHE H . . 4.060 2.339 2.204 2.546 . 0 0 "[ . 1 . 2]" 1
850 1 73 ASN H 1 75 LEU H . . 4.350 3.654 3.490 4.000 . 0 0 "[ . 1 . 2]" 1
851 1 73 ASN H 1 111 LEU QD . . 4.840 4.618 4.083 4.843 0.003 10 0 "[ . 1 . 2]" 1
852 1 73 ASN HA 1 73 ASN HD21 . . 4.380 4.118 3.741 4.291 . 0 0 "[ . 1 . 2]" 1
853 1 74 PHE HA 1 74 PHE QD . . 3.980 3.030 2.645 3.252 . 0 0 "[ . 1 . 2]" 1
854 1 74 PHE QD 1 75 LEU H . . 4.220 3.853 3.060 4.160 . 0 0 "[ . 1 . 2]" 1
855 1 74 PHE QD 1 78 THR HB . . 4.980 4.685 3.831 4.985 0.005 11 0 "[ . 1 . 2]" 1
856 1 74 PHE QD 1 78 THR MG . . 4.190 3.094 2.446 3.769 . 0 0 "[ . 1 . 2]" 1
857 1 74 PHE QE 1 78 THR MG . . 3.420 2.475 1.977 3.379 . 0 0 "[ . 1 . 2]" 1
858 1 75 LEU H 1 75 LEU HB3 . . 4.090 2.367 2.284 2.532 . 0 0 "[ . 1 . 2]" 1
859 1 75 LEU H 1 75 LEU MD1 . . 4.250 3.962 3.871 4.138 . 0 0 "[ . 1 . 2]" 1
860 1 75 LEU H 1 75 LEU MD2 . . 4.250 4.069 3.995 4.129 . 0 0 "[ . 1 . 2]" 1
861 1 75 LEU H 1 75 LEU HG . . 4.890 4.537 4.522 4.623 . 0 0 "[ . 1 . 2]" 1
862 1 75 LEU H 1 76 ARG H . . 4.100 2.920 2.437 3.084 . 0 0 "[ . 1 . 2]" 1
863 1 75 LEU HA 1 75 LEU MD1 . . 3.330 3.167 2.998 3.334 0.004 15 0 "[ . 1 . 2]" 1
864 1 75 LEU HA 1 75 LEU QD . . 2.790 1.955 1.898 1.997 . 0 0 "[ . 1 . 2]" 1
865 1 75 LEU HA 1 75 LEU MD2 . . 3.330 1.975 1.916 2.024 . 0 0 "[ . 1 . 2]" 1
866 1 75 LEU HA 1 75 LEU HG . . 4.000 3.777 3.650 3.824 . 0 0 "[ . 1 . 2]" 1
867 1 75 LEU HA 1 79 TRP H . . 4.210 3.542 3.045 4.221 0.011 19 0 "[ . 1 . 2]" 1
868 1 75 LEU HB3 1 75 LEU MD1 . . 3.290 2.246 2.165 2.311 . 0 0 "[ . 1 . 2]" 1
869 1 75 LEU HB3 1 75 LEU MD2 . . 3.290 3.214 3.206 3.221 . 0 0 "[ . 1 . 2]" 1
870 1 75 LEU HB3 1 76 ARG H . . 3.870 2.258 2.130 2.504 . 0 0 "[ . 1 . 2]" 1
871 1 75 LEU QD 1 76 ARG H . . 3.620 2.275 1.968 2.829 . 0 0 "[ . 1 . 2]" 1
872 1 75 LEU QD 1 76 ARG HA . . 4.370 2.338 2.111 2.633 . 0 0 "[ . 1 . 2]" 1
873 1 75 LEU QD 1 77 ASP H . . 4.690 3.883 3.743 4.110 . 0 0 "[ . 1 . 2]" 1
874 1 75 LEU QD 1 79 TRP HA . . 4.060 3.780 3.485 4.062 0.002 12 0 "[ . 1 . 2]" 1
875 1 75 LEU QD 1 79 TRP HD1 . . 3.590 2.930 2.420 3.430 . 0 0 "[ . 1 . 2]" 1
876 1 75 LEU QD 1 79 TRP HE1 . . 4.280 4.085 3.630 4.291 0.011 7 0 "[ . 1 . 2]" 1
877 1 75 LEU QD 1 79 TRP HZ2 . . 5.440 4.920 4.606 5.206 . 0 0 "[ . 1 . 2]" 1
878 1 75 LEU QD 1 80 CYS H . . 4.730 4.236 3.764 4.624 . 0 0 "[ . 1 . 2]" 1
879 1 75 LEU QD 1 116 THR H . . 5.440 5.167 4.474 5.448 0.008 20 0 "[ . 1 . 2]" 1
880 1 75 LEU QD 1 117 PRO HD3 . . 3.490 2.466 1.952 2.866 . 0 0 "[ . 1 . 2]" 1
881 1 75 LEU MD1 1 76 ARG H . . 4.260 2.288 1.973 2.875 . 0 0 "[ . 1 . 2]" 1
882 1 75 LEU MD1 1 79 TRP HA . . 4.870 4.434 4.284 4.871 0.001 16 0 "[ . 1 . 2]" 1
883 1 75 LEU MD1 1 79 TRP HB3 . . 4.300 2.413 1.973 3.251 . 0 0 "[ . 1 . 2]" 1
884 1 75 LEU MD1 1 79 TRP HD1 . . 4.320 3.018 2.459 3.596 . 0 0 "[ . 1 . 2]" 1
885 1 75 LEU MD1 1 79 TRP HE1 . . 4.880 4.471 3.740 4.787 . 0 0 "[ . 1 . 2]" 1
886 1 75 LEU MD2 1 76 ARG H . . 4.260 4.137 3.914 4.267 0.007 9 0 "[ . 1 . 2]" 1
887 1 75 LEU MD2 1 79 TRP HA . . 4.870 4.127 3.621 4.661 . 0 0 "[ . 1 . 2]" 1
888 1 75 LEU MD2 1 79 TRP HB3 . . 4.300 3.545 2.931 3.988 . 0 0 "[ . 1 . 2]" 1
889 1 75 LEU MD2 1 79 TRP HD1 . . 4.320 4.046 3.282 4.330 0.010 16 0 "[ . 1 . 2]" 1
890 1 75 LEU MD2 1 79 TRP HE1 . . 4.880 4.759 4.185 4.905 0.025 1 0 "[ . 1 . 2]" 1
891 1 76 ARG H 1 76 ARG HD3 . . 5.160 3.829 1.933 4.791 . 0 0 "[ . 1 . 2]" 1
892 1 76 ARG H 1 77 ASP H . . 3.740 2.714 2.609 2.841 . 0 0 "[ . 1 . 2]" 1
893 1 76 ARG HA 1 76 ARG HD3 . . 4.260 3.249 2.004 4.162 . 0 0 "[ . 1 . 2]" 1
894 1 77 ASP H 1 78 THR H . . 3.710 2.703 2.299 2.927 . 0 0 "[ . 1 . 2]" 1
895 1 77 ASP H 1 78 THR MG . . 5.290 4.455 3.771 4.836 . 0 0 "[ . 1 . 2]" 1
896 1 78 THR H 1 78 THR MG . . 4.040 2.489 1.879 2.861 . 0 0 "[ . 1 . 2]" 1
897 1 78 THR H 1 80 CYS H . . 4.440 3.924 3.664 4.396 . 0 0 "[ . 1 . 2]" 1
898 1 78 THR HA 1 78 THR MG . . 3.430 2.518 2.197 3.156 . 0 0 "[ . 1 . 2]" 1
899 1 78 THR HA 1 81 ASN H . . 4.510 2.948 2.678 3.316 . 0 0 "[ . 1 . 2]" 1
900 1 79 TRP H 1 80 CYS H . . 4.330 2.682 2.053 3.023 . 0 0 "[ . 1 . 2]" 1
901 1 79 TRP HE1 1 117 PRO HA . . 5.490 5.350 4.949 5.498 0.008 5 0 "[ . 1 . 2]" 1
902 1 79 TRP HE3 1 120 LEU QD . . 5.420 3.269 2.771 3.932 . 0 0 "[ . 1 . 2]" 1
903 1 79 TRP HH2 1 89 MET ME . . 3.280 3.014 2.539 3.286 0.006 5 0 "[ . 1 . 2]" 1
904 1 79 TRP HH2 1 92 VAL MG1 . . 5.470 4.192 3.058 5.042 . 0 0 "[ . 1 . 2]" 1
905 1 79 TRP HH2 1 92 VAL QG . . 4.380 3.876 2.976 4.389 0.009 11 0 "[ . 1 . 2]" 1
906 1 79 TRP HH2 1 92 VAL MG2 . . 5.470 4.686 4.083 5.255 . 0 0 "[ . 1 . 2]" 1
907 1 79 TRP HH2 1 119 ALA MB . . 3.660 2.453 1.936 3.099 . 0 0 "[ . 1 . 2]" 1
908 1 79 TRP HH2 1 120 LEU QD . . 4.390 4.071 3.314 4.404 0.014 9 0 "[ . 1 . 2]" 1
909 1 79 TRP HZ2 1 89 MET ME . . 4.860 4.605 4.143 4.863 0.003 11 0 "[ . 1 . 2]" 1
910 1 79 TRP HZ3 1 92 VAL MG1 . . 4.750 3.578 2.578 4.511 . 0 0 "[ . 1 . 2]" 1
911 1 79 TRP HZ3 1 92 VAL MG2 . . 4.750 3.719 2.518 4.762 0.012 19 0 "[ . 1 . 2]" 1
912 1 79 TRP HZ3 1 119 ALA MB . . 4.530 3.528 2.797 4.155 . 0 0 "[ . 1 . 2]" 1
913 1 79 TRP HZ3 1 120 LEU MD1 . . 4.450 2.851 2.141 3.399 . 0 0 "[ . 1 . 2]" 1
914 1 79 TRP HZ3 1 120 LEU QD . . 3.790 2.756 2.120 3.111 . 0 0 "[ . 1 . 2]" 1
915 1 79 TRP HZ3 1 120 LEU MD2 . . 4.450 3.755 3.273 4.088 . 0 0 "[ . 1 . 2]" 1
916 1 80 CYS H 1 80 CYS HB3 . . 4.130 2.479 2.300 2.886 . 0 0 "[ . 1 . 2]" 1
917 1 80 CYS H 1 81 ASN H . . 3.890 2.469 2.079 2.866 . 0 0 "[ . 1 . 2]" 1
918 1 80 CYS H 1 82 PHE H . . 4.460 3.906 3.506 4.476 0.016 20 0 "[ . 1 . 2]" 1
919 1 81 ASN H 1 81 ASN HB3 . . 3.960 3.116 2.187 3.554 . 0 0 "[ . 1 . 2]" 1
920 1 81 ASN H 1 82 PHE H . . 4.160 2.703 2.436 2.998 . 0 0 "[ . 1 . 2]" 1
921 1 82 PHE H 1 82 PHE QD . . 4.210 2.413 2.013 2.810 . 0 0 "[ . 1 . 2]" 1
922 1 82 PHE H 1 83 GLN H . . 4.460 2.704 2.345 3.193 . 0 0 "[ . 1 . 2]" 1
923 1 82 PHE HA 1 82 PHE QE . . 4.640 4.389 4.237 4.615 . 0 0 "[ . 1 . 2]" 1
924 1 82 PHE HA 1 88 LEU QD . . 4.770 3.856 2.212 4.549 . 0 0 "[ . 1 . 2]" 1
925 1 82 PHE QD 1 89 MET ME . . 4.270 2.117 1.789 2.978 . 0 0 "[ . 1 . 2]" 1
926 1 82 PHE QE 1 89 MET ME . . 4.080 3.168 1.843 3.971 . 0 0 "[ . 1 . 2]" 1
927 1 82 PHE QE 1 92 VAL MG1 . . 4.710 3.794 2.224 4.684 . 0 0 "[ . 1 . 2]" 1
928 1 82 PHE QE 1 92 VAL QG . . 3.480 2.662 1.844 3.197 . 0 0 "[ . 1 . 2]" 1
929 1 82 PHE QE 1 92 VAL MG2 . . 4.710 3.202 1.849 4.715 0.005 2 0 "[ . 1 . 2]" 1
930 1 82 PHE QE 1 120 LEU MD1 . . 4.200 3.275 2.594 4.189 . 0 0 "[ . 1 . 2]" 1
931 1 82 PHE QE 1 120 LEU MD2 . . 4.200 3.398 2.472 4.057 . 0 0 "[ . 1 . 2]" 1
932 1 83 GLN H 1 83 GLN HB3 . . 4.000 2.782 2.378 3.543 . 0 0 "[ . 1 . 2]" 1
933 1 83 GLN H 1 83 GLN HG3 . . 4.830 4.183 2.197 4.542 . 0 0 "[ . 1 . 2]" 1
934 1 83 GLN H 1 84 PHE H . . 4.470 2.821 2.303 3.046 . 0 0 "[ . 1 . 2]" 1
935 1 84 PHE H 1 84 PHE QD . . 4.280 3.845 2.324 4.161 . 0 0 "[ . 1 . 2]" 1
936 1 84 PHE H 1 85 TYR H . . 3.820 2.392 2.156 2.732 . 0 0 "[ . 1 . 2]" 1
937 1 84 PHE HA 1 84 PHE QD . . 3.560 2.560 1.998 3.580 0.020 5 0 "[ . 1 . 2]" 1
938 1 84 PHE QD 1 85 TYR H . . 4.470 4.240 3.363 4.467 . 0 0 "[ . 1 . 2]" 1
939 1 85 TYR H 1 85 TYR HB3 . . 4.050 3.162 2.716 3.664 . 0 0 "[ . 1 . 2]" 1
940 1 85 TYR H 1 86 THR HB . . 5.500 5.331 4.673 5.505 0.005 10 0 "[ . 1 . 2]" 1
941 1 85 TYR QD 1 88 LEU QD . . 4.980 3.571 1.930 4.970 . 0 0 "[ . 1 . 2]" 1
942 1 85 TYR QE 1 88 LEU QD . . 5.300 4.485 2.666 5.304 0.004 18 0 "[ . 1 . 2]" 1
943 1 86 THR H 1 86 THR HB . . 3.720 2.183 2.022 2.443 . 0 0 "[ . 1 . 2]" 1
944 1 86 THR H 1 86 THR MG . . 3.550 2.708 2.271 3.546 . 0 0 "[ . 1 . 2]" 1
945 1 86 THR HA 1 86 THR MG . . 3.360 3.110 2.686 3.224 . 0 0 "[ . 1 . 2]" 1
946 1 86 THR HA 1 89 MET H . . 4.370 2.855 2.500 3.724 . 0 0 "[ . 1 . 2]" 1
947 1 86 THR HA 1 90 ASN H . . 4.820 4.564 4.322 4.830 0.010 16 0 "[ . 1 . 2]" 1
948 1 86 THR HB 1 87 SER H . . 4.250 4.021 3.449 4.251 0.001 13 0 "[ . 1 . 2]" 1
949 1 86 THR MG 1 87 SER H . . 3.860 2.924 2.331 3.754 . 0 0 "[ . 1 . 2]" 1
950 1 86 THR MG 1 90 ASN HD21 . . 3.900 3.450 2.317 3.901 0.001 4 0 "[ . 1 . 2]" 1
951 1 86 THR MG 1 90 ASN QD . . 3.280 2.575 1.881 3.053 . 0 0 "[ . 1 . 2]" 1
952 1 86 THR MG 1 90 ASN HD22 . . 3.900 2.755 1.972 3.888 . 0 0 "[ . 1 . 2]" 1
953 1 87 SER H 1 87 SER HB3 . . 3.870 2.839 2.191 3.563 . 0 0 "[ . 1 . 2]" 1
954 1 87 SER H 1 88 LEU H . . 4.140 2.746 2.483 3.199 . 0 0 "[ . 1 . 2]" 1
955 1 87 SER HA 1 89 MET H . . 4.640 4.460 4.120 4.644 0.004 8 0 "[ . 1 . 2]" 1
956 1 87 SER HA 1 90 ASN H . . 4.790 3.736 3.494 4.108 . 0 0 "[ . 1 . 2]" 1
957 1 87 SER HA 1 90 ASN HD21 . . 4.560 2.609 2.102 4.113 . 0 0 "[ . 1 . 2]" 1
958 1 87 SER HA 1 90 ASN QD . . 3.910 2.427 1.906 3.770 . 0 0 "[ . 1 . 2]" 1
959 1 87 SER HA 1 90 ASN HD22 . . 4.560 3.169 1.957 4.379 . 0 0 "[ . 1 . 2]" 1
960 1 88 LEU H 1 88 LEU QD . . 4.470 3.197 2.121 3.732 . 0 0 "[ . 1 . 2]" 1
961 1 88 LEU H 1 89 MET H . . 4.380 2.434 2.202 2.992 . 0 0 "[ . 1 . 2]" 1
962 1 88 LEU HA 1 88 LEU MD1 . . 4.800 2.838 1.904 3.790 . 0 0 "[ . 1 . 2]" 1
963 1 88 LEU HA 1 88 LEU QD . . 3.490 2.159 1.895 3.337 . 0 0 "[ . 1 . 2]" 1
964 1 88 LEU HA 1 88 LEU MD2 . . 4.800 2.388 1.936 4.052 . 0 0 "[ . 1 . 2]" 1
965 1 88 LEU HA 1 92 VAL QG . . 4.740 4.314 3.837 4.751 0.011 12 0 "[ . 1 . 2]" 1
966 1 88 LEU QD 1 89 MET H . . 5.010 3.748 3.153 4.105 . 0 0 "[ . 1 . 2]" 1
967 1 88 LEU QD 1 89 MET ME . . 4.700 3.791 3.069 4.707 0.007 8 0 "[ . 1 . 2]" 1
968 1 88 LEU QD 1 92 VAL QG . . 3.690 2.780 1.898 3.649 . 0 0 "[ . 1 . 2]" 1
969 1 88 LEU QD 1 101 VAL QG . . 3.240 2.614 1.698 3.207 . 0 0 "[ . 1 . 2]" 1
970 1 88 LEU MD1 1 89 MET ME . . 5.500 4.118 3.108 5.498 . 0 0 "[ . 1 . 2]" 1
971 1 88 LEU MD2 1 89 MET ME . . 5.500 5.205 3.537 5.510 0.010 1 0 "[ . 1 . 2]" 1
972 1 89 MET H 1 89 MET ME . . 4.310 3.628 3.041 4.032 . 0 0 "[ . 1 . 2]" 1
973 1 89 MET H 1 90 ASN H . . 4.270 2.750 2.579 2.961 . 0 0 "[ . 1 . 2]" 1
974 1 89 MET HA 1 89 MET ME . . 3.200 1.897 1.818 1.971 . 0 0 "[ . 1 . 2]" 1
975 1 89 MET HA 1 92 VAL MG1 . . 4.020 3.570 2.709 4.031 0.011 12 0 "[ . 1 . 2]" 1
976 1 89 MET HA 1 92 VAL MG2 . . 4.020 2.168 1.930 2.761 . 0 0 "[ . 1 . 2]" 1
977 1 89 MET ME 1 90 ASN H . . 4.930 4.802 4.574 4.938 0.008 5 0 "[ . 1 . 2]" 1
978 1 89 MET ME 1 92 VAL H . . 4.220 4.024 3.714 4.234 0.014 12 0 "[ . 1 . 2]" 1
979 1 89 MET ME 1 92 VAL HA . . 5.270 4.794 4.264 5.275 0.005 19 0 "[ . 1 . 2]" 1
980 1 89 MET ME 1 92 VAL MG1 . . 3.580 2.491 1.850 2.938 . 0 0 "[ . 1 . 2]" 1
981 1 89 MET ME 1 92 VAL QG . . 2.830 1.872 1.704 2.207 . 0 0 "[ . 1 . 2]" 1
982 1 89 MET ME 1 92 VAL MG2 . . 3.580 1.975 1.738 2.471 . 0 0 "[ . 1 . 2]" 1
983 1 89 MET ME 1 119 ALA MB . . 3.820 3.283 2.433 3.825 0.005 8 0 "[ . 1 . 2]" 1
984 1 89 MET ME 1 120 LEU QD . . 4.070 3.676 2.649 4.070 0.000 10 0 "[ . 1 . 2]" 1
985 1 90 ASN H 1 90 ASN HB3 . . 4.080 3.476 2.718 3.622 . 0 0 "[ . 1 . 2]" 1
986 1 90 ASN H 1 91 SER H . . 4.130 2.453 2.161 2.950 . 0 0 "[ . 1 . 2]" 1
987 1 90 ASN H 1 92 VAL H . . 4.660 3.850 3.585 4.258 . 0 0 "[ . 1 . 2]" 1
988 1 90 ASN H 1 92 VAL QG . . 4.760 4.184 3.602 4.763 0.003 7 0 "[ . 1 . 2]" 1
989 1 90 ASN HA 1 90 ASN QD . . 4.580 3.635 2.371 4.262 . 0 0 "[ . 1 . 2]" 1
990 1 90 ASN HA 1 93 ASN H . . 3.930 3.748 3.495 3.942 0.012 14 0 "[ . 1 . 2]" 1
991 1 90 ASN HB3 1 91 SER H . . 4.670 3.677 2.493 4.430 . 0 0 "[ . 1 . 2]" 1
992 1 91 SER H 1 92 VAL H . . 4.370 2.493 2.328 2.683 . 0 0 "[ . 1 . 2]" 1
993 1 91 SER H 1 92 VAL QG . . 4.490 3.694 3.133 4.156 . 0 0 "[ . 1 . 2]" 1
994 1 91 SER H 1 95 GLN QE . . 4.930 4.006 3.171 4.566 . 0 0 "[ . 1 . 2]" 1
995 1 91 SER H 1 101 VAL QG . . 4.460 4.079 3.772 4.404 . 0 0 "[ . 1 . 2]" 1
996 1 91 SER HA 1 92 VAL HA . . 4.970 4.838 4.751 4.900 . 0 0 "[ . 1 . 2]" 1
997 1 91 SER HA 1 95 GLN HE21 . . 4.110 2.897 1.908 4.110 0.000 14 0 "[ . 1 . 2]" 1
998 1 91 SER HA 1 95 GLN HE22 . . 4.110 3.774 2.654 4.123 0.013 15 0 "[ . 1 . 2]" 1
999 1 91 SER HA 1 101 VAL QG . . 4.330 3.436 2.957 4.158 . 0 0 "[ . 1 . 2]" 1
1000 1 91 SER HB3 1 101 VAL MG1 . . 4.530 3.974 2.287 4.564 0.034 15 0 "[ . 1 . 2]" 1
1001 1 91 SER HB3 1 101 VAL MG2 . . 4.530 2.309 1.774 4.534 0.004 16 0 "[ . 1 . 2]" 1
1002 1 91 SER HG 1 101 VAL MG1 . . 5.070 4.345 2.350 5.090 0.020 6 0 "[ . 1 . 2]" 1
1003 1 91 SER HG 1 101 VAL QG . . 4.300 2.758 1.862 3.471 . 0 0 "[ . 1 . 2]" 1
1004 1 91 SER HG 1 101 VAL MG2 . . 5.070 2.902 1.868 4.613 . 0 0 "[ . 1 . 2]" 1
1005 1 92 VAL H 1 92 VAL MG1 . . 4.000 3.274 2.044 3.701 . 0 0 "[ . 1 . 2]" 1
1006 1 92 VAL H 1 92 VAL QG . . 3.340 2.152 1.822 2.532 . 0 0 "[ . 1 . 2]" 1
1007 1 92 VAL H 1 92 VAL MG2 . . 4.000 2.210 1.876 2.585 . 0 0 "[ . 1 . 2]" 1
1008 1 92 VAL H 1 93 ASN H . . 4.070 2.637 2.454 2.753 . 0 0 "[ . 1 . 2]" 1
1009 1 92 VAL H 1 101 VAL MG1 . . 4.540 4.333 3.354 4.571 0.031 1 0 "[ . 1 . 2]" 1
1010 1 92 VAL H 1 101 VAL QG . . 3.850 3.584 3.205 3.874 0.024 6 0 "[ . 1 . 2]" 1
1011 1 92 VAL H 1 101 VAL MG2 . . 4.540 3.862 3.330 4.282 . 0 0 "[ . 1 . 2]" 1
1012 1 92 VAL HA 1 92 VAL MG1 . . 3.410 2.406 2.121 2.622 . 0 0 "[ . 1 . 2]" 1
1013 1 92 VAL HA 1 92 VAL QG . . 2.980 2.099 1.998 2.279 . 0 0 "[ . 1 . 2]" 1
1014 1 92 VAL HA 1 92 VAL MG2 . . 3.410 2.524 2.087 3.209 . 0 0 "[ . 1 . 2]" 1
1015 1 92 VAL HA 1 101 VAL MG1 . . 3.990 3.072 1.975 3.827 . 0 0 "[ . 1 . 2]" 1
1016 1 92 VAL HA 1 101 VAL QG . . 3.480 2.726 1.970 3.464 . 0 0 "[ . 1 . 2]" 1
1017 1 92 VAL HA 1 101 VAL MG2 . . 3.990 3.466 2.033 4.047 0.057 5 0 "[ . 1 . 2]" 1
1018 1 92 VAL HA 1 120 LEU QD . . 4.340 3.486 2.852 3.921 . 0 0 "[ . 1 . 2]" 1
1019 1 92 VAL HA 1 123 ILE MD . . 4.010 3.090 1.973 3.967 . 0 0 "[ . 1 . 2]" 1
1020 1 92 VAL HB 1 93 ASN H . . 4.590 3.495 3.030 4.206 . 0 0 "[ . 1 . 2]" 1
1021 1 92 VAL QG 1 93 ASN H . . 3.640 3.160 2.313 3.571 . 0 0 "[ . 1 . 2]" 1
1022 1 92 VAL QG 1 101 VAL QG . . 3.200 2.583 2.063 3.013 . 0 0 "[ . 1 . 2]" 1
1023 1 92 VAL QG 1 119 ALA H . . 5.440 4.847 4.070 5.442 0.002 17 0 "[ . 1 . 2]" 1
1024 1 92 VAL QG 1 119 ALA MB . . 3.140 2.384 1.628 3.007 . 0 0 "[ . 1 . 2]" 1
1025 1 92 VAL QG 1 120 LEU QD . . 2.760 1.985 1.553 2.503 . 0 0 "[ . 1 . 2]" 1
1026 1 92 VAL MG1 1 93 ASN H . . 4.310 3.892 3.368 4.297 . 0 0 "[ . 1 . 2]" 1
1027 1 92 VAL MG2 1 93 ASN H . . 4.310 3.640 2.326 4.293 . 0 0 "[ . 1 . 2]" 1
1028 1 93 ASN H 1 93 ASN HB3 . . 3.880 3.159 2.398 3.567 . 0 0 "[ . 1 . 2]" 1
1029 1 93 ASN H 1 93 ASN QD . . 4.380 3.795 1.898 4.378 . 0 0 "[ . 1 . 2]" 1
1030 1 93 ASN H 1 94 ARG H . . 4.020 2.638 2.306 3.029 . 0 0 "[ . 1 . 2]" 1
1031 1 93 ASN H 1 95 GLN H . . 4.200 3.883 3.173 4.267 0.067 18 0 "[ . 1 . 2]" 1
1032 1 93 ASN H 1 95 GLN QE . . 5.130 3.943 2.127 4.818 . 0 0 "[ . 1 . 2]" 1
1033 1 93 ASN H 1 123 ILE MD . . 5.110 4.374 3.638 5.113 0.003 20 0 "[ . 1 . 2]" 1
1034 1 94 ARG H 1 94 ARG HG3 . . 4.550 3.681 2.221 4.739 0.189 3 0 "[ . 1 . 2]" 1
1035 1 94 ARG H 1 95 GLN H . . 3.890 2.874 2.542 3.205 . 0 0 "[ . 1 . 2]" 1
1036 1 94 ARG HA 1 94 ARG HG3 . . 3.980 3.109 2.065 4.221 0.241 3 0 "[ . 1 . 2]" 1
1037 1 95 GLN H 1 95 GLN HB3 . . 3.980 3.506 3.064 3.583 . 0 0 "[ . 1 . 2]" 1
1038 1 95 GLN H 1 95 GLN QE . . 4.450 3.003 1.785 4.469 0.019 13 0 "[ . 1 . 2]" 1
1039 1 95 GLN H 1 95 GLN HG3 . . 4.260 2.606 1.943 4.079 . 0 0 "[ . 1 . 2]" 1
1040 1 95 GLN H 1 96 HIS H . . 4.570 4.563 4.394 4.651 0.081 19 0 "[ . 1 . 2]" 1
1041 1 95 GLN HA 1 95 GLN HG3 . . 3.580 2.691 2.163 3.078 . 0 0 "[ . 1 . 2]" 1
1042 1 96 HIS H 1 97 LYS H . . 4.320 3.271 2.088 3.899 . 0 0 "[ . 1 . 2]" 1
1043 1 97 LYS H 1 97 LYS HB3 . . 4.170 3.022 2.833 3.483 . 0 0 "[ . 1 . 2]" 1
1044 1 97 LYS H 1 97 LYS HG3 . . 4.920 4.517 3.798 4.662 . 0 0 "[ . 1 . 2]" 1
1045 1 97 LYS H 1 98 TYR H . . 4.830 4.454 3.869 4.614 . 0 0 "[ . 1 . 2]" 1
1046 1 97 LYS HA 1 97 LYS HG3 . . 3.640 2.505 2.121 2.729 . 0 0 "[ . 1 . 2]" 1
1047 1 97 LYS HB3 1 98 TYR H . . 4.730 2.939 1.956 4.402 . 0 0 "[ . 1 . 2]" 1
1048 1 97 LYS HB3 1 152 ILE MG . . 5.150 4.057 3.055 4.679 . 0 0 "[ . 1 . 2]" 1
1049 1 98 TYR H 1 99 ASN H . . 4.070 2.993 2.646 3.305 . 0 0 "[ . 1 . 2]" 1
1050 1 98 TYR HA 1 98 TYR QD . . 4.050 3.460 1.986 3.780 . 0 0 "[ . 1 . 2]" 1
1051 1 98 TYR HA 1 152 ILE HA . . 5.500 5.269 4.695 5.511 0.011 11 0 "[ . 1 . 2]" 1
1052 1 98 TYR HA 1 152 ILE HB . . 4.690 2.434 1.956 2.930 . 0 0 "[ . 1 . 2]" 1
1053 1 98 TYR HA 1 152 ILE MD . . 4.090 2.880 2.404 3.266 . 0 0 "[ . 1 . 2]" 1
1054 1 98 TYR HA 1 152 ILE MG . . 4.040 2.788 1.974 3.357 . 0 0 "[ . 1 . 2]" 1
1055 1 98 TYR HB3 1 152 ILE MG . . 3.970 2.312 1.867 3.182 . 0 0 "[ . 1 . 2]" 1
1056 1 98 TYR QE 1 152 ILE MG . . 4.760 4.168 2.421 4.779 0.019 6 0 "[ . 1 . 2]" 1
1057 1 98 TYR QE 1 153 TRP HA . . 5.100 4.763 3.428 5.113 0.013 17 0 "[ . 1 . 2]" 1
1058 1 98 TYR QE 1 156 THR MG . . 4.010 3.652 2.683 4.016 0.006 20 0 "[ . 1 . 2]" 1
1059 1 99 ASN HA 1 100 SER H . . 3.560 2.331 2.257 2.534 . 0 0 "[ . 1 . 2]" 1
1060 1 100 SER H 1 100 SER HB3 . . 4.150 3.298 2.489 3.908 . 0 0 "[ . 1 . 2]" 1
1061 1 100 SER H 1 101 VAL QG . . 4.570 4.299 3.757 4.521 . 0 0 "[ . 1 . 2]" 1
1062 1 100 SER HA 1 101 VAL H . . 3.420 2.462 2.219 2.662 . 0 0 "[ . 1 . 2]" 1
1063 1 100 SER HA 1 101 VAL QG . . 3.860 3.395 2.775 3.849 . 0 0 "[ . 1 . 2]" 1
1064 1 100 SER HA 1 102 ILE MD . . 5.140 4.431 3.539 5.139 . 0 0 "[ . 1 . 2]" 1
1065 1 101 VAL H 1 101 VAL MG1 . . 3.840 3.627 2.507 3.878 0.038 1 0 "[ . 1 . 2]" 1
1066 1 101 VAL H 1 101 VAL QG . . 3.130 2.618 1.981 3.087 . 0 0 "[ . 1 . 2]" 1
1067 1 101 VAL H 1 101 VAL MG2 . . 3.840 2.741 1.989 3.398 . 0 0 "[ . 1 . 2]" 1
1068 1 101 VAL HA 1 101 VAL MG1 . . 3.520 2.416 2.185 2.730 . 0 0 "[ . 1 . 2]" 1
1069 1 101 VAL HA 1 101 VAL QG . . 3.080 2.125 2.046 2.515 . 0 0 "[ . 1 . 2]" 1
1070 1 101 VAL HA 1 101 VAL MG2 . . 3.520 2.426 2.148 3.161 . 0 0 "[ . 1 . 2]" 1
1071 1 101 VAL HA 1 102 ILE MD . . 4.500 3.682 3.151 4.503 0.003 15 0 "[ . 1 . 2]" 1
1072 1 101 VAL HB 1 102 ILE H . . 4.920 4.236 2.958 4.620 . 0 0 "[ . 1 . 2]" 1
1073 1 101 VAL QG 1 102 ILE H . . 3.590 2.862 2.372 3.532 . 0 0 "[ . 1 . 2]" 1
1074 1 101 VAL QG 1 102 ILE HA . . 3.950 3.636 3.286 3.983 0.033 2 0 "[ . 1 . 2]" 1
1075 1 101 VAL MG1 1 102 ILE H . . 4.460 3.018 2.388 4.387 . 0 0 "[ . 1 . 2]" 1
1076 1 101 VAL MG1 1 102 ILE HA . . 5.500 3.890 3.317 5.524 0.024 13 0 "[ . 1 . 2]" 1
1077 1 101 VAL MG2 1 102 ILE H . . 4.460 4.027 3.174 4.330 . 0 0 "[ . 1 . 2]" 1
1078 1 101 VAL MG2 1 102 ILE HA . . 5.500 5.304 3.365 5.575 0.075 14 0 "[ . 1 . 2]" 1
1079 1 102 ILE H 1 102 ILE MD . . 4.000 3.163 2.647 3.884 . 0 0 "[ . 1 . 2]" 1
1080 1 102 ILE H 1 102 ILE MG . . 3.870 3.587 3.342 3.920 0.050 17 0 "[ . 1 . 2]" 1
1081 1 102 ILE HA 1 102 ILE MD . . 3.540 2.409 1.880 2.660 . 0 0 "[ . 1 . 2]" 1
1082 1 102 ILE HA 1 102 ILE MG . . 3.360 2.654 2.414 2.854 . 0 0 "[ . 1 . 2]" 1
1083 1 102 ILE HA 1 103 PRO HD3 . . 3.800 2.081 1.946 2.231 . 0 0 "[ . 1 . 2]" 1
1084 1 102 ILE HA 1 123 ILE MG . . 3.880 3.320 2.538 3.871 . 0 0 "[ . 1 . 2]" 1
1085 1 102 ILE HB 1 102 ILE MD . . 3.490 2.485 2.118 3.209 . 0 0 "[ . 1 . 2]" 1
1086 1 102 ILE MD 1 123 ILE MG . . 3.650 3.443 2.757 3.662 0.012 5 0 "[ . 1 . 2]" 1
1087 1 102 ILE MD 1 124 ASN H . . 5.460 4.820 3.796 5.453 . 0 0 "[ . 1 . 2]" 1
1088 1 102 ILE MD 1 124 ASN QD . . 4.930 3.794 2.004 4.805 . 0 0 "[ . 1 . 2]" 1
1089 1 102 ILE MD 1 125 ALA HA . . 5.500 4.772 3.762 5.274 . 0 0 "[ . 1 . 2]" 1
1090 1 102 ILE MD 1 140 ILE HA . . 5.020 4.609 4.004 5.036 0.016 2 0 "[ . 1 . 2]" 1
1091 1 102 ILE MD 1 140 ILE MG . . 3.190 2.317 1.883 2.845 . 0 0 "[ . 1 . 2]" 1
1092 1 102 ILE MD 1 141 PHE QE . . 4.360 3.795 3.212 4.361 0.001 13 0 "[ . 1 . 2]" 1
1093 1 102 ILE HG13 1 140 ILE MG . . 4.130 3.007 1.879 3.950 . 0 0 "[ . 1 . 2]" 1
1094 1 102 ILE MG 1 103 PRO HD3 . . 4.130 3.968 3.476 4.138 0.008 3 0 "[ . 1 . 2]" 1
1095 1 102 ILE MG 1 104 MET H . . 4.330 3.928 3.662 4.320 . 0 0 "[ . 1 . 2]" 1
1096 1 102 ILE MG 1 104 MET HA . . 4.250 3.726 3.518 3.967 . 0 0 "[ . 1 . 2]" 1
1097 1 102 ILE MG 1 104 MET HG3 . . 5.050 4.776 4.431 5.076 0.026 15 0 "[ . 1 . 2]" 1
1098 1 102 ILE MG 1 123 ILE MG . . 4.770 4.380 4.028 4.778 0.008 2 0 "[ . 1 . 2]" 1
1099 1 102 ILE MG 1 125 ALA HA . . 3.660 2.816 2.332 3.112 . 0 0 "[ . 1 . 2]" 1
1100 1 102 ILE MG 1 125 ALA MB . . 4.190 3.984 3.534 4.226 0.036 10 0 "[ . 1 . 2]" 1
1101 1 102 ILE MG 1 126 LEU H . . 3.700 2.422 1.922 2.839 . 0 0 "[ . 1 . 2]" 1
1102 1 102 ILE MG 1 126 LEU HB3 . . 4.500 3.176 3.033 3.426 . 0 0 "[ . 1 . 2]" 1
1103 1 102 ILE MG 1 126 LEU HG . . 3.820 2.902 2.554 3.134 . 0 0 "[ . 1 . 2]" 1
1104 1 102 ILE MG 1 137 VAL QG . . 5.440 4.779 4.577 5.123 . 0 0 "[ . 1 . 2]" 1
1105 1 102 ILE MG 1 140 ILE MD . . 3.090 2.244 1.888 2.724 . 0 0 "[ . 1 . 2]" 1
1106 1 102 ILE MG 1 140 ILE MG . . 3.890 2.757 2.317 3.074 . 0 0 "[ . 1 . 2]" 1
1107 1 102 ILE MG 1 141 PHE QE . . 4.310 3.297 2.576 3.882 . 0 0 "[ . 1 . 2]" 1
1108 1 102 ILE MG 1 141 PHE HZ . . 4.040 2.841 2.102 3.443 . 0 0 "[ . 1 . 2]" 1
1109 1 103 PRO HD3 1 125 ALA MB . . 4.390 4.259 3.685 4.430 0.040 17 0 "[ . 1 . 2]" 1
1110 1 103 PRO HG3 1 123 ILE MG . . 3.860 3.143 2.590 3.856 . 0 0 "[ . 1 . 2]" 1
1111 1 103 PRO HG3 1 125 ALA MB . . 3.840 3.672 3.502 3.849 0.009 12 0 "[ . 1 . 2]" 1
1112 1 104 MET H 1 104 MET HB3 . . 3.890 2.389 2.306 2.455 . 0 0 "[ . 1 . 2]" 1
1113 1 104 MET H 1 104 MET ME . . 5.500 5.605 5.548 5.685 0.185 8 0 "[ . 1 . 2]" 1
1114 1 104 MET HA 1 104 MET ME . . 4.460 4.281 4.186 4.341 . 0 0 "[ . 1 . 2]" 1
1115 1 104 MET HA 1 125 ALA MB . . 4.130 3.431 3.240 3.639 . 0 0 "[ . 1 . 2]" 1
1116 1 104 MET HA 1 126 LEU H . . 4.280 2.181 1.942 2.723 . 0 0 "[ . 1 . 2]" 1
1117 1 104 MET HA 1 126 LEU MD1 . . 4.890 4.016 3.756 4.230 . 0 0 "[ . 1 . 2]" 1
1118 1 104 MET HA 1 126 LEU QD . . 4.060 3.815 3.594 3.982 . 0 0 "[ . 1 . 2]" 1
1119 1 104 MET HA 1 126 LEU MD2 . . 4.890 4.775 4.530 4.894 0.004 9 0 "[ . 1 . 2]" 1
1120 1 104 MET HA 1 126 LEU HG . . 5.120 4.960 4.685 5.151 0.031 5 0 "[ . 1 . 2]" 1
1121 1 104 MET HB3 1 105 ARG H . . 4.090 3.825 3.542 3.977 . 0 0 "[ . 1 . 2]" 1
1122 1 104 MET HB3 1 105 ARG HA . . 4.960 4.749 4.485 4.922 . 0 0 "[ . 1 . 2]" 1
1123 1 104 MET ME 1 104 MET HG3 . . 3.030 2.021 1.959 2.106 . 0 0 "[ . 1 . 2]" 1
1124 1 104 MET ME 1 105 ARG H . . 3.950 3.880 3.521 3.991 0.041 13 0 "[ . 1 . 2]" 1
1125 1 104 MET ME 1 126 LEU HA . . 4.860 4.739 4.543 4.867 0.007 14 0 "[ . 1 . 2]" 1
1126 1 104 MET ME 1 126 LEU QD . . 2.890 1.760 1.689 1.916 . 0 0 "[ . 1 . 2]" 1
1127 1 104 MET ME 1 126 LEU HG . . 3.760 3.561 3.184 3.755 . 0 0 "[ . 1 . 2]" 1
1128 1 104 MET ME 1 127 GLU H . . 4.710 4.221 3.639 4.603 . 0 0 "[ . 1 . 2]" 1
1129 1 104 MET ME 1 127 GLU HA . . 4.160 3.994 3.419 4.233 0.073 10 0 "[ . 1 . 2]" 1
1130 1 104 MET ME 1 128 GLU H . . 3.730 3.541 3.081 3.756 0.026 14 0 "[ . 1 . 2]" 1
1131 1 104 MET ME 1 128 GLU HA . . 3.760 3.378 3.110 3.791 0.031 5 0 "[ . 1 . 2]" 1
1132 1 104 MET ME 1 128 GLU HE2 . . 4.360 2.951 1.919 4.352 . 0 0 "[ . 1 . 2]" 1
1133 1 104 MET ME 1 133 PHE HA . . 5.500 5.237 4.985 5.470 . 0 0 "[ . 1 . 2]" 1
1134 1 104 MET ME 1 133 PHE QD . . 3.680 3.349 2.748 3.682 0.002 1 0 "[ . 1 . 2]" 1
1135 1 104 MET ME 1 133 PHE QE . . 3.430 3.044 2.095 3.466 0.036 9 0 "[ . 1 . 2]" 1
1136 1 104 MET ME 1 137 VAL QG . . 4.200 3.618 3.227 4.259 0.059 12 0 "[ . 1 . 2]" 1
1137 1 104 MET HG3 1 105 ARG H . . 4.170 2.442 2.129 2.590 . 0 0 "[ . 1 . 2]" 1
1138 1 104 MET HG3 1 126 LEU HA . . 4.510 4.437 4.321 4.529 0.019 14 0 "[ . 1 . 2]" 1
1139 1 104 MET HG3 1 126 LEU QD . . 3.270 2.486 2.152 2.682 . 0 0 "[ . 1 . 2]" 1
1140 1 105 ARG H 1 125 ALA MB . . 4.860 4.318 3.942 4.747 . 0 0 "[ . 1 . 2]" 1
1141 1 105 ARG H 1 126 LEU QD . . 4.550 4.124 3.735 4.319 . 0 0 "[ . 1 . 2]" 1
1142 1 105 ARG H 1 127 GLU HA . . 4.370 2.925 2.352 3.230 . 0 0 "[ . 1 . 2]" 1
1143 1 105 ARG H 1 128 GLU H . . 4.550 3.830 3.324 4.472 . 0 0 "[ . 1 . 2]" 1
1144 1 106 PRO HA 1 107 LEU HA . . 4.390 4.251 4.237 4.272 . 0 0 "[ . 1 . 2]" 1
1145 1 106 PRO HA 1 107 LEU QD . . 3.670 2.445 2.273 2.635 . 0 0 "[ . 1 . 2]" 1
1146 1 107 LEU H 1 107 LEU HB3 . . 3.900 3.622 3.558 3.691 . 0 0 "[ . 1 . 2]" 1
1147 1 107 LEU H 1 107 LEU MD1 . . 3.640 2.405 1.984 3.708 0.068 13 0 "[ . 1 . 2]" 1
1148 1 107 LEU H 1 107 LEU MD2 . . 3.640 2.471 1.884 3.279 . 0 0 "[ . 1 . 2]" 1
1149 1 107 LEU H 1 107 LEU HG . . 4.000 3.726 1.970 4.125 0.125 8 0 "[ . 1 . 2]" 1
1150 1 107 LEU H 1 108 ASN H . . 4.380 2.213 2.052 2.359 . 0 0 "[ . 1 . 2]" 1
1151 1 107 LEU H 1 108 ASN QD . . 4.710 3.570 2.937 4.640 . 0 0 "[ . 1 . 2]" 1
1152 1 107 LEU HA 1 107 LEU QD . . 2.770 2.054 1.897 2.459 . 0 0 "[ . 1 . 2]" 1
1153 1 107 LEU HA 1 107 LEU HG . . 3.830 3.457 2.910 3.798 . 0 0 "[ . 1 . 2]" 1
1154 1 107 LEU HA 1 129 GLU H . . 5.500 5.390 4.736 5.563 0.063 13 0 "[ . 1 . 2]" 1
1155 1 107 LEU HB3 1 107 LEU MD1 . . 3.440 2.764 2.360 3.137 . 0 0 "[ . 1 . 2]" 1
1156 1 107 LEU HB3 1 107 LEU QD . . 3.000 2.473 2.124 2.592 . 0 0 "[ . 1 . 2]" 1
1157 1 107 LEU HB3 1 107 LEU MD2 . . 3.440 2.900 2.337 3.156 . 0 0 "[ . 1 . 2]" 1
1158 1 107 LEU HB3 1 107 LEU HG . . 2.930 2.342 2.239 3.031 0.101 9 0 "[ . 1 . 2]" 1
1159 1 107 LEU HB3 1 108 ASN H . . 4.230 3.941 3.652 4.167 . 0 0 "[ . 1 . 2]" 1
1160 1 107 LEU HB3 1 108 ASN QD . . 5.130 4.386 3.534 4.918 . 0 0 "[ . 1 . 2]" 1
1161 1 107 LEU HB3 1 109 ASN H . . 5.500 5.466 5.316 5.544 0.044 12 0 "[ . 1 . 2]" 1
1162 1 107 LEU HB3 1 129 GLU HA . . 5.180 4.828 4.221 5.215 0.035 10 0 "[ . 1 . 2]" 1
1163 1 107 LEU QD 1 108 ASN H . . 3.640 3.247 2.658 3.734 0.094 13 0 "[ . 1 . 2]" 1
1164 1 107 LEU QD 1 108 ASN QD . . 3.850 3.374 2.712 3.902 0.052 7 0 "[ . 1 . 2]" 1
1165 1 107 LEU QD 1 128 GLU H . . 4.090 2.789 2.296 3.129 . 0 0 "[ . 1 . 2]" 1
1166 1 107 LEU QD 1 128 GLU HA . . 4.330 3.816 3.552 4.337 0.007 6 0 "[ . 1 . 2]" 1
1167 1 107 LEU QD 1 128 GLU HE2 . . 4.060 3.201 1.883 4.089 0.029 8 0 "[ . 1 . 2]" 1
1168 1 107 LEU QD 1 129 GLU H . . 3.550 2.188 1.913 2.566 . 0 0 "[ . 1 . 2]" 1
1169 1 107 LEU QD 1 129 GLU HA . . 3.420 2.982 2.398 3.513 0.093 18 0 "[ . 1 . 2]" 1
1170 1 107 LEU QD 1 130 SER H . . 4.490 4.146 3.958 4.310 . 0 0 "[ . 1 . 2]" 1
1171 1 107 LEU MD1 1 108 ASN H . . 4.180 4.029 3.889 4.202 0.022 13 0 "[ . 1 . 2]" 1
1172 1 107 LEU MD1 1 128 GLU HE2 . . 4.710 4.157 3.044 4.716 0.006 16 0 "[ . 1 . 2]" 1
1173 1 107 LEU MD1 1 129 GLU H . . 4.510 2.347 1.916 4.011 . 0 0 "[ . 1 . 2]" 1
1174 1 107 LEU MD2 1 108 ASN H . . 4.180 3.551 2.699 4.299 0.119 19 0 "[ . 1 . 2]" 1
1175 1 107 LEU MD2 1 128 GLU HE2 . . 4.710 3.488 1.887 4.544 . 0 0 "[ . 1 . 2]" 1
1176 1 107 LEU MD2 1 129 GLU H . . 4.510 4.028 2.158 4.516 0.006 15 0 "[ . 1 . 2]" 1
1177 1 107 LEU HG 1 108 ASN H . . 5.240 4.924 3.192 5.312 0.072 3 0 "[ . 1 . 2]" 1
1178 1 107 LEU HG 1 129 GLU HG3 . . 5.230 4.664 2.200 5.100 . 0 0 "[ . 1 . 2]" 1
1179 1 108 ASN H 1 108 ASN HB3 . . 3.730 3.280 2.603 3.558 . 0 0 "[ . 1 . 2]" 1
1180 1 108 ASN H 1 108 ASN QD . . 3.890 2.191 1.863 3.144 . 0 0 "[ . 1 . 2]" 1
1181 1 108 ASN H 1 109 ASN H . . 3.930 2.463 2.452 2.480 . 0 0 "[ . 1 . 2]" 1
1182 1 108 ASN HA 1 108 ASN QD . . 4.270 2.948 1.954 3.787 . 0 0 "[ . 1 . 2]" 1
1183 1 108 ASN HA 1 109 ASN H . . 3.560 3.530 3.502 3.552 . 0 0 "[ . 1 . 2]" 1
1184 1 108 ASN HA 1 109 ASN HA . . 4.620 4.569 4.566 4.580 . 0 0 "[ . 1 . 2]" 1
1185 1 108 ASN HB3 1 109 ASN H . . 4.490 3.993 3.623 4.259 . 0 0 "[ . 1 . 2]" 1
1186 1 109 ASN H 1 109 ASN HB3 . . 3.560 3.342 2.684 3.576 0.016 5 0 "[ . 1 . 2]" 1
1187 1 109 ASN HA 1 109 ASN QD . . 4.480 3.150 2.569 3.903 . 0 0 "[ . 1 . 2]" 1
1188 1 109 ASN HA 1 110 PRO HD3 . . 3.900 2.143 2.055 2.213 . 0 0 "[ . 1 . 2]" 1
1189 1 109 ASN HB3 1 109 ASN QD . . 3.410 3.264 2.818 3.373 . 0 0 "[ . 1 . 2]" 1
1190 1 109 ASN HB3 1 109 ASN HD22 . . 4.150 4.085 3.807 4.157 0.007 6 0 "[ . 1 . 2]" 1
1191 1 111 LEU H 1 111 LEU MD1 . . 4.780 4.269 4.079 4.337 . 0 0 "[ . 1 . 2]" 1
1192 1 111 LEU H 1 111 LEU QD . . 4.090 3.727 3.667 3.754 . 0 0 "[ . 1 . 2]" 1
1193 1 111 LEU H 1 111 LEU MD2 . . 4.780 4.115 3.956 4.361 . 0 0 "[ . 1 . 2]" 1
1194 1 111 LEU HA 1 111 LEU MD1 . . 4.020 2.896 2.700 3.192 . 0 0 "[ . 1 . 2]" 1
1195 1 111 LEU HA 1 111 LEU QD . . 3.000 1.906 1.864 2.098 . 0 0 "[ . 1 . 2]" 1
1196 1 111 LEU HA 1 111 LEU MD2 . . 4.020 1.935 1.883 2.187 . 0 0 "[ . 1 . 2]" 1
1197 1 111 LEU HB3 1 111 LEU MD1 . . 3.430 2.285 2.132 2.384 . 0 0 "[ . 1 . 2]" 1
1198 1 111 LEU HB3 1 111 LEU MD2 . . 3.430 3.211 3.195 3.221 . 0 0 "[ . 1 . 2]" 1
1199 1 111 LEU QD 1 112 PRO HA . . 5.360 3.916 3.624 4.080 . 0 0 "[ . 1 . 2]" 1
1200 1 111 LEU QD 1 113 ARG HA . . 4.800 3.973 3.534 4.162 . 0 0 "[ . 1 . 2]" 1
1201 1 111 LEU QD 1 115 ARG H . . 3.780 3.179 2.973 3.451 . 0 0 "[ . 1 . 2]" 1
1202 1 111 LEU QD 1 116 THR H . . 4.040 3.026 2.560 3.639 . 0 0 "[ . 1 . 2]" 1
1203 1 111 LEU QD 1 116 THR HA . . 4.290 2.786 2.396 3.111 . 0 0 "[ . 1 . 2]" 1
1204 1 111 LEU QD 1 117 PRO HD3 . . 5.110 3.886 3.312 4.254 . 0 0 "[ . 1 . 2]" 1
1205 1 111 LEU MD1 1 115 ARG H . . 4.410 3.304 3.062 3.691 . 0 0 "[ . 1 . 2]" 1
1206 1 111 LEU MD2 1 115 ARG H . . 4.410 4.191 3.637 4.414 0.004 17 0 "[ . 1 . 2]" 1
1207 1 112 PRO HA 1 113 ARG HA . . 4.380 4.152 4.148 4.159 . 0 0 "[ . 1 . 2]" 1
1208 1 112 PRO HB3 1 113 ARG H . . 4.320 3.415 3.347 3.591 . 0 0 "[ . 1 . 2]" 1
1209 1 112 PRO HB3 1 115 ARG H . . 5.260 5.102 4.839 5.262 0.002 5 0 "[ . 1 . 2]" 1
1210 1 113 ARG H 1 113 ARG HG3 . . 4.330 2.735 1.947 3.704 . 0 0 "[ . 1 . 2]" 1
1211 1 113 ARG HA 1 113 ARG HG3 . . 4.050 3.503 2.039 4.021 . 0 0 "[ . 1 . 2]" 1
1212 1 113 ARG HA 1 115 ARG H . . 4.290 3.605 3.328 3.994 . 0 0 "[ . 1 . 2]" 1
1213 1 113 ARG HA 1 116 THR H . . 4.220 2.824 2.575 3.251 . 0 0 "[ . 1 . 2]" 1
1214 1 113 ARG HA 1 116 THR HB . . 4.630 2.078 1.988 2.415 . 0 0 "[ . 1 . 2]" 1
1215 1 113 ARG HA 1 116 THR HG1 . . 3.950 2.737 1.991 3.965 0.015 1 0 "[ . 1 . 2]" 1
1216 1 113 ARG HA 1 116 THR MG . . 4.390 3.569 3.315 3.788 . 0 0 "[ . 1 . 2]" 1
1217 1 114 GLU H 1 114 GLU HG3 . . 4.850 3.642 2.354 4.404 . 0 0 "[ . 1 . 2]" 1
1218 1 114 GLU HA 1 114 GLU HG3 . . 3.950 3.724 2.597 4.008 0.058 18 0 "[ . 1 . 2]" 1
1219 1 114 GLU HG3 1 115 ARG H . . 4.540 3.400 2.487 4.536 . 0 0 "[ . 1 . 2]" 1
1220 1 115 ARG H 1 115 ARG HB3 . . 4.040 3.585 3.447 3.689 . 0 0 "[ . 1 . 2]" 1
1221 1 115 ARG H 1 116 THR H . . 3.110 2.084 1.891 2.501 . 0 0 "[ . 1 . 2]" 1
1222 1 115 ARG H 1 116 THR HB . . 4.580 4.244 3.789 4.575 . 0 0 "[ . 1 . 2]" 1
1223 1 115 ARG H 1 116 THR HG1 . . 4.490 4.017 3.239 4.502 0.012 10 0 "[ . 1 . 2]" 1
1224 1 115 ARG HA 1 115 ARG HD3 . . 4.410 2.181 1.996 2.502 . 0 0 "[ . 1 . 2]" 1
1225 1 115 ARG HA 1 115 ARG HG3 . . 4.090 3.644 2.791 3.732 . 0 0 "[ . 1 . 2]" 1
1226 1 115 ARG HB3 1 116 THR H . . 4.550 4.005 3.566 4.358 . 0 0 "[ . 1 . 2]" 1
1227 1 115 ARG HE 1 115 ARG HG3 . . 4.090 2.799 2.410 3.636 . 0 0 "[ . 1 . 2]" 1
1228 1 116 THR H 1 116 THR HB . . 3.550 2.486 2.298 2.656 . 0 0 "[ . 1 . 2]" 1
1229 1 116 THR H 1 116 THR HG1 . . 3.730 2.901 1.942 3.704 . 0 0 "[ . 1 . 2]" 1
1230 1 116 THR H 1 116 THR MG . . 3.870 3.728 3.667 3.854 . 0 0 "[ . 1 . 2]" 1
1231 1 116 THR H 1 121 GLN HE22 . . 4.950 4.852 4.581 5.003 0.053 18 0 "[ . 1 . 2]" 1
1232 1 116 THR HA 1 116 THR MG . . 3.630 2.337 2.237 2.493 . 0 0 "[ . 1 . 2]" 1
1233 1 116 THR HA 1 120 LEU QD . . 4.440 4.261 4.061 4.459 0.019 10 0 "[ . 1 . 2]" 1
1234 1 116 THR HB 1 121 GLN HB3 . . 4.520 3.464 2.714 4.557 0.037 19 0 "[ . 1 . 2]" 1
1235 1 116 THR HB 1 121 GLN HE21 . . 4.390 3.468 2.733 4.089 . 0 0 "[ . 1 . 2]" 1
1236 1 116 THR HB 1 121 GLN HG3 . . 5.500 5.071 4.156 5.488 . 0 0 "[ . 1 . 2]" 1
1237 1 116 THR MG 1 117 PRO HA . . 4.500 4.245 4.001 4.398 . 0 0 "[ . 1 . 2]" 1
1238 1 116 THR MG 1 117 PRO HD3 . . 3.690 2.768 2.685 2.872 . 0 0 "[ . 1 . 2]" 1
1239 1 116 THR MG 1 120 LEU H . . 4.190 4.021 3.850 4.109 . 0 0 "[ . 1 . 2]" 1
1240 1 116 THR MG 1 120 LEU HA . . 4.710 4.660 4.496 4.751 0.041 4 0 "[ . 1 . 2]" 1
1241 1 116 THR MG 1 120 LEU HB3 . . 3.950 3.476 3.336 3.742 . 0 0 "[ . 1 . 2]" 1
1242 1 116 THR MG 1 120 LEU QD . . 3.630 3.314 3.142 3.634 0.004 10 0 "[ . 1 . 2]" 1
1243 1 116 THR MG 1 121 GLN H . . 4.330 2.765 2.523 3.201 . 0 0 "[ . 1 . 2]" 1
1244 1 116 THR MG 1 121 GLN HE21 . . 3.660 3.392 3.181 3.689 0.029 19 0 "[ . 1 . 2]" 1
1245 1 116 THR MG 1 121 GLN HE22 . . 4.630 4.518 4.361 4.648 0.018 1 0 "[ . 1 . 2]" 1
1246 1 117 PRO HA 1 120 LEU QD . . 5.350 4.983 4.932 5.084 . 0 0 "[ . 1 . 2]" 1
1247 1 117 PRO HD3 1 120 LEU QD . . 4.300 2.905 2.692 3.118 . 0 0 "[ . 1 . 2]" 1
1248 1 118 PHE HA 1 118 PHE QD . . 3.950 3.663 3.155 3.759 . 0 0 "[ . 1 . 2]" 1
1249 1 118 PHE HA 1 121 GLN H . . 4.180 3.637 3.417 3.783 . 0 0 "[ . 1 . 2]" 1
1250 1 118 PHE HA 1 121 GLN HE21 . . 3.450 2.569 2.373 3.488 0.038 1 0 "[ . 1 . 2]" 1
1251 1 118 PHE HA 1 121 GLN HE22 . . 3.900 3.397 3.025 3.927 0.027 13 0 "[ . 1 . 2]" 1
1252 1 118 PHE HB3 1 119 ALA H . . 4.660 4.162 3.217 4.373 . 0 0 "[ . 1 . 2]" 1
1253 1 118 PHE QD 1 119 ALA HA . . 4.070 3.082 2.841 3.344 . 0 0 "[ . 1 . 2]" 1
1254 1 118 PHE QD 1 119 ALA MB . . 3.720 3.200 2.780 3.478 . 0 0 "[ . 1 . 2]" 1
1255 1 119 ALA H 1 119 ALA MB . . 3.400 2.190 2.107 2.270 . 0 0 "[ . 1 . 2]" 1
1256 1 119 ALA H 1 120 LEU H . . 4.490 2.361 2.288 2.445 . 0 0 "[ . 1 . 2]" 1
1257 1 119 ALA H 1 122 THR MG . . 4.920 4.498 4.303 4.865 . 0 0 "[ . 1 . 2]" 1
1258 1 119 ALA HA 1 120 LEU HA . . 4.730 4.704 4.669 4.724 . 0 0 "[ . 1 . 2]" 1
1259 1 119 ALA HA 1 120 LEU QD . . 5.360 5.059 4.800 5.172 . 0 0 "[ . 1 . 2]" 1
1260 1 119 ALA HA 1 121 GLN H . . 4.550 4.355 3.884 4.625 0.075 4 0 "[ . 1 . 2]" 1
1261 1 119 ALA HA 1 122 THR MG . . 3.730 3.652 3.587 3.737 0.007 20 0 "[ . 1 . 2]" 1
1262 1 119 ALA HA 1 123 ILE MD . . 3.790 3.543 3.059 3.801 0.011 10 0 "[ . 1 . 2]" 1
1263 1 119 ALA MB 1 120 LEU H . . 3.480 2.395 2.310 2.517 . 0 0 "[ . 1 . 2]" 1
1264 1 119 ALA MB 1 120 LEU MD1 . . 4.300 4.100 3.986 4.195 . 0 0 "[ . 1 . 2]" 1
1265 1 119 ALA MB 1 120 LEU QD . . 3.380 3.238 2.976 3.373 . 0 0 "[ . 1 . 2]" 1
1266 1 119 ALA MB 1 120 LEU MD2 . . 4.300 3.395 3.065 3.594 . 0 0 "[ . 1 . 2]" 1
1267 1 119 ALA MB 1 121 GLN H . . 4.420 4.254 4.017 4.420 . 0 0 "[ . 1 . 2]" 1
1268 1 120 LEU H 1 120 LEU HB3 . . 4.100 3.551 3.542 3.569 . 0 0 "[ . 1 . 2]" 1
1269 1 120 LEU H 1 120 LEU MD1 . . 4.170 3.477 3.450 3.523 . 0 0 "[ . 1 . 2]" 1
1270 1 120 LEU H 1 120 LEU QD . . 3.460 3.069 3.002 3.101 . 0 0 "[ . 1 . 2]" 1
1271 1 120 LEU H 1 120 LEU MD2 . . 4.170 3.417 3.272 3.498 . 0 0 "[ . 1 . 2]" 1
1272 1 120 LEU H 1 120 LEU HG . . 4.000 2.188 2.101 2.236 . 0 0 "[ . 1 . 2]" 1
1273 1 120 LEU H 1 121 GLN H . . 3.630 2.528 2.455 2.573 . 0 0 "[ . 1 . 2]" 1
1274 1 120 LEU HA 1 120 LEU MD1 . . 4.070 3.915 3.899 3.940 . 0 0 "[ . 1 . 2]" 1
1275 1 120 LEU HA 1 120 LEU QD . . 3.000 2.034 1.965 2.247 . 0 0 "[ . 1 . 2]" 1
1276 1 120 LEU HA 1 120 LEU MD2 . . 4.070 2.041 1.970 2.260 . 0 0 "[ . 1 . 2]" 1
1277 1 120 LEU HA 1 120 LEU HG . . 3.690 3.052 2.990 3.149 . 0 0 "[ . 1 . 2]" 1
1278 1 120 LEU HA 1 123 ILE MD . . 3.380 2.296 1.813 3.020 . 0 0 "[ . 1 . 2]" 1
1279 1 120 LEU QD 1 121 GLN H . . 4.840 4.189 4.091 4.332 . 0 0 "[ . 1 . 2]" 1
1280 1 120 LEU QD 1 123 ILE MD . . 3.680 2.466 1.803 3.136 . 0 0 "[ . 1 . 2]" 1
1281 1 121 GLN H 1 121 GLN HG3 . . 4.620 4.064 3.689 4.580 . 0 0 "[ . 1 . 2]" 1
1282 1 121 GLN H 1 122 THR MG . . 4.060 3.770 3.506 3.895 . 0 0 "[ . 1 . 2]" 1
1283 1 121 GLN HA 1 121 GLN HG3 . . 3.770 3.229 2.605 3.657 . 0 0 "[ . 1 . 2]" 1
1284 1 121 GLN HG3 1 122 THR MG . . 4.310 2.853 1.918 4.337 0.027 1 0 "[ . 1 . 2]" 1
1285 1 122 THR H 1 122 THR MG . . 3.470 2.703 2.524 2.937 . 0 0 "[ . 1 . 2]" 1
1286 1 122 THR HA 1 122 THR MG . . 2.820 2.460 2.378 2.516 . 0 0 "[ . 1 . 2]" 1
1287 1 122 THR HB 1 123 ILE H . . 4.550 4.464 3.799 4.600 0.050 5 0 "[ . 1 . 2]" 1
1288 1 122 THR MG 1 123 ILE H . . 4.290 4.260 4.135 4.319 0.029 16 0 "[ . 1 . 2]" 1
1289 1 123 ILE H 1 123 ILE MD . . 4.040 3.719 2.993 3.993 . 0 0 "[ . 1 . 2]" 1
1290 1 123 ILE H 1 123 ILE MG . . 3.790 3.585 3.504 3.715 . 0 0 "[ . 1 . 2]" 1
1291 1 123 ILE HA 1 123 ILE MD . . 3.880 3.746 3.675 3.907 0.027 10 0 "[ . 1 . 2]" 1
1292 1 123 ILE HA 1 123 ILE HG13 . . 3.760 2.395 2.234 2.759 . 0 0 "[ . 1 . 2]" 1
1293 1 123 ILE HA 1 123 ILE MG . . 3.040 2.625 2.290 2.717 . 0 0 "[ . 1 . 2]" 1
1294 1 123 ILE HA 1 124 ASN H . . 3.560 2.392 2.249 2.530 . 0 0 "[ . 1 . 2]" 1
1295 1 123 ILE HB 1 123 ILE MD . . 3.030 2.118 1.969 2.255 . 0 0 "[ . 1 . 2]" 1
1296 1 123 ILE MD 1 123 ILE MG . . 2.650 2.304 2.059 2.531 . 0 0 "[ . 1 . 2]" 1
1297 1 123 ILE MD 1 124 ASN H . . 5.030 4.768 4.562 5.034 0.004 16 0 "[ . 1 . 2]" 1
1298 1 123 ILE MG 1 124 ASN H . . 3.730 1.969 1.781 2.527 . 0 0 "[ . 1 . 2]" 1
1299 1 124 ASN HA 1 125 ALA H . . 3.170 2.442 2.252 2.667 . 0 0 "[ . 1 . 2]" 1
1300 1 124 ASN HA 1 125 ALA MB . . 4.250 4.123 3.911 4.257 0.007 3 0 "[ . 1 . 2]" 1
1301 1 124 ASN QD 1 140 ILE MD . . 3.780 2.612 1.852 3.603 . 0 0 "[ . 1 . 2]" 1
1302 1 124 ASN QD 1 140 ILE MG . . 4.170 3.773 3.002 4.181 0.011 5 0 "[ . 1 . 2]" 1
1303 1 125 ALA H 1 125 ALA MB . . 3.220 2.054 1.933 2.324 . 0 0 "[ . 1 . 2]" 1
1304 1 125 ALA HA 1 126 LEU H . . 3.440 2.396 2.204 2.636 . 0 0 "[ . 1 . 2]" 1
1305 1 125 ALA MB 1 126 LEU H . . 3.230 2.718 2.246 3.218 . 0 0 "[ . 1 . 2]" 1
1306 1 125 ALA MB 1 127 GLU H . . 5.460 5.104 4.825 5.431 . 0 0 "[ . 1 . 2]" 1
1307 1 125 ALA MB 1 127 GLU HG3 . . 4.350 3.784 3.310 4.359 0.009 5 0 "[ . 1 . 2]" 1
1308 1 125 ALA MB 1 136 GLN HE21 . . 5.500 5.163 4.839 5.510 0.010 20 0 "[ . 1 . 2]" 1
1309 1 125 ALA MB 1 136 GLN HE22 . . 4.410 4.225 3.982 4.414 0.004 3 0 "[ . 1 . 2]" 1
1310 1 126 LEU H 1 126 LEU HB3 . . 3.700 2.849 2.708 2.963 . 0 0 "[ . 1 . 2]" 1
1311 1 126 LEU H 1 126 LEU MD1 . . 4.480 4.298 4.222 4.354 . 0 0 "[ . 1 . 2]" 1
1312 1 126 LEU H 1 126 LEU QD . . 3.770 3.510 3.204 3.660 . 0 0 "[ . 1 . 2]" 1
1313 1 126 LEU H 1 126 LEU MD2 . . 4.480 3.730 3.304 4.013 . 0 0 "[ . 1 . 2]" 1
1314 1 126 LEU H 1 126 LEU HG . . 4.720 4.540 4.303 4.717 . 0 0 "[ . 1 . 2]" 1
1315 1 126 LEU H 1 140 ILE MD . . 4.610 4.417 3.730 4.615 0.005 20 0 "[ . 1 . 2]" 1
1316 1 126 LEU HA 1 126 LEU MD1 . . 3.680 2.973 2.851 3.161 . 0 0 "[ . 1 . 2]" 1
1317 1 126 LEU HA 1 126 LEU QD . . 3.220 1.856 1.822 1.898 . 0 0 "[ . 1 . 2]" 1
1318 1 126 LEU HA 1 126 LEU MD2 . . 3.680 1.875 1.835 1.924 . 0 0 "[ . 1 . 2]" 1
1319 1 126 LEU HA 1 127 GLU H . . 3.440 2.234 2.182 2.357 . 0 0 "[ . 1 . 2]" 1
1320 1 126 LEU HA 1 136 GLN HE21 . . 4.930 2.249 1.997 2.409 . 0 0 "[ . 1 . 2]" 1
1321 1 126 LEU HA 1 136 GLN HE22 . . 4.090 2.892 2.530 3.281 . 0 0 "[ . 1 . 2]" 1
1322 1 126 LEU HA 1 140 ILE MD . . 4.170 3.309 3.000 3.467 . 0 0 "[ . 1 . 2]" 1
1323 1 126 LEU QD 1 127 GLU H . . 3.420 2.269 1.911 2.455 . 0 0 "[ . 1 . 2]" 1
1324 1 126 LEU QD 1 133 PHE HA . . 4.260 3.317 3.048 3.647 . 0 0 "[ . 1 . 2]" 1
1325 1 126 LEU QD 1 133 PHE QD . . 3.050 2.478 2.249 2.720 . 0 0 "[ . 1 . 2]" 1
1326 1 126 LEU QD 1 133 PHE QE . . 3.330 3.028 2.358 3.323 . 0 0 "[ . 1 . 2]" 1
1327 1 126 LEU QD 1 136 GLN H . . 4.680 3.986 3.676 4.289 . 0 0 "[ . 1 . 2]" 1
1328 1 126 LEU QD 1 136 GLN HA . . 4.430 3.995 3.792 4.270 . 0 0 "[ . 1 . 2]" 1
1329 1 126 LEU QD 1 136 GLN HB3 . . 3.280 2.420 2.094 2.703 . 0 0 "[ . 1 . 2]" 1
1330 1 126 LEU QD 1 136 GLN HE21 . . 4.640 2.295 2.188 2.461 . 0 0 "[ . 1 . 2]" 1
1331 1 126 LEU QD 1 136 GLN HE22 . . 4.710 3.409 3.072 3.682 . 0 0 "[ . 1 . 2]" 1
1332 1 126 LEU QD 1 136 GLN HG3 . . 4.120 3.615 3.243 3.928 . 0 0 "[ . 1 . 2]" 1
1333 1 126 LEU QD 1 137 VAL H . . 3.650 2.853 1.967 3.273 . 0 0 "[ . 1 . 2]" 1
1334 1 126 LEU QD 1 137 VAL HA . . 3.730 2.548 2.102 3.006 . 0 0 "[ . 1 . 2]" 1
1335 1 126 LEU QD 1 137 VAL HB . . 4.520 3.566 2.237 4.172 . 0 0 "[ . 1 . 2]" 1
1336 1 126 LEU QD 1 137 VAL QG . . 2.750 2.013 1.712 2.823 0.073 14 0 "[ . 1 . 2]" 1
1337 1 126 LEU QD 1 138 GLU H . . 5.230 4.651 4.207 5.007 . 0 0 "[ . 1 . 2]" 1
1338 1 126 LEU QD 1 139 ARG H . . 5.440 5.408 5.197 5.512 0.072 12 0 "[ . 1 . 2]" 1
1339 1 126 LEU QD 1 140 ILE MD . . 3.210 1.799 1.668 2.021 . 0 0 "[ . 1 . 2]" 1
1340 1 126 LEU QD 1 140 ILE MG . . 4.440 3.377 3.076 4.003 . 0 0 "[ . 1 . 2]" 1
1341 1 126 LEU QD 1 141 PHE QD . . 4.420 4.176 3.875 4.419 . 0 0 "[ . 1 . 2]" 1
1342 1 126 LEU QD 1 141 PHE HZ . . 3.790 3.089 2.386 3.547 . 0 0 "[ . 1 . 2]" 1
1343 1 126 LEU MD1 1 127 GLU H . . 4.260 2.601 1.954 3.080 . 0 0 "[ . 1 . 2]" 1
1344 1 126 LEU MD1 1 136 GLN HB3 . . 4.550 4.506 4.318 4.577 0.027 1 0 "[ . 1 . 2]" 1
1345 1 126 LEU MD1 1 136 GLN HG3 . . 5.010 4.933 4.657 5.058 0.048 14 0 "[ . 1 . 2]" 1
1346 1 126 LEU MD1 1 137 VAL H . . 4.440 3.732 3.017 4.029 . 0 0 "[ . 1 . 2]" 1
1347 1 126 LEU MD1 1 137 VAL HA . . 4.280 3.902 3.619 4.112 . 0 0 "[ . 1 . 2]" 1
1348 1 126 LEU MD1 1 137 VAL MG1 . . 4.520 3.801 3.290 4.069 . 0 0 "[ . 1 . 2]" 1
1349 1 126 LEU MD1 1 137 VAL MG2 . . 4.520 2.259 1.813 3.645 . 0 0 "[ . 1 . 2]" 1
1350 1 126 LEU MD1 1 141 PHE QE . . 3.580 3.383 3.121 3.578 . 0 0 "[ . 1 . 2]" 1
1351 1 126 LEU MD2 1 127 GLU H . . 4.260 2.612 2.314 2.923 . 0 0 "[ . 1 . 2]" 1
1352 1 126 LEU MD2 1 136 GLN HB3 . . 4.550 2.431 2.097 2.725 . 0 0 "[ . 1 . 2]" 1
1353 1 126 LEU MD2 1 136 GLN HG3 . . 5.010 3.728 3.296 4.148 . 0 0 "[ . 1 . 2]" 1
1354 1 126 LEU MD2 1 137 VAL H . . 4.440 2.985 1.978 3.506 . 0 0 "[ . 1 . 2]" 1
1355 1 126 LEU MD2 1 137 VAL HA . . 4.280 2.588 2.110 3.111 . 0 0 "[ . 1 . 2]" 1
1356 1 126 LEU MD2 1 137 VAL MG1 . . 4.520 3.896 3.243 4.408 . 0 0 "[ . 1 . 2]" 1
1357 1 126 LEU MD2 1 137 VAL MG2 . . 4.520 2.568 1.930 3.767 . 0 0 "[ . 1 . 2]" 1
1358 1 126 LEU MD2 1 141 PHE QE . . 3.580 3.233 2.832 3.579 . 0 0 "[ . 1 . 2]" 1
1359 1 126 LEU HG 1 127 GLU H . . 4.780 4.631 4.228 4.835 0.055 8 0 "[ . 1 . 2]" 1
1360 1 126 LEU HG 1 133 PHE QD . . 5.500 5.277 5.055 5.502 0.002 16 0 "[ . 1 . 2]" 1
1361 1 126 LEU HG 1 133 PHE QE . . 5.500 5.410 4.732 5.549 0.049 2 0 "[ . 1 . 2]" 1
1362 1 126 LEU HG 1 136 GLN HE21 . . 5.110 5.114 5.058 5.136 0.026 7 0 "[ . 1 . 2]" 1
1363 1 126 LEU HG 1 137 VAL QG . . 4.150 3.295 2.813 3.907 . 0 0 "[ . 1 . 2]" 1
1364 1 127 GLU H 1 128 GLU H . . 4.690 4.391 4.183 4.551 . 0 0 "[ . 1 . 2]" 1
1365 1 127 GLU H 1 136 GLN HE21 . . 4.500 2.517 1.896 3.380 . 0 0 "[ . 1 . 2]" 1
1366 1 127 GLU H 1 136 GLN HE22 . . 4.630 3.535 2.745 4.503 . 0 0 "[ . 1 . 2]" 1
1367 1 127 GLU HA 1 127 GLU HG3 . . 4.060 2.951 2.608 3.631 . 0 0 "[ . 1 . 2]" 1
1368 1 127 GLU HA 1 128 GLU H . . 3.640 2.244 2.202 2.300 . 0 0 "[ . 1 . 2]" 1
1369 1 127 GLU HA 1 129 GLU H . . 4.090 3.689 3.453 3.962 . 0 0 "[ . 1 . 2]" 1
1370 1 127 GLU HG3 1 128 GLU H . . 5.120 5.022 4.749 5.185 0.065 5 0 "[ . 1 . 2]" 1
1371 1 128 GLU H 1 129 GLU H . . 3.700 1.998 1.883 2.394 . 0 0 "[ . 1 . 2]" 1
1372 1 128 GLU H 1 130 SER H . . 4.520 3.611 3.283 4.094 . 0 0 "[ . 1 . 2]" 1
1373 1 128 GLU HA 1 128 GLU HG3 . . 4.130 3.406 2.639 4.229 0.099 5 0 "[ . 1 . 2]" 1
1374 1 128 GLU HA 1 129 GLU HA . . 4.660 4.594 4.534 4.688 0.028 5 0 "[ . 1 . 2]" 1
1375 1 128 GLU HA 1 130 SER H . . 4.310 3.542 3.349 3.872 . 0 0 "[ . 1 . 2]" 1
1376 1 128 GLU HA 1 133 PHE H . . 5.470 5.088 4.809 5.473 0.003 14 0 "[ . 1 . 2]" 1
1377 1 128 GLU HA 1 133 PHE HA . . 4.550 3.890 3.402 4.228 . 0 0 "[ . 1 . 2]" 1
1378 1 128 GLU HA 1 133 PHE HB3 . . 4.530 3.738 3.360 4.120 . 0 0 "[ . 1 . 2]" 1
1379 1 128 GLU HA 1 133 PHE QD . . 3.840 2.418 1.989 3.044 . 0 0 "[ . 1 . 2]" 1
1380 1 128 GLU HG3 1 129 GLU H . . 5.020 3.520 2.589 4.294 . 0 0 "[ . 1 . 2]" 1
1381 1 129 GLU H 1 129 GLU HB3 . . 3.830 2.882 2.603 3.511 . 0 0 "[ . 1 . 2]" 1
1382 1 129 GLU H 1 129 GLU HG3 . . 3.420 2.345 1.889 3.021 . 0 0 "[ . 1 . 2]" 1
1383 1 129 GLU H 1 130 SER H . . 3.300 2.549 2.289 2.824 . 0 0 "[ . 1 . 2]" 1
1384 1 129 GLU H 1 130 SER HA . . 4.950 4.806 4.567 4.981 0.031 5 0 "[ . 1 . 2]" 1
1385 1 129 GLU HA 1 129 GLU HB3 . . 3.000 2.452 2.365 2.636 . 0 0 "[ . 1 . 2]" 1
1386 1 129 GLU HA 1 130 SER H . . 3.270 3.180 3.017 3.439 0.169 18 0 "[ . 1 . 2]" 1
1387 1 129 GLU HG3 1 130 SER H . . 5.000 3.527 3.020 5.056 0.056 18 0 "[ . 1 . 2]" 1
1388 1 130 SER H 1 130 SER HB3 . . 3.160 2.709 2.354 3.029 . 0 0 "[ . 1 . 2]" 1
1389 1 130 SER H 1 133 PHE HB3 . . 4.190 3.885 3.299 4.200 0.010 19 0 "[ . 1 . 2]" 1
1390 1 130 SER H 1 133 PHE QD . . 4.880 4.774 4.409 4.939 0.059 3 0 "[ . 1 . 2]" 1
1391 1 131 ARG HA 1 133 PHE H . . 4.470 3.501 3.347 3.828 . 0 0 "[ . 1 . 2]" 1
1392 1 133 PHE H 1 133 PHE HB3 . . 3.640 1.961 1.908 2.035 . 0 0 "[ . 1 . 2]" 1
1393 1 133 PHE H 1 133 PHE QD . . 4.040 3.809 3.684 3.923 . 0 0 "[ . 1 . 2]" 1
1394 1 133 PHE H 1 134 PRO HD3 . . 3.660 2.325 2.129 2.583 . 0 0 "[ . 1 . 2]" 1
1395 1 133 PHE HA 1 133 PHE QD . . 3.780 2.876 2.642 3.094 . 0 0 "[ . 1 . 2]" 1
1396 1 133 PHE HA 1 136 GLN H . . 4.410 3.997 3.835 4.166 . 0 0 "[ . 1 . 2]" 1
1397 1 133 PHE HA 1 136 GLN HB3 . . 5.500 5.411 5.222 5.532 0.032 17 0 "[ . 1 . 2]" 1
1398 1 133 PHE HA 1 136 GLN HG3 . . 4.240 3.622 3.347 3.746 . 0 0 "[ . 1 . 2]" 1
1399 1 133 PHE HA 1 137 VAL QG . . 4.410 3.748 3.538 4.461 0.051 18 0 "[ . 1 . 2]" 1
1400 1 133 PHE QD 1 137 VAL QG . . 3.430 2.777 2.105 3.438 0.008 12 0 "[ . 1 . 2]" 1
1401 1 133 PHE QE 1 137 VAL QG . . 3.670 2.590 2.046 3.050 . 0 0 "[ . 1 . 2]" 1
1402 1 134 PRO HA 1 137 VAL HB . . 3.580 2.577 2.041 3.891 0.311 18 0 "[ . 1 . 2]" 1
1403 1 134 PRO HA 1 137 VAL MG1 . . 3.960 3.183 1.722 3.687 . 0 0 "[ . 1 . 2]" 1
1404 1 134 PRO HA 1 137 VAL QG . . 3.300 2.618 1.720 2.906 . 0 0 "[ . 1 . 2]" 1
1405 1 134 PRO HA 1 137 VAL MG2 . . 3.960 3.201 2.917 4.047 0.087 14 0 "[ . 1 . 2]" 1
1406 1 134 PRO HB3 1 135 THR H . . 4.290 4.256 4.145 4.351 0.061 12 0 "[ . 1 . 2]" 1
1407 1 134 PRO HB3 1 137 VAL QG . . 4.630 4.078 3.278 4.361 . 0 0 "[ . 1 . 2]" 1
1408 1 134 PRO HD3 1 135 THR H . . 4.020 3.665 3.655 3.691 . 0 0 "[ . 1 . 2]" 1
1409 1 134 PRO HG3 1 135 THR H . . 4.180 4.129 3.992 4.260 0.080 12 0 "[ . 1 . 2]" 1
1410 1 135 THR H 1 135 THR HB . . 3.030 2.047 1.974 2.126 . 0 0 "[ . 1 . 2]" 1
1411 1 135 THR H 1 135 THR MG . . 3.700 3.548 3.438 3.618 . 0 0 "[ . 1 . 2]" 1
1412 1 135 THR H 1 136 GLN H . . 3.270 2.888 2.722 3.085 . 0 0 "[ . 1 . 2]" 1
1413 1 135 THR HA 1 135 THR MG . . 2.850 2.693 2.630 2.799 . 0 0 "[ . 1 . 2]" 1
1414 1 135 THR HA 1 137 VAL H . . 5.500 4.677 4.341 5.117 . 0 0 "[ . 1 . 2]" 1
1415 1 135 THR HA 1 137 VAL QG . . 5.440 5.105 4.004 5.471 0.031 5 0 "[ . 1 . 2]" 1
1416 1 135 THR HA 1 138 GLU HG3 . . 3.560 3.377 3.144 3.588 0.028 12 0 "[ . 1 . 2]" 1
1417 1 135 THR HA 1 139 ARG H . . 4.570 4.072 3.832 4.325 . 0 0 "[ . 1 . 2]" 1
1418 1 135 THR HB 1 136 GLN H . . 3.440 2.731 2.543 2.943 . 0 0 "[ . 1 . 2]" 1
1419 1 135 THR MG 1 136 GLN H . . 3.670 2.562 2.263 2.842 . 0 0 "[ . 1 . 2]" 1
1420 1 135 THR MG 1 136 GLN HA . . 4.030 3.010 2.802 3.184 . 0 0 "[ . 1 . 2]" 1
1421 1 135 THR MG 1 136 GLN HE21 . . 5.500 5.474 5.385 5.530 0.030 10 0 "[ . 1 . 2]" 1
1422 1 135 THR MG 1 136 GLN HG3 . . 4.090 3.341 3.244 3.519 . 0 0 "[ . 1 . 2]" 1
1423 1 136 GLN H 1 136 GLN HB3 . . 3.620 3.548 3.535 3.564 . 0 0 "[ . 1 . 2]" 1
1424 1 136 GLN H 1 136 GLN HG3 . . 3.400 2.279 2.038 2.728 . 0 0 "[ . 1 . 2]" 1
1425 1 136 GLN H 1 137 VAL H . . 3.510 2.766 2.533 2.995 . 0 0 "[ . 1 . 2]" 1
1426 1 136 GLN H 1 137 VAL QG . . 4.240 3.985 3.443 4.238 . 0 0 "[ . 1 . 2]" 1
1427 1 136 GLN H 1 138 GLU H . . 4.340 3.948 3.812 4.086 . 0 0 "[ . 1 . 2]" 1
1428 1 136 GLN HA 1 136 GLN HG3 . . 3.820 3.532 3.372 3.627 . 0 0 "[ . 1 . 2]" 1
1429 1 136 GLN HA 1 139 ARG HB3 . . 4.800 4.210 3.849 4.496 . 0 0 "[ . 1 . 2]" 1
1430 1 136 GLN HA 1 140 ILE MD . . 3.970 3.537 3.061 3.818 . 0 0 "[ . 1 . 2]" 1
1431 1 136 GLN HB3 1 136 GLN HE22 . . 4.500 3.424 3.177 3.812 . 0 0 "[ . 1 . 2]" 1
1432 1 136 GLN HB3 1 137 VAL H . . 4.010 3.729 3.232 4.036 0.026 4 0 "[ . 1 . 2]" 1
1433 1 136 GLN HB3 1 137 VAL QG . . 4.750 4.304 4.069 4.673 . 0 0 "[ . 1 . 2]" 1
1434 1 136 GLN HB3 1 140 ILE MD . . 3.550 1.984 1.768 2.189 . 0 0 "[ . 1 . 2]" 1
1435 1 136 GLN HB3 1 140 ILE MG . . 5.150 4.824 4.542 5.148 . 0 0 "[ . 1 . 2]" 1
1436 1 136 GLN HE21 1 140 ILE MD . . 4.190 3.216 2.672 3.821 . 0 0 "[ . 1 . 2]" 1
1437 1 136 GLN HE22 1 136 GLN HG3 . . 3.770 3.712 3.554 3.803 0.033 7 0 "[ . 1 . 2]" 1
1438 1 136 GLN HE22 1 140 ILE MD . . 4.310 3.583 2.868 3.887 . 0 0 "[ . 1 . 2]" 1
1439 1 136 GLN HG3 1 137 VAL H . . 4.390 4.151 3.931 4.350 . 0 0 "[ . 1 . 2]" 1
1440 1 136 GLN HG3 1 140 ILE MD . . 4.670 4.513 4.147 4.683 0.013 7 0 "[ . 1 . 2]" 1
1441 1 137 VAL H 1 137 VAL HB . . 3.500 2.370 2.247 2.481 . 0 0 "[ . 1 . 2]" 1
1442 1 137 VAL H 1 137 VAL MG1 . . 3.720 3.331 1.894 3.709 . 0 0 "[ . 1 . 2]" 1
1443 1 137 VAL H 1 137 VAL QG . . 3.040 2.096 1.888 2.352 . 0 0 "[ . 1 . 2]" 1
1444 1 137 VAL H 1 137 VAL MG2 . . 3.720 2.471 1.930 3.714 . 0 0 "[ . 1 . 2]" 1
1445 1 137 VAL H 1 138 GLU H . . 3.560 2.698 2.492 2.953 . 0 0 "[ . 1 . 2]" 1
1446 1 137 VAL HA 1 137 VAL MG1 . . 3.290 2.650 2.450 3.209 . 0 0 "[ . 1 . 2]" 1
1447 1 137 VAL HA 1 137 VAL MG2 . . 3.290 2.400 2.310 2.516 . 0 0 "[ . 1 . 2]" 1
1448 1 137 VAL HA 1 140 ILE HB . . 4.800 3.082 2.922 3.224 . 0 0 "[ . 1 . 2]" 1
1449 1 137 VAL HA 1 140 ILE MD . . 3.800 3.582 3.017 3.836 0.036 10 0 "[ . 1 . 2]" 1
1450 1 137 VAL HA 1 140 ILE MG . . 4.340 4.221 4.091 4.353 0.013 20 0 "[ . 1 . 2]" 1
1451 1 137 VAL HA 1 141 PHE QD . . 3.940 2.808 2.459 3.152 . 0 0 "[ . 1 . 2]" 1
1452 1 137 VAL HA 1 141 PHE QE . . 4.100 2.760 2.269 3.650 . 0 0 "[ . 1 . 2]" 1
1453 1 137 VAL HB 1 138 GLU H . . 4.330 3.213 2.848 4.170 . 0 0 "[ . 1 . 2]" 1
1454 1 137 VAL QG 1 138 GLU H . . 3.400 3.167 2.111 3.437 0.037 6 0 "[ . 1 . 2]" 1
1455 1 137 VAL QG 1 138 GLU HA . . 3.970 3.412 3.083 3.559 . 0 0 "[ . 1 . 2]" 1
1456 1 137 VAL QG 1 138 GLU HG3 . . 4.440 4.067 3.097 4.468 0.028 13 0 "[ . 1 . 2]" 1
1457 1 137 VAL QG 1 140 ILE MD . . 4.800 3.972 3.607 4.755 . 0 0 "[ . 1 . 2]" 1
1458 1 137 VAL QG 1 141 PHE QD . . 3.260 1.827 1.746 1.961 . 0 0 "[ . 1 . 2]" 1
1459 1 137 VAL QG 1 141 PHE QE . . 3.540 2.083 1.822 2.753 . 0 0 "[ . 1 . 2]" 1
1460 1 137 VAL MG1 1 138 GLU H . . 4.070 3.375 2.128 3.739 . 0 0 "[ . 1 . 2]" 1
1461 1 137 VAL MG1 1 138 GLU HA . . 5.500 3.529 3.434 3.607 . 0 0 "[ . 1 . 2]" 1
1462 1 137 VAL MG1 1 138 GLU HG3 . . 5.490 4.227 3.136 4.722 . 0 0 "[ . 1 . 2]" 1
1463 1 137 VAL MG1 1 141 PHE QD . . 4.000 2.288 1.775 4.042 0.042 18 0 "[ . 1 . 2]" 1
1464 1 137 VAL MG1 1 141 PHE QE . . 4.030 2.740 1.973 4.175 0.145 12 0 "[ . 1 . 2]" 1
1465 1 137 VAL MG2 1 138 GLU H . . 4.070 3.960 3.508 4.102 0.032 1 0 "[ . 1 . 2]" 1
1466 1 137 VAL MG2 1 138 GLU HA . . 5.500 5.061 3.445 5.464 . 0 0 "[ . 1 . 2]" 1
1467 1 137 VAL MG2 1 138 GLU HG3 . . 5.490 5.374 4.731 5.531 0.041 15 0 "[ . 1 . 2]" 1
1468 1 137 VAL MG2 1 141 PHE QD . . 4.000 3.171 1.748 3.767 . 0 0 "[ . 1 . 2]" 1
1469 1 137 VAL MG2 1 141 PHE QE . . 4.030 2.325 1.950 3.033 . 0 0 "[ . 1 . 2]" 1
1470 1 138 GLU H 1 138 GLU HG3 . . 3.530 3.071 2.816 3.525 . 0 0 "[ . 1 . 2]" 1
1471 1 138 GLU H 1 139 ARG H . . 3.360 2.538 2.363 2.850 . 0 0 "[ . 1 . 2]" 1
1472 1 138 GLU HA 1 138 GLU HG3 . . 3.660 3.426 3.314 3.583 . 0 0 "[ . 1 . 2]" 1
1473 1 138 GLU HA 1 139 ARG H . . 3.610 3.620 3.575 3.646 0.036 14 0 "[ . 1 . 2]" 1
1474 1 139 ARG H 1 139 ARG HB3 . . 3.690 3.540 3.499 3.569 . 0 0 "[ . 1 . 2]" 1
1475 1 139 ARG H 1 139 ARG HG3 . . 3.760 2.621 1.947 3.819 0.059 12 0 "[ . 1 . 2]" 1
1476 1 139 ARG HA 1 139 ARG HB3 . . 2.940 2.584 2.496 2.678 . 0 0 "[ . 1 . 2]" 1
1477 1 139 ARG HA 1 139 ARG HG3 . . 3.530 2.965 2.338 3.233 . 0 0 "[ . 1 . 2]" 1
1478 1 139 ARG HA 1 142 GLN HE21 . . 3.860 2.687 2.274 3.062 . 0 0 "[ . 1 . 2]" 1
1479 1 139 ARG HA 1 142 GLN HE22 . . 3.710 3.343 3.011 3.715 0.005 13 0 "[ . 1 . 2]" 1
1480 1 139 ARG HB3 1 140 ILE HA . . 4.560 4.113 3.923 4.311 . 0 0 "[ . 1 . 2]" 1
1481 1 139 ARG HB3 1 142 GLN HE22 . . 4.190 4.043 3.759 4.209 0.019 1 0 "[ . 1 . 2]" 1
1482 1 140 ILE H 1 140 ILE HB . . 3.700 2.480 2.431 2.635 . 0 0 "[ . 1 . 2]" 1
1483 1 140 ILE H 1 140 ILE MD . . 3.950 3.366 2.970 3.620 . 0 0 "[ . 1 . 2]" 1
1484 1 140 ILE H 1 140 ILE HG13 . . 3.950 1.940 1.899 1.985 . 0 0 "[ . 1 . 2]" 1
1485 1 140 ILE H 1 140 ILE MG . . 3.880 3.709 3.697 3.716 . 0 0 "[ . 1 . 2]" 1
1486 1 140 ILE H 1 141 PHE H . . 3.570 2.993 2.891 3.118 . 0 0 "[ . 1 . 2]" 1
1487 1 140 ILE HA 1 140 ILE MD . . 3.860 3.812 3.639 3.887 0.027 12 0 "[ . 1 . 2]" 1
1488 1 140 ILE HA 1 140 ILE HG13 . . 3.490 2.931 2.729 3.392 . 0 0 "[ . 1 . 2]" 1
1489 1 140 ILE HA 1 140 ILE MG . . 3.370 2.486 2.326 2.539 . 0 0 "[ . 1 . 2]" 1
1490 1 140 ILE HB 1 140 ILE MD . . 3.060 2.292 2.191 2.528 . 0 0 "[ . 1 . 2]" 1
1491 1 140 ILE HB 1 141 PHE H . . 3.930 2.442 2.070 2.723 . 0 0 "[ . 1 . 2]" 1
1492 1 140 ILE MD 1 140 ILE MG . . 2.860 2.068 1.832 2.289 . 0 0 "[ . 1 . 2]" 1
1493 1 140 ILE MD 1 141 PHE H . . 4.490 4.341 3.900 4.507 0.017 8 0 "[ . 1 . 2]" 1
1494 1 140 ILE MD 1 141 PHE QE . . 4.010 3.545 3.334 3.853 . 0 0 "[ . 1 . 2]" 1
1495 1 140 ILE HG13 1 140 ILE MG . . 3.350 3.225 3.184 3.240 . 0 0 "[ . 1 . 2]" 1
1496 1 140 ILE HG13 1 141 PHE H . . 4.650 4.269 3.897 4.405 . 0 0 "[ . 1 . 2]" 1
1497 1 140 ILE MG 1 141 PHE H . . 3.770 3.212 2.885 3.405 . 0 0 "[ . 1 . 2]" 1
1498 1 140 ILE MG 1 141 PHE HA . . 4.130 3.529 3.362 3.752 . 0 0 "[ . 1 . 2]" 1
1499 1 140 ILE MG 1 141 PHE QD . . 4.050 2.056 1.968 2.585 . 0 0 "[ . 1 . 2]" 1
1500 1 140 ILE MG 1 141 PHE QE . . 4.040 1.905 1.831 2.088 . 0 0 "[ . 1 . 2]" 1
1501 1 140 ILE MG 1 142 GLN H . . 4.920 4.773 4.602 4.933 0.013 18 0 "[ . 1 . 2]" 1
1502 1 141 PHE H 1 141 PHE QD . . 3.990 2.992 2.826 3.135 . 0 0 "[ . 1 . 2]" 1
1503 1 141 PHE H 1 142 GLN H . . 4.480 3.620 3.388 3.750 . 0 0 "[ . 1 . 2]" 1
1504 1 141 PHE HA 1 141 PHE QD . . 4.130 2.389 2.230 2.573 . 0 0 "[ . 1 . 2]" 1
1505 1 141 PHE HA 1 142 GLN H . . 3.630 2.529 2.432 2.639 . 0 0 "[ . 1 . 2]" 1
1506 1 142 GLN H 1 142 GLN HE21 . . 4.250 3.749 3.649 3.830 . 0 0 "[ . 1 . 2]" 1
1507 1 142 GLN H 1 145 VAL H . . 4.250 3.816 3.719 4.029 . 0 0 "[ . 1 . 2]" 1
1508 1 142 GLN H 1 145 VAL MG1 . . 4.080 3.211 3.079 3.498 . 0 0 "[ . 1 . 2]" 1
1509 1 142 GLN H 1 145 VAL MG2 . . 4.080 3.349 3.198 3.753 . 0 0 "[ . 1 . 2]" 1
1510 1 142 GLN HA 1 145 VAL H . . 5.100 4.411 4.389 4.467 . 0 0 "[ . 1 . 2]" 1
1511 1 142 GLN HE21 1 145 VAL MG1 . . 4.450 4.380 4.171 4.470 0.020 7 0 "[ . 1 . 2]" 1
1512 1 142 GLN HE21 1 145 VAL QG . . 3.840 2.301 1.911 2.905 . 0 0 "[ . 1 . 2]" 1
1513 1 142 GLN HE21 1 145 VAL MG2 . . 4.450 2.311 1.914 2.943 . 0 0 "[ . 1 . 2]" 1
1514 1 142 GLN HE22 1 145 VAL QG . . 4.210 3.082 2.910 3.269 . 0 0 "[ . 1 . 2]" 1
1515 1 143 GLU H 1 143 GLU HG3 . . 4.900 4.409 4.268 4.474 . 0 0 "[ . 1 . 2]" 1
1516 1 143 GLU HA 1 143 GLU HG3 . . 3.650 2.581 2.362 2.731 . 0 0 "[ . 1 . 2]" 1
1517 1 143 GLU HA 1 146 TYR H . . 4.270 2.743 2.706 2.858 . 0 0 "[ . 1 . 2]" 1
1518 1 143 GLU HA 1 146 TYR HA . . 4.500 4.561 4.521 4.631 0.131 14 0 "[ . 1 . 2]" 1
1519 1 143 GLU HA 1 146 TYR QE . . 5.500 5.336 3.500 5.501 0.001 3 0 "[ . 1 . 2]" 1
1520 1 143 GLU HA 1 147 LYS H . . 4.500 4.160 3.901 4.531 0.031 13 0 "[ . 1 . 2]" 1
1521 1 143 GLU HG3 1 147 LYS HG3 . . 4.770 4.188 3.368 4.691 . 0 0 "[ . 1 . 2]" 1
1522 1 144 SER H 1 145 VAL H . . 4.480 2.804 2.759 2.829 . 0 0 "[ . 1 . 2]" 1
1523 1 144 SER H 1 145 VAL QG . . 4.620 4.363 4.299 4.622 0.002 16 0 "[ . 1 . 2]" 1
1524 1 144 SER HA 1 147 LYS H . . 4.720 3.882 3.780 4.215 . 0 0 "[ . 1 . 2]" 1
1525 1 144 SER HA 1 147 LYS HG3 . . 4.840 2.932 2.421 3.855 . 0 0 "[ . 1 . 2]" 1
1526 1 145 VAL H 1 145 VAL HB . . 3.830 2.258 2.167 2.296 . 0 0 "[ . 1 . 2]" 1
1527 1 145 VAL H 1 145 VAL MG1 . . 3.460 3.632 3.465 3.674 0.214 11 0 "[ . 1 . 2]" 1
1528 1 145 VAL H 1 145 VAL QG . . 2.860 2.668 2.601 2.878 0.018 16 0 "[ . 1 . 2]" 1
1529 1 145 VAL H 1 145 VAL MG2 . . 3.460 2.749 2.660 3.076 . 0 0 "[ . 1 . 2]" 1
1530 1 145 VAL H 1 146 TYR H . . 3.820 2.118 2.098 2.178 . 0 0 "[ . 1 . 2]" 1
1531 1 145 VAL H 1 147 LYS H . . 4.770 3.820 3.721 4.023 . 0 0 "[ . 1 . 2]" 1
1532 1 145 VAL HA 1 145 VAL MG1 . . 3.310 2.598 2.568 2.736 . 0 0 "[ . 1 . 2]" 1
1533 1 145 VAL HA 1 145 VAL QG . . 2.720 2.158 2.044 2.177 . 0 0 "[ . 1 . 2]" 1
1534 1 145 VAL HA 1 145 VAL MG2 . . 3.310 2.310 2.110 2.351 . 0 0 "[ . 1 . 2]" 1
1535 1 145 VAL HA 1 148 THR H . . 4.100 3.538 3.035 3.717 . 0 0 "[ . 1 . 2]" 1
1536 1 145 VAL HA 1 148 THR HB . . 3.800 3.321 2.813 3.703 . 0 0 "[ . 1 . 2]" 1
1537 1 145 VAL HA 1 149 GLN H . . 4.630 4.448 4.080 4.645 0.015 4 0 "[ . 1 . 2]" 1
1538 1 145 VAL HB 1 146 TYR HA . . 5.270 4.557 4.500 4.711 . 0 0 "[ . 1 . 2]" 1
1539 1 145 VAL QG 1 146 TYR H . . 3.630 3.268 2.779 3.389 . 0 0 "[ . 1 . 2]" 1
1540 1 145 VAL QG 1 146 TYR HA . . 4.320 3.292 2.902 3.415 . 0 0 "[ . 1 . 2]" 1
1541 1 145 VAL QG 1 148 THR H . . 4.630 4.324 3.808 4.600 . 0 0 "[ . 1 . 2]" 1
1542 1 145 VAL QG 1 148 THR HB . . 4.150 3.523 2.685 3.780 . 0 0 "[ . 1 . 2]" 1
1543 1 145 VAL QG 1 149 GLN H . . 4.200 3.655 3.286 3.905 . 0 0 "[ . 1 . 2]" 1
1544 1 145 VAL QG 1 149 GLN QE . . 3.990 3.243 1.740 3.863 . 0 0 "[ . 1 . 2]" 1
1545 1 145 VAL MG1 1 146 TYR H . . 4.130 3.435 2.821 3.607 . 0 0 "[ . 1 . 2]" 1
1546 1 145 VAL MG1 1 148 THR HB . . 4.810 3.667 2.766 3.994 . 0 0 "[ . 1 . 2]" 1
1547 1 145 VAL MG2 1 146 TYR H . . 4.130 4.136 4.098 4.185 0.055 16 0 "[ . 1 . 2]" 1
1548 1 145 VAL MG2 1 148 THR HB . . 4.810 4.594 3.628 4.817 0.007 18 0 "[ . 1 . 2]" 1
1549 1 146 TYR H 1 147 LYS H . . 4.330 2.672 2.559 2.980 . 0 0 "[ . 1 . 2]" 1
1550 1 146 TYR HA 1 146 TYR QD . . 4.230 2.187 2.002 2.903 . 0 0 "[ . 1 . 2]" 1
1551 1 146 TYR HA 1 149 GLN H . . 4.370 3.792 3.310 4.096 . 0 0 "[ . 1 . 2]" 1
1552 1 147 LYS H 1 147 LYS HB3 . . 3.730 3.540 3.515 3.565 . 0 0 "[ . 1 . 2]" 1
1553 1 147 LYS H 1 147 LYS HG3 . . 3.960 3.063 2.155 3.448 . 0 0 "[ . 1 . 2]" 1
1554 1 147 LYS H 1 148 THR H . . 3.330 2.852 2.476 3.037 . 0 0 "[ . 1 . 2]" 1
1555 1 147 LYS HA 1 147 LYS HG3 . . 3.810 3.752 3.621 3.824 0.014 1 0 "[ . 1 . 2]" 1
1556 1 147 LYS HA 1 150 GLN H . . 4.200 3.715 3.215 4.156 . 0 0 "[ . 1 . 2]" 1
1557 1 147 LYS HB3 1 148 THR H . . 4.070 3.549 3.324 4.003 . 0 0 "[ . 1 . 2]" 1
1558 1 148 THR H 1 148 THR HB . . 3.350 2.344 2.173 2.536 . 0 0 "[ . 1 . 2]" 1
1559 1 148 THR H 1 148 THR MG . . 3.720 3.668 3.641 3.680 . 0 0 "[ . 1 . 2]" 1
1560 1 148 THR H 1 149 GLN H . . 3.330 3.073 2.866 3.231 . 0 0 "[ . 1 . 2]" 1
1561 1 148 THR HA 1 148 THR MG . . 2.760 2.439 2.310 2.603 . 0 0 "[ . 1 . 2]" 1
1562 1 148 THR HA 1 149 GLN QE . . 5.320 4.952 4.043 5.322 0.002 16 0 "[ . 1 . 2]" 1
1563 1 148 THR HA 1 151 THR H . . 4.470 3.364 2.985 3.874 . 0 0 "[ . 1 . 2]" 1
1564 1 148 THR HA 1 151 THR HB . . 3.860 2.484 1.999 2.995 . 0 0 "[ . 1 . 2]" 1
1565 1 148 THR HA 1 152 ILE MD . . 4.080 3.562 3.395 3.788 . 0 0 "[ . 1 . 2]" 1
1566 1 148 THR HB 1 149 GLN H . . 4.050 2.357 2.169 2.738 . 0 0 "[ . 1 . 2]" 1
1567 1 148 THR HB 1 149 GLN QE . . 4.640 3.172 1.999 4.098 . 0 0 "[ . 1 . 2]" 1
1568 1 148 THR MG 1 149 GLN H . . 3.590 3.036 2.732 3.546 . 0 0 "[ . 1 . 2]" 1
1569 1 148 THR MG 1 152 ILE H . . 4.150 4.059 3.621 4.162 0.012 10 0 "[ . 1 . 2]" 1
1570 1 148 THR MG 1 152 ILE HB . . 4.710 4.181 3.954 4.423 . 0 0 "[ . 1 . 2]" 1
1571 1 148 THR MG 1 152 ILE MD . . 3.150 1.749 1.622 1.914 . 0 0 "[ . 1 . 2]" 1
1572 1 148 THR MG 1 152 ILE MG . . 4.650 4.310 4.062 4.539 . 0 0 "[ . 1 . 2]" 1
1573 1 149 GLN H 1 152 ILE MD . . 4.450 3.098 2.772 3.609 . 0 0 "[ . 1 . 2]" 1
1574 1 149 GLN HA 1 152 ILE HB . . 3.920 2.557 2.238 2.990 . 0 0 "[ . 1 . 2]" 1
1575 1 149 GLN HA 1 152 ILE MD . . 3.320 1.990 1.794 2.378 . 0 0 "[ . 1 . 2]" 1
1576 1 149 GLN HA 1 152 ILE MG . . 4.270 3.923 3.479 4.287 0.017 15 0 "[ . 1 . 2]" 1
1577 1 149 GLN QE 1 152 ILE MD . . 4.640 2.307 1.729 4.038 . 0 0 "[ . 1 . 2]" 1
1578 1 150 GLN H 1 150 GLN HB3 . . 4.140 2.294 2.214 2.489 . 0 0 "[ . 1 . 2]" 1
1579 1 150 GLN H 1 151 THR H . . 4.030 2.691 2.308 3.149 . 0 0 "[ . 1 . 2]" 1
1580 1 150 GLN HA 1 151 THR HA . . 5.050 4.736 4.669 4.868 . 0 0 "[ . 1 . 2]" 1
1581 1 150 GLN HA 1 152 ILE H . . 4.550 4.172 3.814 4.587 0.037 11 0 "[ . 1 . 2]" 1
1582 1 150 GLN HA 1 153 TRP H . . 4.430 3.391 3.136 3.787 . 0 0 "[ . 1 . 2]" 1
1583 1 150 GLN QE 1 151 THR HA . . 4.180 3.580 2.892 4.203 0.023 3 0 "[ . 1 . 2]" 1
1584 1 150 GLN QE 1 153 TRP H . . 5.340 4.749 3.774 5.237 . 0 0 "[ . 1 . 2]" 1
1585 1 150 GLN QE 1 154 LYS H . . 4.230 3.274 2.291 4.238 0.008 3 0 "[ . 1 . 2]" 1
1586 1 150 GLN HE21 1 154 LYS H . . 4.980 3.779 2.393 4.831 . 0 0 "[ . 1 . 2]" 1
1587 1 150 GLN HE22 1 154 LYS H . . 4.980 3.651 2.924 4.690 . 0 0 "[ . 1 . 2]" 1
1588 1 150 GLN HG3 1 151 THR HA . . 5.500 3.414 2.974 3.767 . 0 0 "[ . 1 . 2]" 1
1589 1 151 THR H 1 151 THR HB . . 3.510 2.139 2.045 2.283 . 0 0 "[ . 1 . 2]" 1
1590 1 151 THR H 1 151 THR MG . . 3.710 3.606 3.499 3.690 . 0 0 "[ . 1 . 2]" 1
1591 1 151 THR H 1 152 ILE H . . 3.820 2.484 2.270 2.937 . 0 0 "[ . 1 . 2]" 1
1592 1 151 THR H 1 152 ILE MD . . 4.640 4.312 4.003 4.643 0.003 12 0 "[ . 1 . 2]" 1
1593 1 151 THR H 1 153 TRP H . . 4.960 3.954 3.650 4.368 . 0 0 "[ . 1 . 2]" 1
1594 1 151 THR HA 1 151 THR MG . . 2.780 2.596 2.432 2.707 . 0 0 "[ . 1 . 2]" 1
1595 1 151 THR HA 1 154 LYS H . . 4.180 3.440 2.864 3.660 . 0 0 "[ . 1 . 2]" 1
1596 1 151 THR HA 1 155 GLU H . . 4.230 4.098 3.759 4.308 0.078 17 0 "[ . 1 . 2]" 1
1597 1 151 THR HB 1 152 ILE H . . 3.680 3.117 2.792 3.414 . 0 0 "[ . 1 . 2]" 1
1598 1 151 THR MG 1 152 ILE H . . 3.710 3.511 2.960 3.714 0.004 17 0 "[ . 1 . 2]" 1
1599 1 151 THR MG 1 152 ILE HA . . 4.390 3.492 3.026 3.682 . 0 0 "[ . 1 . 2]" 1
1600 1 151 THR MG 1 153 TRP H . . 5.300 4.936 4.476 5.302 0.002 20 0 "[ . 1 . 2]" 1
1601 1 151 THR MG 1 154 LYS H . . 5.210 4.865 4.078 5.226 0.016 15 0 "[ . 1 . 2]" 1
1602 1 151 THR MG 1 155 GLU HG3 . . 3.920 2.764 2.195 4.012 0.092 6 0 "[ . 1 . 2]" 1
1603 1 152 ILE H 1 152 ILE HB . . 3.680 2.420 2.317 2.509 . 0 0 "[ . 1 . 2]" 1
1604 1 152 ILE H 1 152 ILE MD . . 3.360 3.114 2.894 3.366 0.006 12 0 "[ . 1 . 2]" 1
1605 1 152 ILE H 1 152 ILE MG . . 3.910 3.718 3.693 3.762 . 0 0 "[ . 1 . 2]" 1
1606 1 152 ILE H 1 153 TRP H . . 4.180 2.438 2.193 2.687 . 0 0 "[ . 1 . 2]" 1
1607 1 152 ILE HA 1 152 ILE MD . . 4.030 3.883 3.846 3.921 . 0 0 "[ . 1 . 2]" 1
1608 1 152 ILE HA 1 152 ILE MG . . 3.260 2.410 2.252 2.536 . 0 0 "[ . 1 . 2]" 1
1609 1 152 ILE HA 1 155 GLU H . . 4.570 3.334 2.851 3.675 . 0 0 "[ . 1 . 2]" 1
1610 1 152 ILE HB 1 152 ILE MD . . 3.160 2.184 2.073 2.262 . 0 0 "[ . 1 . 2]" 1
1611 1 152 ILE HB 1 153 TRP H . . 4.200 2.940 2.486 3.304 . 0 0 "[ . 1 . 2]" 1
1612 1 152 ILE MD 1 153 TRP H . . 4.790 4.464 4.143 4.771 . 0 0 "[ . 1 . 2]" 1
1613 1 152 ILE MG 1 153 TRP H . . 3.980 3.718 3.189 3.962 . 0 0 "[ . 1 . 2]" 1
1614 1 152 ILE MG 1 153 TRP HA . . 4.440 3.694 3.365 3.945 . 0 0 "[ . 1 . 2]" 1
1615 1 152 ILE MG 1 155 GLU H . . 5.040 4.522 4.181 4.822 . 0 0 "[ . 1 . 2]" 1
1616 1 153 TRP H 1 153 TRP HB3 . . 4.130 2.469 2.310 2.603 . 0 0 "[ . 1 . 2]" 1
1617 1 153 TRP H 1 154 LYS HA . . 5.260 5.103 4.776 5.254 . 0 0 "[ . 1 . 2]" 1
1618 1 153 TRP H 1 156 THR MG . . 4.530 4.477 4.051 4.653 0.123 11 0 "[ . 1 . 2]" 1
1619 1 153 TRP HA 1 153 TRP HE1 . . 5.180 4.941 4.717 5.121 . 0 0 "[ . 1 . 2]" 1
1620 1 153 TRP HA 1 156 THR HB . . 4.510 2.898 2.344 4.395 . 0 0 "[ . 1 . 2]" 1
1621 1 153 TRP HA 1 156 THR MG . . 4.030 2.029 1.770 2.363 . 0 0 "[ . 1 . 2]" 1
1622 1 153 TRP HE1 1 156 THR MG . . 4.480 3.755 3.257 4.441 . 0 0 "[ . 1 . 2]" 1
1623 1 154 LYS H 1 154 LYS HB3 . . 3.690 2.443 2.153 3.512 . 0 0 "[ . 1 . 2]" 1
1624 1 154 LYS H 1 154 LYS HG3 . . 4.740 3.178 1.968 4.704 . 0 0 "[ . 1 . 2]" 1
1625 1 154 LYS H 1 155 GLU H . . 3.940 2.570 2.181 2.835 . 0 0 "[ . 1 . 2]" 1
1626 1 154 LYS H 1 157 ARG HE . . 5.100 4.702 3.853 5.111 0.011 6 0 "[ . 1 . 2]" 1
1627 1 154 LYS HA 1 156 THR MG . . 4.380 4.156 3.855 4.383 0.003 12 0 "[ . 1 . 2]" 1
1628 1 154 LYS HA 1 157 ARG HE . . 4.770 2.089 1.892 2.477 . 0 0 "[ . 1 . 2]" 1
1629 1 154 LYS HA 1 157 ARG HG3 . . 4.360 2.479 1.994 4.534 0.174 11 0 "[ . 1 . 2]" 1
1630 1 154 LYS HB3 1 155 GLU H . . 4.450 3.802 2.591 4.223 . 0 0 "[ . 1 . 2]" 1
1631 1 154 LYS HB3 1 157 ARG HE . . 5.160 4.089 3.118 5.151 . 0 0 "[ . 1 . 2]" 1
1632 1 154 LYS HE3 1 154 LYS HG3 . . 4.040 3.365 2.845 4.068 0.028 3 0 "[ . 1 . 2]" 1
1633 1 154 LYS HG3 1 157 ARG HE . . 5.500 4.862 3.890 5.354 . 0 0 "[ . 1 . 2]" 1
1634 1 155 GLU H 1 156 THR H . . 3.840 2.333 2.180 2.845 . 0 0 "[ . 1 . 2]" 1
1635 1 155 GLU H 1 156 THR HB . . 5.150 4.317 4.015 5.238 0.088 11 0 "[ . 1 . 2]" 1
1636 1 155 GLU HA 1 155 GLU HG3 . . 3.820 3.194 2.464 3.630 . 0 0 "[ . 1 . 2]" 1
1637 1 155 GLU HA 1 157 ARG H . . 4.160 3.682 3.404 3.967 . 0 0 "[ . 1 . 2]" 1
1638 1 155 GLU HA 1 158 ASN H . . 3.840 3.360 2.971 3.868 0.028 11 0 "[ . 1 . 2]" 1
1639 1 155 GLU HA 1 158 ASN HD21 . . 4.000 3.918 3.722 4.017 0.017 18 0 "[ . 1 . 2]" 1
1640 1 155 GLU HA 1 158 ASN HD22 . . 4.700 4.483 4.125 4.729 0.029 11 0 "[ . 1 . 2]" 1
1641 1 155 GLU HG3 1 156 THR H . . 5.440 4.861 1.946 5.444 0.004 14 0 "[ . 1 . 2]" 1
1642 1 156 THR H 1 156 THR HB . . 4.010 2.238 2.124 2.489 . 0 0 "[ . 1 . 2]" 1
1643 1 156 THR H 1 156 THR MG . . 4.030 2.540 2.090 2.701 . 0 0 "[ . 1 . 2]" 1
1644 1 156 THR H 1 157 ARG H . . 4.410 2.631 2.489 2.759 . 0 0 "[ . 1 . 2]" 1
1645 1 156 THR HA 1 156 THR MG . . 3.270 3.199 3.181 3.243 . 0 0 "[ . 1 . 2]" 1
1646 1 156 THR HA 1 158 ASN H . . 4.210 3.729 3.456 4.082 . 0 0 "[ . 1 . 2]" 1
1647 1 156 THR HA 1 159 MET ME . . 3.760 2.017 1.821 2.428 . 0 0 "[ . 1 . 2]" 1
1648 1 156 THR MG 1 157 ARG H . . 4.080 2.401 2.155 2.736 . 0 0 "[ . 1 . 2]" 1
1649 1 156 THR MG 1 157 ARG HD3 . . 4.620 3.764 2.771 4.189 . 0 0 "[ . 1 . 2]" 1
1650 1 156 THR MG 1 159 MET ME . . 4.520 4.049 3.404 4.486 . 0 0 "[ . 1 . 2]" 1
1651 1 157 ARG H 1 158 ASN H . . 4.250 2.451 2.319 2.685 . 0 0 "[ . 1 . 2]" 1
1652 1 157 ARG H 1 159 MET ME . . 5.050 4.728 4.331 5.013 . 0 0 "[ . 1 . 2]" 1
1653 1 157 ARG HA 1 157 ARG HG3 . . 3.910 3.459 2.282 3.751 . 0 0 "[ . 1 . 2]" 1
1654 1 157 ARG HB3 1 158 ASN HD21 . . 4.700 4.050 2.709 4.476 . 0 0 "[ . 1 . 2]" 1
1655 1 158 ASN H 1 158 ASN HB3 . . 4.000 3.450 3.412 3.571 . 0 0 "[ . 1 . 2]" 1
1656 1 158 ASN HA 1 158 ASN HD21 . . 4.070 2.265 2.023 2.899 . 0 0 "[ . 1 . 2]" 1
1657 1 158 ASN HB3 1 159 MET H . . 4.070 3.234 2.579 3.857 . 0 0 "[ . 1 . 2]" 1
1658 1 159 MET H 1 159 MET ME . . 3.580 3.419 2.830 3.744 0.164 1 0 "[ . 1 . 2]" 1
1659 1 159 MET H 1 159 MET HG3 . . 3.570 2.476 1.962 3.653 0.083 5 0 "[ . 1 . 2]" 1
1660 1 160 VAL H 1 160 VAL HB . . 3.600 2.983 2.140 3.546 . 0 0 "[ . 1 . 2]" 1
1661 1 160 VAL H 1 160 VAL MG1 . . 3.820 2.225 1.851 3.644 . 0 0 "[ . 1 . 2]" 1
1662 1 160 VAL H 1 160 VAL QG . . 3.270 1.978 1.782 2.577 . 0 0 "[ . 1 . 2]" 1
1663 1 160 VAL H 1 160 VAL MG2 . . 3.820 2.732 1.912 3.709 . 0 0 "[ . 1 . 2]" 1
1664 1 160 VAL H 1 161 GLN H . . 4.020 2.639 2.446 2.989 . 0 0 "[ . 1 . 2]" 1
1665 1 160 VAL HA 1 160 VAL MG1 . . 3.240 2.718 2.349 3.220 . 0 0 "[ . 1 . 2]" 1
1666 1 160 VAL HA 1 160 VAL QG . . 2.720 2.275 2.037 2.435 . 0 0 "[ . 1 . 2]" 1
1667 1 160 VAL HA 1 160 VAL MG2 . . 3.240 2.763 2.081 3.220 . 0 0 "[ . 1 . 2]" 1
1668 1 160 VAL HB 1 161 GLN H . . 4.430 3.657 2.447 4.035 . 0 0 "[ . 1 . 2]" 1
1669 1 160 VAL QG 1 161 GLN H . . 3.870 1.994 1.780 3.122 . 0 0 "[ . 1 . 2]" 1
1670 1 160 VAL QG 1 161 GLN QE . . 4.070 3.465 2.161 4.091 0.021 5 0 "[ . 1 . 2]" 1
1671 1 161 GLN H 1 161 GLN HB3 . . 3.360 2.965 2.823 3.337 . 0 0 "[ . 1 . 2]" 1
1672 1 161 GLN HA 1 161 GLN HE21 . . 4.400 2.674 1.946 4.053 . 0 0 "[ . 1 . 2]" 1
1673 1 161 GLN HA 1 161 GLN QE . . 3.860 2.550 1.927 3.729 . 0 0 "[ . 1 . 2]" 1
1674 1 161 GLN HA 1 161 GLN HE22 . . 4.400 3.495 3.019 4.355 . 0 0 "[ . 1 . 2]" 1
1675 1 163 GLN H 1 163 GLN HG3 . . 4.980 4.335 3.113 4.940 . 0 0 "[ . 1 . 2]" 1
1676 1 163 GLN HA 1 163 GLN HG3 . . 3.670 2.822 2.202 3.585 . 0 0 "[ . 1 . 2]" 1
1677 1 163 GLN HE21 1 163 GLN HG3 . . 3.310 2.680 2.138 3.493 0.183 16 0 "[ . 1 . 2]" 1
1678 1 163 GLN HE22 1 163 GLN HG3 . . 3.930 3.704 3.460 4.117 0.187 16 0 "[ . 1 . 2]" 1
1679 1 164 PHE HA 1 165 ILE H . . 3.210 2.766 2.554 2.937 . 0 0 "[ . 1 . 2]" 1
1680 1 164 PHE HB3 1 165 ILE H . . 4.870 3.563 2.529 4.325 . 0 0 "[ . 1 . 2]" 1
1681 1 165 ILE H 1 165 ILE HB . . 3.530 2.492 2.090 2.918 . 0 0 "[ . 1 . 2]" 1
1682 1 165 ILE H 1 165 ILE HG13 . . 4.670 3.716 2.215 4.590 . 0 0 "[ . 1 . 2]" 1
1683 1 165 ILE H 1 165 ILE MG . . 4.480 3.595 2.455 3.955 . 0 0 "[ . 1 . 2]" 1
1684 1 165 ILE HA 1 165 ILE MD . . 3.800 2.610 1.891 3.767 . 0 0 "[ . 1 . 2]" 1
1685 1 165 ILE HA 1 165 ILE HG13 . . 3.950 3.177 2.106 3.876 . 0 0 "[ . 1 . 2]" 1
1686 1 165 ILE HA 1 165 ILE MG . . 3.340 2.567 2.165 3.193 . 0 0 "[ . 1 . 2]" 1
1687 1 165 ILE HA 1 166 ALA H . . 2.560 2.356 2.250 2.457 . 0 0 "[ . 1 . 2]" 1
1688 1 165 ILE HB 1 165 ILE MD . . 3.600 2.773 2.086 3.206 . 0 0 "[ . 1 . 2]" 1
1689 1 165 ILE HB 1 166 ALA H . . 4.210 3.979 3.578 4.179 . 0 0 "[ . 1 . 2]" 1
1690 1 165 ILE MD 1 166 ALA H . . 4.650 3.846 2.926 4.655 0.005 14 0 "[ . 1 . 2]" 1
1691 1 165 ILE MG 1 166 ALA H . . 3.550 2.304 1.861 3.414 . 0 0 "[ . 1 . 2]" 1
1692 1 166 ALA H 1 166 ALA MB . . 3.060 2.068 1.932 2.432 . 0 0 "[ . 1 . 2]" 1
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