NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
467557 |
2ksr   |
16672 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ksr
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 1435
_Distance_constraint_stats_list.Viol_count 1456
_Distance_constraint_stats_list.Viol_total 647.038
_Distance_constraint_stats_list.Viol_max 0.255
_Distance_constraint_stats_list.Viol_rms 0.0087
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0011
_Distance_constraint_stats_list.Viol_average_violations_only 0.0222
_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 25 ARG 0.012 0.003 12 0 "[ . 1 . 2]"
1 26 ARG 0.462 0.148 7 0 "[ . 1 . 2]"
1 27 LYS 1.443 0.148 7 0 "[ . 1 . 2]"
1 28 PRO 0.224 0.101 1 0 "[ . 1 . 2]"
1 29 LEU 0.807 0.137 13 0 "[ . 1 . 2]"
1 30 PHE 0.258 0.011 2 0 "[ . 1 . 2]"
1 31 TYR 0.224 0.013 15 0 "[ . 1 . 2]"
1 32 THR 0.083 0.007 12 0 "[ . 1 . 2]"
1 33 ILE 0.522 0.041 5 0 "[ . 1 . 2]"
1 34 ASN 0.108 0.055 3 0 "[ . 1 . 2]"
1 35 LEU 0.293 0.027 3 0 "[ . 1 . 2]"
1 36 ILE 1.060 0.052 20 0 "[ . 1 . 2]"
1 37 ILE 0.479 0.052 20 0 "[ . 1 . 2]"
1 38 PRO 0.088 0.088 20 0 "[ . 1 . 2]"
1 39 CYS 0.232 0.035 20 0 "[ . 1 . 2]"
1 40 VAL 0.577 0.043 20 0 "[ . 1 . 2]"
1 41 LEU 0.093 0.088 20 0 "[ . 1 . 2]"
1 42 ILE 1.048 0.060 20 0 "[ . 1 . 2]"
1 43 THR 1.488 0.060 20 0 "[ . 1 . 2]"
1 44 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 LEU 0.020 0.009 20 0 "[ . 1 . 2]"
1 46 ALA 0.141 0.024 13 0 "[ . 1 . 2]"
1 47 ILE 1.743 0.053 19 0 "[ . 1 . 2]"
1 48 LEU 0.020 0.009 20 0 "[ . 1 . 2]"
1 49 VAL 0.085 0.024 13 0 "[ . 1 . 2]"
1 50 PHE 0.195 0.022 1 0 "[ . 1 . 2]"
1 51 TYR 1.589 0.053 19 0 "[ . 1 . 2]"
1 52 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ASP 0.013 0.007 11 0 "[ . 1 . 2]"
1 56 CYS 0.013 0.007 11 0 "[ . 1 . 2]"
1 57 GLY 0.001 0.001 1 0 "[ . 1 . 2]"
1 58 GLU 0.011 0.005 11 0 "[ . 1 . 2]"
1 59 LYS 0.001 0.001 2 0 "[ . 1 . 2]"
1 60 MET 0.011 0.003 9 0 "[ . 1 . 2]"
1 61 THR 0.764 0.255 20 0 "[ . 1 . 2]"
1 62 LEU 0.009 0.005 11 0 "[ . 1 . 2]"
1 63 CYS 0.002 0.002 16 0 "[ . 1 . 2]"
1 64 ILE 0.792 0.255 20 0 "[ . 1 . 2]"
1 65 SER 0.021 0.011 11 0 "[ . 1 . 2]"
1 66 VAL 0.034 0.022 20 0 "[ . 1 . 2]"
1 67 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 LEU 1.550 0.065 17 0 "[ . 1 . 2]"
1 69 ALA 0.810 0.056 20 0 "[ . 1 . 2]"
1 70 LEU 0.559 0.037 15 0 "[ . 1 . 2]"
1 71 THR 0.219 0.065 17 0 "[ . 1 . 2]"
1 72 VAL 0.132 0.042 11 0 "[ . 1 . 2]"
1 73 PHE 0.250 0.021 11 0 "[ . 1 . 2]"
1 74 LEU 0.286 0.022 10 0 "[ . 1 . 2]"
1 75 LEU 0.368 0.046 10 0 "[ . 1 . 2]"
1 76 LEU 0.297 0.046 10 0 "[ . 1 . 2]"
1 77 ILE 0.379 0.047 10 0 "[ . 1 . 2]"
1 78 SER 0.006 0.004 18 0 "[ . 1 . 2]"
1 79 LYS 0.026 0.007 20 0 "[ . 1 . 2]"
1 80 ILE 0.052 0.022 6 0 "[ . 1 . 2]"
1 81 VAL 0.049 0.022 6 0 "[ . 1 . 2]"
1 82 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 THR 0.766 0.154 12 0 "[ . 1 . 2]"
1 85 SER 0.050 0.016 16 0 "[ . 1 . 2]"
1 86 LEU 0.338 0.070 12 0 "[ . 1 . 2]"
1 87 ASP 1.050 0.243 10 0 "[ . 1 . 2]"
1 88 VAL 0.123 0.026 3 0 "[ . 1 . 2]"
1 89 PRO 0.848 0.069 10 0 "[ . 1 . 2]"
1 90 LEU 0.857 0.069 10 0 "[ . 1 . 2]"
1 91 VAL 0.900 0.093 10 0 "[ . 1 . 2]"
1 92 GLY 0.245 0.031 10 0 "[ . 1 . 2]"
1 93 LYS 1.754 0.090 10 0 "[ . 1 . 2]"
1 94 TYR 1.262 0.090 10 0 "[ . 1 . 2]"
1 95 LEU 1.807 0.053 3 0 "[ . 1 . 2]"
1 96 MET 0.030 0.005 7 0 "[ . 1 . 2]"
1 97 PHE 2.149 0.104 9 0 "[ . 1 . 2]"
1 98 THR 3.646 0.105 15 0 "[ . 1 . 2]"
1 99 MET 1.972 0.105 15 0 "[ . 1 . 2]"
1 100 VAL 2.015 0.071 9 0 "[ . 1 . 2]"
1 101 LEU 4.935 0.104 9 0 "[ . 1 . 2]"
1 102 VAL 0.284 0.021 6 0 "[ . 1 . 2]"
1 103 THR 0.970 0.190 9 0 "[ . 1 . 2]"
1 104 PHE 2.113 0.190 9 0 "[ . 1 . 2]"
1 105 SER 0.247 0.064 11 0 "[ . 1 . 2]"
1 106 ILE 0.125 0.029 6 0 "[ . 1 . 2]"
1 107 VAL 1.113 0.064 11 0 "[ . 1 . 2]"
1 108 THR 0.267 0.034 18 0 "[ . 1 . 2]"
1 109 SER 0.009 0.003 6 0 "[ . 1 . 2]"
1 110 VAL 0.762 0.193 19 0 "[ . 1 . 2]"
1 111 CYS 0.352 0.179 19 0 "[ . 1 . 2]"
1 112 VAL 0.000 0.000 1 0 "[ . 1 . 2]"
1 113 LEU 0.098 0.008 19 0 "[ . 1 . 2]"
1 114 ASN 1.684 0.193 19 0 "[ . 1 . 2]"
1 115 VAL 1.463 0.108 19 0 "[ . 1 . 2]"
1 116 HIS 0.000 0.000 1 0 "[ . 1 . 2]"
1 118 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 THR 0.001 0.001 20 0 "[ . 1 . 2]"
1 122 THR 0.001 0.001 20 0 "[ . 1 . 2]"
1 124 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 PRO 0.037 0.008 3 0 "[ . 1 . 2]"
1 126 ARG 0.037 0.008 3 0 "[ . 1 . 2]"
1 130 GLY 0.005 0.004 15 0 "[ . 1 . 2]"
1 131 TYR 0.018 0.007 15 0 "[ . 1 . 2]"
1 132 VAL 0.014 0.007 15 0 "[ . 1 . 2]"
1 133 ALA 0.110 0.011 18 0 "[ . 1 . 2]"
1 134 MET 0.004 0.002 20 0 "[ . 1 . 2]"
1 135 VAL 0.002 0.001 4 0 "[ . 1 . 2]"
1 136 ILE 0.003 0.003 7 0 "[ . 1 . 2]"
1 137 ASP 0.008 0.003 7 0 "[ . 1 . 2]"
1 138 ARG 0.098 0.098 19 0 "[ . 1 . 2]"
1 139 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 140 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 LEU 0.009 0.003 7 0 "[ . 1 . 2]"
1 142 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 143 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 144 PHE 0.003 0.002 9 0 "[ . 1 . 2]"
1 145 VAL 0.013 0.004 18 0 "[ . 1 . 2]"
1 146 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 147 VAL 0.005 0.004 9 0 "[ . 1 . 2]"
1 148 CYS 0.002 0.001 10 0 "[ . 1 . 2]"
1 149 VAL 0.012 0.009 2 0 "[ . 1 . 2]"
1 150 PHE 0.012 0.009 2 0 "[ . 1 . 2]"
1 151 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 152 THR 0.540 0.051 12 0 "[ . 1 . 2]"
1 153 ILE 1.088 0.085 7 0 "[ . 1 . 2]"
1 154 GLY 0.060 0.015 4 0 "[ . 1 . 2]"
1 155 MET 0.056 0.018 11 0 "[ . 1 . 2]"
1 156 PHE 0.048 0.012 4 0 "[ . 1 . 2]"
1 157 LEU 0.073 0.013 14 0 "[ . 1 . 2]"
1 158 GLN 0.058 0.013 14 0 "[ . 1 . 2]"
1 159 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 160 LEU 0.236 0.111 12 0 "[ . 1 . 2]"
1 161 PHE 2.116 0.224 12 0 "[ . 1 . 2]"
1 162 GLN 1.174 0.224 12 0 "[ . 1 . 2]"
1 163 ASN 0.124 0.123 16 0 "[ . 1 . 2]"
1 164 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 25 ARG H 1 25 ARG HB2 . . 3.600 2.502 2.065 3.592 . 0 0 "[ . 1 . 2]" 1
2 1 25 ARG H 1 25 ARG QB . . 2.840 2.366 2.042 2.625 . 0 0 "[ . 1 . 2]" 1
3 1 25 ARG H 1 25 ARG HB3 . . 3.600 3.440 2.555 3.601 0.001 4 0 "[ . 1 . 2]" 1
4 1 25 ARG H 1 25 ARG QD . . 4.330 3.188 1.920 4.329 . 0 0 "[ . 1 . 2]" 1
5 1 25 ARG H 1 25 ARG QG . . 3.550 2.737 2.006 3.540 . 0 0 "[ . 1 . 2]" 1
6 1 25 ARG H 1 26 ARG H . . 3.490 2.997 2.578 3.288 . 0 0 "[ . 1 . 2]" 1
7 1 25 ARG HA 1 25 ARG QD . . 4.490 3.391 1.998 4.202 . 0 0 "[ . 1 . 2]" 1
8 1 25 ARG HA 1 25 ARG QG . . 3.700 2.477 2.026 3.386 . 0 0 "[ . 1 . 2]" 1
9 1 25 ARG QB 1 25 ARG QD . . 3.310 2.172 1.989 2.291 . 0 0 "[ . 1 . 2]" 1
10 1 25 ARG QB 1 26 ARG H . . 3.730 2.913 1.923 3.733 0.003 12 0 "[ . 1 . 2]" 1
11 1 25 ARG HB2 1 25 ARG QD . . 3.830 2.593 2.014 3.400 . 0 0 "[ . 1 . 2]" 1
12 1 25 ARG HB3 1 25 ARG QD . . 3.830 2.727 2.137 3.338 . 0 0 "[ . 1 . 2]" 1
13 1 26 ARG H 1 26 ARG QB . . 3.060 2.397 2.054 3.065 0.005 14 0 "[ . 1 . 2]" 1
14 1 26 ARG H 1 26 ARG QD . . 4.180 3.922 1.952 4.180 0.000 11 0 "[ . 1 . 2]" 1
15 1 26 ARG H 1 26 ARG QG . . 3.500 2.811 2.082 3.496 . 0 0 "[ . 1 . 2]" 1
16 1 26 ARG H 1 27 LYS H . . 4.170 3.314 2.238 4.318 0.148 7 0 "[ . 1 . 2]" 1
17 1 26 ARG HA 1 26 ARG QD . . 4.280 3.316 1.977 4.255 . 0 0 "[ . 1 . 2]" 1
18 1 26 ARG HA 1 26 ARG QG . . 3.760 2.606 2.105 3.412 . 0 0 "[ . 1 . 2]" 1
19 1 27 LYS H 1 27 LYS QB . . 3.120 2.888 2.333 3.120 0.000 3 0 "[ . 1 . 2]" 1
20 1 27 LYS H 1 27 LYS QD . . 4.160 3.681 2.234 4.160 . 0 0 "[ . 1 . 2]" 1
21 1 27 LYS H 1 27 LYS QE . . 5.350 4.174 1.945 5.338 . 0 0 "[ . 1 . 2]" 1
22 1 27 LYS H 1 27 LYS QG . . 3.820 2.556 1.935 3.818 . 0 0 "[ . 1 . 2]" 1
23 1 27 LYS H 1 28 PRO QD . . 3.960 3.221 2.479 4.061 0.101 1 0 "[ . 1 . 2]" 1
24 1 27 LYS HA 1 27 LYS QD . . 4.500 4.050 2.475 4.483 . 0 0 "[ . 1 . 2]" 1
25 1 27 LYS HA 1 27 LYS QE . . 4.800 4.419 3.756 4.799 . 0 0 "[ . 1 . 2]" 1
26 1 27 LYS QB 1 27 LYS QD . . 3.340 2.155 1.981 2.359 . 0 0 "[ . 1 . 2]" 1
27 1 27 LYS QB 1 27 LYS QE . . 4.100 2.805 2.082 3.713 . 0 0 "[ . 1 . 2]" 1
28 1 27 LYS QB 1 28 PRO QD . . 3.820 3.569 2.263 3.798 . 0 0 "[ . 1 . 2]" 1
29 1 27 LYS QB 1 29 LEU H . . 4.980 3.422 2.118 4.064 . 0 0 "[ . 1 . 2]" 1
30 1 27 LYS QG 1 29 LEU H . . 4.180 4.160 3.726 4.317 0.137 13 0 "[ . 1 . 2]" 1
31 1 28 PRO HA 1 30 PHE QB . . 4.390 4.384 4.367 4.394 0.004 8 0 "[ . 1 . 2]" 1
32 1 28 PRO QB 1 29 LEU H . . 4.050 3.648 3.511 3.913 . 0 0 "[ . 1 . 2]" 1
33 1 28 PRO QB 1 31 TYR QB . . 4.580 2.952 1.868 3.394 . 0 0 "[ . 1 . 2]" 1
34 1 28 PRO QD 1 29 LEU H . . 4.490 3.114 2.714 4.452 . 0 0 "[ . 1 . 2]" 1
35 1 28 PRO HG2 1 29 LEU HA . . 5.100 4.324 4.126 5.011 . 0 0 "[ . 1 . 2]" 1
36 1 29 LEU H 1 29 LEU QB . . 3.620 2.336 2.232 2.678 . 0 0 "[ . 1 . 2]" 1
37 1 29 LEU H 1 29 LEU QD . . 4.020 2.931 2.468 3.107 . 0 0 "[ . 1 . 2]" 1
38 1 29 LEU H 1 29 LEU HG . . 4.180 2.608 1.997 2.829 . 0 0 "[ . 1 . 2]" 1
39 1 29 LEU H 1 30 PHE H . . 3.810 2.707 2.501 2.764 . 0 0 "[ . 1 . 2]" 1
40 1 29 LEU H 1 30 PHE QB . . 4.880 4.537 4.288 4.745 . 0 0 "[ . 1 . 2]" 1
41 1 29 LEU HA 1 32 THR HB . . 4.200 4.072 3.963 4.143 . 0 0 "[ . 1 . 2]" 1
42 1 29 LEU HA 1 32 THR MG . . 3.930 1.999 1.924 2.059 . 0 0 "[ . 1 . 2]" 1
43 1 29 LEU HA 1 33 ILE H . . 4.280 4.223 4.166 4.281 0.001 10 0 "[ . 1 . 2]" 1
44 1 29 LEU QB 1 30 PHE HA . . 5.340 4.491 4.242 4.567 . 0 0 "[ . 1 . 2]" 1
45 1 29 LEU QB 1 32 THR MG . . 3.620 3.359 3.272 3.427 . 0 0 "[ . 1 . 2]" 1
46 1 29 LEU QD 1 30 PHE QB . . 3.640 3.141 2.324 3.602 . 0 0 "[ . 1 . 2]" 1
47 1 29 LEU HG 1 30 PHE H . . 3.850 2.151 2.087 2.308 . 0 0 "[ . 1 . 2]" 1
48 1 29 LEU HG 1 30 PHE HA . . 5.500 3.908 3.706 4.419 . 0 0 "[ . 1 . 2]" 1
49 1 29 LEU HG 1 30 PHE QB . . 5.270 3.383 3.080 3.925 . 0 0 "[ . 1 . 2]" 1
50 1 30 PHE H 1 30 PHE QB . . 3.260 2.233 2.133 2.325 . 0 0 "[ . 1 . 2]" 1
51 1 30 PHE H 1 31 TYR H . . 4.170 2.405 2.378 2.427 . 0 0 "[ . 1 . 2]" 1
52 1 30 PHE H 1 32 THR H . . 4.130 4.131 4.069 4.137 0.007 12 0 "[ . 1 . 2]" 1
53 1 30 PHE HA 1 30 PHE QD . . 4.080 2.509 2.018 3.000 . 0 0 "[ . 1 . 2]" 1
54 1 30 PHE HA 1 33 ILE H . . 3.850 3.689 3.670 3.744 . 0 0 "[ . 1 . 2]" 1
55 1 30 PHE HA 1 33 ILE HB . . 4.010 4.016 3.994 4.021 0.011 2 0 "[ . 1 . 2]" 1
56 1 30 PHE HA 1 33 ILE MG . . 3.960 1.946 1.921 2.008 . 0 0 "[ . 1 . 2]" 1
57 1 30 PHE QB 1 31 TYR H . . 3.970 2.813 2.763 2.883 . 0 0 "[ . 1 . 2]" 1
58 1 30 PHE QD 1 33 ILE MG . . 5.030 3.002 2.489 3.571 . 0 0 "[ . 1 . 2]" 1
59 1 31 TYR H 1 31 TYR HB2 . . 3.840 2.318 2.220 2.796 . 0 0 "[ . 1 . 2]" 1
60 1 31 TYR H 1 31 TYR HB3 . . 3.840 2.817 2.343 2.970 . 0 0 "[ . 1 . 2]" 1
61 1 31 TYR H 1 32 THR H . . 3.840 2.563 2.495 2.589 . 0 0 "[ . 1 . 2]" 1
62 1 31 TYR H 1 32 THR MG . . 3.740 3.501 3.446 3.517 . 0 0 "[ . 1 . 2]" 1
63 1 31 TYR HA 1 31 TYR QD . . 4.340 2.896 2.213 3.072 . 0 0 "[ . 1 . 2]" 1
64 1 31 TYR HA 1 33 ILE H . . 4.600 4.374 4.333 4.403 . 0 0 "[ . 1 . 2]" 1
65 1 31 TYR HA 1 34 ASN H . . 4.030 3.343 3.331 3.395 . 0 0 "[ . 1 . 2]" 1
66 1 31 TYR HA 1 34 ASN QB . . 4.190 2.276 2.234 2.397 . 0 0 "[ . 1 . 2]" 1
67 1 31 TYR HA 1 35 LEU H . . 4.910 4.892 4.603 4.923 0.013 15 0 "[ . 1 . 2]" 1
68 1 31 TYR QB 1 32 THR MG . . 5.060 3.930 3.909 3.978 . 0 0 "[ . 1 . 2]" 1
69 1 31 TYR QB 1 35 LEU QD . . 4.940 4.586 4.407 4.938 . 0 0 "[ . 1 . 2]" 1
70 1 31 TYR HB2 1 32 THR H . . 4.150 3.562 3.422 3.941 . 0 0 "[ . 1 . 2]" 1
71 1 31 TYR HB3 1 32 THR H . . 4.150 2.532 2.489 2.622 . 0 0 "[ . 1 . 2]" 1
72 1 31 TYR QD 1 35 LEU QD . . 4.000 2.713 2.457 2.946 . 0 0 "[ . 1 . 2]" 1
73 1 31 TYR QD 1 35 LEU HG . . 4.440 4.441 4.390 4.452 0.012 19 0 "[ . 1 . 2]" 1
74 1 31 TYR QE 1 35 LEU QD . . 4.130 2.488 1.887 2.896 . 0 0 "[ . 1 . 2]" 1
75 1 31 TYR QE 1 35 LEU HG . . 4.680 4.183 3.132 4.671 . 0 0 "[ . 1 . 2]" 1
76 1 32 THR H 1 32 THR HB . . 3.820 2.627 2.625 2.628 . 0 0 "[ . 1 . 2]" 1
77 1 32 THR H 1 32 THR MG . . 3.900 1.920 1.918 1.924 . 0 0 "[ . 1 . 2]" 1
78 1 32 THR H 1 33 ILE H . . 3.890 2.706 2.670 2.719 . 0 0 "[ . 1 . 2]" 1
79 1 32 THR HB 1 33 ILE H . . 4.060 3.966 3.962 3.976 . 0 0 "[ . 1 . 2]" 1
80 1 32 THR HB 1 33 ILE MG . . 5.500 5.486 5.480 5.499 . 0 0 "[ . 1 . 2]" 1
81 1 32 THR MG 1 33 ILE H . . 3.740 2.049 2.043 2.074 . 0 0 "[ . 1 . 2]" 1
82 1 32 THR MG 1 33 ILE HB . . 4.630 2.918 2.909 2.962 . 0 0 "[ . 1 . 2]" 1
83 1 32 THR MG 1 34 ASN H . . 4.470 4.075 4.066 4.101 . 0 0 "[ . 1 . 2]" 1
84 1 33 ILE H 1 33 ILE HB . . 3.610 2.572 2.560 2.577 . 0 0 "[ . 1 . 2]" 1
85 1 33 ILE H 1 33 ILE MD . . 4.800 4.200 4.196 4.212 . 0 0 "[ . 1 . 2]" 1
86 1 33 ILE H 1 33 ILE QG . . 4.490 4.030 4.024 4.031 . 0 0 "[ . 1 . 2]" 1
87 1 33 ILE H 1 33 ILE MG . . 3.530 2.089 2.082 2.098 . 0 0 "[ . 1 . 2]" 1
88 1 33 ILE H 1 34 ASN H . . 4.020 2.466 2.459 2.507 . 0 0 "[ . 1 . 2]" 1
89 1 33 ILE HA 1 33 ILE MD . . 3.940 3.324 3.318 3.341 . 0 0 "[ . 1 . 2]" 1
90 1 33 ILE HA 1 33 ILE MG . . 3.300 3.200 3.199 3.201 . 0 0 "[ . 1 . 2]" 1
91 1 33 ILE HA 1 36 ILE HB . . 4.360 2.474 2.398 2.522 . 0 0 "[ . 1 . 2]" 1
92 1 33 ILE HA 1 36 ILE QG . . 4.000 2.368 2.180 3.256 . 0 0 "[ . 1 . 2]" 1
93 1 33 ILE HA 1 36 ILE MG . . 3.830 3.849 3.838 3.871 0.041 5 0 "[ . 1 . 2]" 1
94 1 33 ILE HB 1 34 ASN H . . 4.180 3.998 3.993 4.011 . 0 0 "[ . 1 . 2]" 1
95 1 33 ILE MD 1 34 ASN H . . 4.030 3.470 3.447 3.490 . 0 0 "[ . 1 . 2]" 1
96 1 33 ILE MD 1 34 ASN HA . . 3.740 2.893 2.848 2.905 . 0 0 "[ . 1 . 2]" 1
97 1 33 ILE MD 1 34 ASN QB . . 5.210 4.355 3.943 4.457 . 0 0 "[ . 1 . 2]" 1
98 1 33 ILE QG 1 34 ASN H . . 4.730 4.356 4.343 4.360 . 0 0 "[ . 1 . 2]" 1
99 1 33 ILE QG 1 34 ASN HA . . 4.920 4.738 4.663 4.757 . 0 0 "[ . 1 . 2]" 1
100 1 33 ILE QG 1 36 ILE H . . 4.920 3.986 3.905 4.494 . 0 0 "[ . 1 . 2]" 1
101 1 33 ILE QG 1 36 ILE HB . . 3.960 2.460 2.320 3.337 . 0 0 "[ . 1 . 2]" 1
102 1 33 ILE QG 1 37 ILE H . . 4.390 3.916 3.878 4.051 . 0 0 "[ . 1 . 2]" 1
103 1 33 ILE QG 1 37 ILE QG . . 4.940 3.419 2.834 3.565 . 0 0 "[ . 1 . 2]" 1
104 1 33 ILE MG 1 34 ASN H . . 3.580 2.254 2.252 2.259 . 0 0 "[ . 1 . 2]" 1
105 1 33 ILE MG 1 34 ASN HA . . 3.730 3.020 3.002 3.088 . 0 0 "[ . 1 . 2]" 1
106 1 33 ILE MG 1 34 ASN QB . . 4.190 3.421 3.162 3.576 . 0 0 "[ . 1 . 2]" 1
107 1 34 ASN H 1 34 ASN QB . . 3.160 2.075 2.047 2.191 . 0 0 "[ . 1 . 2]" 1
108 1 34 ASN H 1 34 ASN HD21 . . 5.060 3.496 2.678 4.533 . 0 0 "[ . 1 . 2]" 1
109 1 34 ASN H 1 34 ASN QD . . 4.220 3.389 2.653 4.214 . 0 0 "[ . 1 . 2]" 1
110 1 34 ASN H 1 34 ASN HD22 . . 5.060 4.787 4.310 5.115 0.055 3 0 "[ . 1 . 2]" 1
111 1 34 ASN H 1 35 LEU H . . 3.490 2.686 2.538 2.711 . 0 0 "[ . 1 . 2]" 1
112 1 34 ASN HA 1 37 ILE HB . . 4.590 3.419 3.056 3.515 . 0 0 "[ . 1 . 2]" 1
113 1 34 ASN QB 1 35 LEU H . . 3.810 2.983 2.935 3.195 . 0 0 "[ . 1 . 2]" 1
114 1 34 ASN QB 1 35 LEU QD . . 4.730 2.559 2.361 3.588 . 0 0 "[ . 1 . 2]" 1
115 1 35 LEU H 1 35 LEU HB2 . . 4.080 2.218 2.148 2.229 . 0 0 "[ . 1 . 2]" 1
116 1 35 LEU H 1 35 LEU QB . . 3.420 2.194 2.123 2.206 . 0 0 "[ . 1 . 2]" 1
117 1 35 LEU H 1 35 LEU HB3 . . 4.080 3.490 3.321 3.513 . 0 0 "[ . 1 . 2]" 1
118 1 35 LEU H 1 35 LEU QD . . 3.570 2.489 2.284 3.007 . 0 0 "[ . 1 . 2]" 1
119 1 35 LEU H 1 35 LEU HG . . 4.300 4.130 4.097 4.327 0.027 3 0 "[ . 1 . 2]" 1
120 1 35 LEU H 1 36 ILE HB . . 4.550 4.456 4.355 4.487 . 0 0 "[ . 1 . 2]" 1
121 1 35 LEU QB 1 36 ILE H . . 4.450 3.037 2.907 3.066 . 0 0 "[ . 1 . 2]" 1
122 1 35 LEU QB 1 36 ILE HA . . 4.800 3.952 3.882 3.967 . 0 0 "[ . 1 . 2]" 1
123 1 35 LEU MD1 1 73 PHE QE . . 4.120 3.138 2.070 3.853 . 0 0 "[ . 1 . 2]" 1
124 1 35 LEU HG 1 77 ILE MD . . 4.580 2.196 1.894 3.571 . 0 0 "[ . 1 . 2]" 1
125 1 35 LEU HG 1 77 ILE MG . . 4.860 4.795 4.509 4.864 0.004 11 0 "[ . 1 . 2]" 1
126 1 36 ILE H 1 36 ILE HB . . 3.670 2.454 2.387 2.468 . 0 0 "[ . 1 . 2]" 1
127 1 36 ILE H 1 36 ILE MD . . 4.180 3.426 3.330 3.690 . 0 0 "[ . 1 . 2]" 1
128 1 36 ILE H 1 36 ILE HG12 . . 3.870 2.366 2.330 2.527 . 0 0 "[ . 1 . 2]" 1
129 1 36 ILE H 1 36 ILE HG13 . . 3.870 3.756 3.747 3.792 . 0 0 "[ . 1 . 2]" 1
130 1 36 ILE H 1 36 ILE MG . . 3.800 3.757 3.732 3.762 . 0 0 "[ . 1 . 2]" 1
131 1 36 ILE H 1 37 ILE H . . 3.820 2.450 2.399 2.464 . 0 0 "[ . 1 . 2]" 1
132 1 36 ILE H 1 37 ILE QG . . 4.640 4.580 4.464 4.639 . 0 0 "[ . 1 . 2]" 1
133 1 36 ILE H 1 39 CYS QB . . 4.620 4.428 4.396 4.518 . 0 0 "[ . 1 . 2]" 1
134 1 36 ILE HA 1 36 ILE MD . . 3.340 1.961 1.951 2.041 . 0 0 "[ . 1 . 2]" 1
135 1 36 ILE HA 1 36 ILE HG12 . . 4.190 3.016 2.866 3.049 . 0 0 "[ . 1 . 2]" 1
136 1 36 ILE HA 1 36 ILE QG . . 3.610 2.887 2.771 2.912 . 0 0 "[ . 1 . 2]" 1
137 1 36 ILE HA 1 36 ILE HG13 . . 4.190 3.689 3.677 3.692 . 0 0 "[ . 1 . 2]" 1
138 1 36 ILE HA 1 36 ILE MG . . 3.320 2.416 2.382 2.460 . 0 0 "[ . 1 . 2]" 1
139 1 36 ILE HA 1 39 CYS H . . 4.960 3.324 3.276 3.346 . 0 0 "[ . 1 . 2]" 1
140 1 36 ILE HA 1 39 CYS HB2 . . 4.380 2.913 2.086 3.093 . 0 0 "[ . 1 . 2]" 1
141 1 36 ILE HA 1 39 CYS QB . . 3.810 2.192 2.054 2.319 . 0 0 "[ . 1 . 2]" 1
142 1 36 ILE HA 1 39 CYS HB3 . . 4.380 2.314 2.160 3.075 . 0 0 "[ . 1 . 2]" 1
143 1 36 ILE HA 1 40 VAL H . . 5.250 3.897 3.668 4.840 . 0 0 "[ . 1 . 2]" 1
144 1 36 ILE HB 1 36 ILE MD . . 3.560 3.221 3.215 3.231 . 0 0 "[ . 1 . 2]" 1
145 1 36 ILE MD 1 39 CYS H . . 4.760 4.762 4.705 4.776 0.016 10 0 "[ . 1 . 2]" 1
146 1 36 ILE MD 1 39 CYS HB2 . . 4.050 3.726 3.179 3.852 . 0 0 "[ . 1 . 2]" 1
147 1 36 ILE MD 1 39 CYS HB3 . . 4.050 3.203 2.990 3.581 . 0 0 "[ . 1 . 2]" 1
148 1 36 ILE QG 1 36 ILE MG . . 3.210 2.280 2.238 2.314 . 0 0 "[ . 1 . 2]" 1
149 1 36 ILE QG 1 37 ILE H . . 5.110 4.118 4.090 4.244 . 0 0 "[ . 1 . 2]" 1
150 1 36 ILE HG12 1 36 ILE MG . . 3.700 3.200 3.187 3.201 . 0 0 "[ . 1 . 2]" 1
151 1 36 ILE HG13 1 36 ILE MG . . 3.700 2.334 2.286 2.374 . 0 0 "[ . 1 . 2]" 1
152 1 36 ILE MG 1 37 ILE H . . 3.470 3.494 3.489 3.522 0.052 20 0 "[ . 1 . 2]" 1
153 1 36 ILE MG 1 39 CYS H . . 4.730 4.339 4.102 4.390 . 0 0 "[ . 1 . 2]" 1
154 1 36 ILE MG 1 39 CYS HB2 . . 4.660 4.482 3.386 4.661 0.001 9 0 "[ . 1 . 2]" 1
155 1 36 ILE MG 1 39 CYS QB . . 4.000 3.192 2.834 3.286 . 0 0 "[ . 1 . 2]" 1
156 1 36 ILE MG 1 39 CYS HB3 . . 4.660 3.271 3.040 3.359 . 0 0 "[ . 1 . 2]" 1
157 1 36 ILE MG 1 40 VAL H . . 4.180 3.601 3.325 4.223 0.043 20 0 "[ . 1 . 2]" 1
158 1 37 ILE H 1 37 ILE HB . . 3.890 2.250 2.249 2.253 . 0 0 "[ . 1 . 2]" 1
159 1 37 ILE H 1 37 ILE QG . . 3.670 2.690 2.682 2.696 . 0 0 "[ . 1 . 2]" 1
160 1 37 ILE H 1 37 ILE MG . . 4.210 3.648 3.647 3.650 . 0 0 "[ . 1 . 2]" 1
161 1 37 ILE H 1 38 PRO QD . . 4.400 2.071 2.068 2.082 . 0 0 "[ . 1 . 2]" 1
162 1 37 ILE H 1 39 CYS QB . . 4.730 4.525 4.359 4.603 . 0 0 "[ . 1 . 2]" 1
163 1 37 ILE HA 1 37 ILE HG12 . . 4.120 2.599 2.435 2.628 . 0 0 "[ . 1 . 2]" 1
164 1 37 ILE HA 1 37 ILE QG . . 3.580 2.515 2.232 2.565 . 0 0 "[ . 1 . 2]" 1
165 1 37 ILE HA 1 37 ILE HG13 . . 4.120 3.434 2.584 3.584 . 0 0 "[ . 1 . 2]" 1
166 1 37 ILE HB 1 37 ILE MD . . 3.740 3.081 2.282 3.227 . 0 0 "[ . 1 . 2]" 1
167 1 37 ILE HB 1 38 PRO QD . . 4.290 1.865 1.863 1.866 . 0 0 "[ . 1 . 2]" 1
168 1 37 ILE MD 1 38 PRO QD . . 4.550 4.021 3.496 4.128 . 0 0 "[ . 1 . 2]" 1
169 1 37 ILE HG12 1 37 ILE MG . . 3.400 3.077 2.389 3.198 . 0 0 "[ . 1 . 2]" 1
170 1 37 ILE HG13 1 37 ILE MG . . 3.400 2.473 2.343 3.198 . 0 0 "[ . 1 . 2]" 1
171 1 37 ILE MG 1 38 PRO HB3 . . 3.940 3.288 3.285 3.289 . 0 0 "[ . 1 . 2]" 1
172 1 37 ILE MG 1 38 PRO QD . . 4.030 2.054 2.049 2.056 . 0 0 "[ . 1 . 2]" 1
173 1 37 ILE MG 1 39 CYS H . . 5.120 4.284 4.188 4.329 . 0 0 "[ . 1 . 2]" 1
174 1 38 PRO HA 1 41 LEU QD . . 3.960 2.040 1.936 2.168 . 0 0 "[ . 1 . 2]" 1
175 1 38 PRO HA 1 41 LEU HG . . 4.310 3.738 2.890 3.992 . 0 0 "[ . 1 . 2]" 1
176 1 38 PRO HB2 1 39 CYS H . . 4.050 3.564 3.478 3.735 . 0 0 "[ . 1 . 2]" 1
177 1 38 PRO HB3 1 39 CYS H . . 4.640 4.275 4.224 4.373 . 0 0 "[ . 1 . 2]" 1
178 1 38 PRO HB3 1 41 LEU QD . . 3.480 3.411 3.240 3.568 0.088 20 0 "[ . 1 . 2]" 1
179 1 38 PRO QD 1 39 CYS H . . 4.270 2.647 2.620 2.733 . 0 0 "[ . 1 . 2]" 1
180 1 38 PRO QD 1 41 LEU QD . . 4.430 3.816 3.609 4.035 . 0 0 "[ . 1 . 2]" 1
181 1 39 CYS H 1 39 CYS HB2 . . 3.950 2.551 2.243 2.702 . 0 0 "[ . 1 . 2]" 1
182 1 39 CYS H 1 39 CYS HB3 . . 3.950 2.555 2.400 2.856 . 0 0 "[ . 1 . 2]" 1
183 1 39 CYS H 1 40 VAL H . . 3.950 2.551 2.514 2.701 . 0 0 "[ . 1 . 2]" 1
184 1 39 CYS H 1 40 VAL QG . . 4.380 3.762 3.725 3.920 . 0 0 "[ . 1 . 2]" 1
185 1 39 CYS H 1 41 LEU QD . . 5.440 4.680 4.043 4.933 . 0 0 "[ . 1 . 2]" 1
186 1 39 CYS HA 1 41 LEU H . . 4.780 4.416 4.321 4.443 . 0 0 "[ . 1 . 2]" 1
187 1 39 CYS HA 1 42 ILE H . . 4.810 4.203 4.182 4.224 . 0 0 "[ . 1 . 2]" 1
188 1 39 CYS HA 1 42 ILE HB . . 4.720 4.311 4.294 4.371 . 0 0 "[ . 1 . 2]" 1
189 1 39 CYS HA 1 42 ILE MG . . 3.820 3.680 3.664 3.765 . 0 0 "[ . 1 . 2]" 1
190 1 39 CYS QB 1 40 VAL QG . . 3.810 3.813 3.800 3.845 0.035 20 0 "[ . 1 . 2]" 1
191 1 39 CYS HB2 1 40 VAL H . . 4.330 3.792 3.571 3.886 . 0 0 "[ . 1 . 2]" 1
192 1 39 CYS HB3 1 40 VAL H . . 4.330 2.523 2.476 2.574 . 0 0 "[ . 1 . 2]" 1
193 1 40 VAL H 1 40 VAL HB . . 4.050 2.604 2.598 2.629 . 0 0 "[ . 1 . 2]" 1
194 1 40 VAL H 1 40 VAL MG1 . . 3.950 2.067 2.041 2.112 . 0 0 "[ . 1 . 2]" 1
195 1 40 VAL H 1 40 VAL QG . . 3.400 2.058 2.033 2.101 . 0 0 "[ . 1 . 2]" 1
196 1 40 VAL H 1 40 VAL MG2 . . 3.950 3.789 3.785 3.789 . 0 0 "[ . 1 . 2]" 1
197 1 40 VAL H 1 41 LEU H . . 4.060 2.373 2.371 2.399 . 0 0 "[ . 1 . 2]" 1
198 1 40 VAL H 1 41 LEU HA . . 5.500 4.958 4.956 4.969 . 0 0 "[ . 1 . 2]" 1
199 1 40 VAL HA 1 43 THR HB . . 5.110 5.114 5.113 5.115 0.005 11 0 "[ . 1 . 2]" 1
200 1 40 VAL HB 1 41 LEU H . . 4.030 3.984 3.978 4.035 0.005 20 0 "[ . 1 . 2]" 1
201 1 40 VAL HB 1 148 CYS HB3 . . 5.200 4.760 3.573 5.201 0.001 10 0 "[ . 1 . 2]" 1
202 1 40 VAL QG 1 41 LEU H . . 4.150 2.230 2.004 2.268 . 0 0 "[ . 1 . 2]" 1
203 1 40 VAL QG 1 43 THR MG . . 3.200 2.310 2.148 2.434 . 0 0 "[ . 1 . 2]" 1
204 1 40 VAL MG1 1 43 THR MG . . 4.120 4.139 4.137 4.142 0.022 9 0 "[ . 1 . 2]" 1
205 1 40 VAL MG2 1 43 THR MG . . 4.120 2.322 2.155 2.451 . 0 0 "[ . 1 . 2]" 1
206 1 40 VAL MG2 1 148 CYS HB2 . . 5.500 4.281 3.123 5.254 . 0 0 "[ . 1 . 2]" 1
207 1 41 LEU H 1 41 LEU QB . . 3.530 2.116 2.072 2.183 . 0 0 "[ . 1 . 2]" 1
208 1 41 LEU H 1 41 LEU QD . . 4.370 3.350 1.978 3.505 . 0 0 "[ . 1 . 2]" 1
209 1 41 LEU H 1 41 LEU HG . . 4.270 3.129 2.852 4.067 . 0 0 "[ . 1 . 2]" 1
210 1 41 LEU HA 1 41 LEU HG . . 3.980 2.664 2.443 3.644 . 0 0 "[ . 1 . 2]" 1
211 1 41 LEU QB 1 42 ILE H . . 4.360 2.810 2.789 2.822 . 0 0 "[ . 1 . 2]" 1
212 1 41 LEU QB 1 42 ILE HA . . 4.490 3.813 3.791 3.844 . 0 0 "[ . 1 . 2]" 1
213 1 42 ILE H 1 42 ILE HB . . 3.780 2.435 2.433 2.444 . 0 0 "[ . 1 . 2]" 1
214 1 42 ILE H 1 42 ILE MD . . 4.080 3.965 3.881 4.081 0.001 20 0 "[ . 1 . 2]" 1
215 1 42 ILE H 1 42 ILE HG12 . . 4.920 4.668 4.663 4.679 . 0 0 "[ . 1 . 2]" 1
216 1 42 ILE H 1 42 ILE QG . . 4.200 4.067 4.027 4.085 . 0 0 "[ . 1 . 2]" 1
217 1 42 ILE H 1 42 ILE HG13 . . 4.920 4.478 4.393 4.515 . 0 0 "[ . 1 . 2]" 1
218 1 42 ILE H 1 42 ILE MG . . 3.880 2.260 2.238 2.274 . 0 0 "[ . 1 . 2]" 1
219 1 42 ILE H 1 43 THR H . . 4.170 2.695 2.694 2.698 . 0 0 "[ . 1 . 2]" 1
220 1 42 ILE H 1 43 THR MG . . 4.020 3.905 3.902 3.910 . 0 0 "[ . 1 . 2]" 1
221 1 42 ILE HA 1 42 ILE HG12 . . 4.110 3.662 3.638 3.674 . 0 0 "[ . 1 . 2]" 1
222 1 42 ILE HA 1 42 ILE QG . . 3.440 2.673 2.360 2.810 . 0 0 "[ . 1 . 2]" 1
223 1 42 ILE HA 1 42 ILE HG13 . . 4.110 2.756 2.390 2.918 . 0 0 "[ . 1 . 2]" 1
224 1 42 ILE HA 1 42 ILE MG . . 3.490 3.193 3.191 3.194 . 0 0 "[ . 1 . 2]" 1
225 1 42 ILE HA 1 45 LEU HB2 . . 5.190 4.459 4.172 4.662 . 0 0 "[ . 1 . 2]" 1
226 1 42 ILE HA 1 45 LEU HB3 . . 3.800 3.478 3.350 3.676 . 0 0 "[ . 1 . 2]" 1
227 1 42 ILE HA 1 46 ALA H . . 4.270 4.270 4.249 4.274 0.004 7 0 "[ . 1 . 2]" 1
228 1 42 ILE HB 1 42 ILE MD . . 2.940 2.251 2.044 2.375 . 0 0 "[ . 1 . 2]" 1
229 1 42 ILE HB 1 43 THR H . . 4.110 3.898 3.897 3.903 . 0 0 "[ . 1 . 2]" 1
230 1 42 ILE HB 1 43 THR MG . . 4.660 4.596 4.593 4.604 . 0 0 "[ . 1 . 2]" 1
231 1 42 ILE MD 1 43 THR H . . 4.980 4.742 4.622 4.985 0.005 12 0 "[ . 1 . 2]" 1
232 1 42 ILE QG 1 46 ALA MB . . 4.340 3.254 3.145 3.358 . 0 0 "[ . 1 . 2]" 1
233 1 42 ILE HG12 1 42 ILE MG . . 3.240 2.298 2.077 2.393 . 0 0 "[ . 1 . 2]" 1
234 1 42 ILE HG12 1 69 ALA MB . . 4.320 3.324 3.055 3.922 . 0 0 "[ . 1 . 2]" 1
235 1 42 ILE HG13 1 42 ILE MG . . 3.240 2.483 2.336 2.817 . 0 0 "[ . 1 . 2]" 1
236 1 42 ILE HG13 1 69 ALA MB . . 4.500 4.500 4.485 4.503 0.003 9 0 "[ . 1 . 2]" 1
237 1 42 ILE MG 1 43 THR H . . 4.040 1.941 1.916 1.953 . 0 0 "[ . 1 . 2]" 1
238 1 42 ILE MG 1 43 THR HA . . 3.790 3.190 3.183 3.204 . 0 0 "[ . 1 . 2]" 1
239 1 42 ILE MG 1 43 THR HB . . 4.260 4.309 4.307 4.320 0.060 20 0 "[ . 1 . 2]" 1
240 1 42 ILE MG 1 43 THR MG . . 3.940 2.173 2.167 2.183 . 0 0 "[ . 1 . 2]" 1
241 1 42 ILE MG 1 46 ALA MB . . 3.860 3.793 3.699 3.844 . 0 0 "[ . 1 . 2]" 1
242 1 42 ILE MG 1 69 ALA MB . . 4.040 3.837 3.428 4.042 0.002 17 0 "[ . 1 . 2]" 1
243 1 43 THR H 1 43 THR HB . . 3.950 3.604 3.603 3.605 . 0 0 "[ . 1 . 2]" 1
244 1 43 THR H 1 43 THR MG . . 3.910 2.103 2.097 2.105 . 0 0 "[ . 1 . 2]" 1
245 1 43 THR HA 1 43 THR MG . . 3.350 2.442 2.438 2.444 . 0 0 "[ . 1 . 2]" 1
246 1 43 THR HA 1 46 ALA MB . . 3.620 2.073 1.997 2.114 . 0 0 "[ . 1 . 2]" 1
247 1 43 THR HA 1 47 ILE H . . 4.740 3.772 3.523 3.975 . 0 0 "[ . 1 . 2]" 1
248 1 43 THR HB 1 47 ILE HG12 . . 5.080 4.908 4.593 5.080 0.000 11 0 "[ . 1 . 2]" 1
249 1 43 THR MG 1 44 SER H . . 4.210 3.669 3.629 3.712 . 0 0 "[ . 1 . 2]" 1
250 1 43 THR MG 1 46 ALA MB . . 3.870 3.855 3.787 3.876 0.006 18 0 "[ . 1 . 2]" 1
251 1 43 THR MG 1 47 ILE MD . . 4.410 4.098 3.782 4.411 0.001 2 0 "[ . 1 . 2]" 1
252 1 44 SER H 1 44 SER QB . . 3.220 2.286 2.050 2.845 . 0 0 "[ . 1 . 2]" 1
253 1 44 SER HA 1 47 ILE HB . . 4.400 3.254 3.144 3.571 . 0 0 "[ . 1 . 2]" 1
254 1 45 LEU H 1 45 LEU HB2 . . 3.880 2.643 2.534 2.766 . 0 0 "[ . 1 . 2]" 1
255 1 45 LEU H 1 45 LEU HB3 . . 3.890 2.417 2.325 2.493 . 0 0 "[ . 1 . 2]" 1
256 1 45 LEU H 1 45 LEU QD . . 4.350 3.713 3.656 3.742 . 0 0 "[ . 1 . 2]" 1
257 1 45 LEU H 1 45 LEU HG . . 4.460 4.424 4.339 4.460 . 0 0 "[ . 1 . 2]" 1
258 1 45 LEU H 1 46 ALA H . . 4.010 2.515 2.463 2.601 . 0 0 "[ . 1 . 2]" 1
259 1 45 LEU H 1 46 ALA MB . . 4.170 4.096 4.049 4.168 . 0 0 "[ . 1 . 2]" 1
260 1 45 LEU H 1 48 LEU H . . 5.010 4.928 4.648 5.019 0.009 20 0 "[ . 1 . 2]" 1
261 1 45 LEU HB2 1 46 ALA H . . 4.280 3.929 3.831 4.036 . 0 0 "[ . 1 . 2]" 1
262 1 45 LEU HB3 1 46 ALA H . . 4.180 2.644 2.535 2.782 . 0 0 "[ . 1 . 2]" 1
263 1 45 LEU QD 1 46 ALA H . . 4.240 3.714 3.023 3.964 . 0 0 "[ . 1 . 2]" 1
264 1 45 LEU QD 1 46 ALA HA . . 4.110 3.828 2.765 4.106 . 0 0 "[ . 1 . 2]" 1
265 1 45 LEU HG 1 46 ALA H . . 4.050 3.888 3.564 4.048 . 0 0 "[ . 1 . 2]" 1
266 1 45 LEU HG 1 48 LEU H . . 5.430 4.824 4.493 5.273 . 0 0 "[ . 1 . 2]" 1
267 1 46 ALA H 1 46 ALA MB . . 3.320 2.101 2.025 2.188 . 0 0 "[ . 1 . 2]" 1
268 1 46 ALA H 1 47 ILE H . . 4.540 2.771 2.688 2.843 . 0 0 "[ . 1 . 2]" 1
269 1 46 ALA H 1 49 VAL QG . . 5.190 4.761 4.523 4.928 . 0 0 "[ . 1 . 2]" 1
270 1 46 ALA HA 1 48 LEU QB . . 5.340 4.548 4.325 4.787 . 0 0 "[ . 1 . 2]" 1
271 1 46 ALA HA 1 49 VAL H . . 4.900 3.749 3.672 3.885 . 0 0 "[ . 1 . 2]" 1
272 1 46 ALA HA 1 49 VAL HB . . 5.500 5.223 5.053 5.524 0.024 13 0 "[ . 1 . 2]" 1
273 1 46 ALA HA 1 49 VAL QG . . 4.360 2.662 2.477 2.736 . 0 0 "[ . 1 . 2]" 1
274 1 46 ALA HA 1 50 PHE H . . 4.300 4.059 3.994 4.103 . 0 0 "[ . 1 . 2]" 1
275 1 46 ALA HA 1 50 PHE HB2 . . 4.470 4.205 4.106 4.306 . 0 0 "[ . 1 . 2]" 1
276 1 46 ALA MB 1 47 ILE H . . 3.790 2.624 2.483 2.772 . 0 0 "[ . 1 . 2]" 1
277 1 46 ALA MB 1 49 VAL H . . 5.210 4.663 4.567 4.774 . 0 0 "[ . 1 . 2]" 1
278 1 46 ALA MB 1 49 VAL QG . . 4.420 3.614 3.426 3.803 . 0 0 "[ . 1 . 2]" 1
279 1 46 ALA MB 1 50 PHE HB2 . . 4.470 3.301 3.037 3.562 . 0 0 "[ . 1 . 2]" 1
280 1 46 ALA MB 1 50 PHE QD . . 4.440 3.602 2.542 4.344 . 0 0 "[ . 1 . 2]" 1
281 1 47 ILE H 1 47 ILE HB . . 4.170 2.159 2.100 2.228 . 0 0 "[ . 1 . 2]" 1
282 1 47 ILE H 1 47 ILE MD . . 3.430 2.536 2.215 2.959 . 0 0 "[ . 1 . 2]" 1
283 1 47 ILE H 1 47 ILE HG12 . . 4.360 4.094 3.941 4.310 . 0 0 "[ . 1 . 2]" 1
284 1 47 ILE H 1 47 ILE HG13 . . 4.370 4.159 3.992 4.361 . 0 0 "[ . 1 . 2]" 1
285 1 47 ILE H 1 47 ILE MG . . 4.030 3.492 3.273 3.623 . 0 0 "[ . 1 . 2]" 1
286 1 47 ILE H 1 50 PHE HB2 . . 4.700 4.638 4.096 4.722 0.022 1 0 "[ . 1 . 2]" 1
287 1 47 ILE HA 1 47 ILE HG12 . . 4.230 3.540 3.512 3.558 . 0 0 "[ . 1 . 2]" 1
288 1 47 ILE HA 1 47 ILE MG . . 3.620 2.780 2.705 2.930 . 0 0 "[ . 1 . 2]" 1
289 1 47 ILE HA 1 50 PHE HB2 . . 4.430 3.105 2.633 3.199 . 0 0 "[ . 1 . 2]" 1
290 1 47 ILE HA 1 51 TYR H . . 4.230 2.192 2.129 2.307 . 0 0 "[ . 1 . 2]" 1
291 1 47 ILE HA 1 51 TYR HB2 . . 4.510 2.826 2.701 3.049 . 0 0 "[ . 1 . 2]" 1
292 1 47 ILE HA 1 51 TYR HB3 . . 4.450 4.278 4.155 4.472 0.022 2 0 "[ . 1 . 2]" 1
293 1 47 ILE HB 1 48 LEU H . . 4.170 3.135 3.070 3.300 . 0 0 "[ . 1 . 2]" 1
294 1 47 ILE MD 1 47 ILE MG . . 3.310 3.255 3.254 3.256 . 0 0 "[ . 1 . 2]" 1
295 1 47 ILE MD 1 50 PHE H . . 5.290 4.551 4.453 4.660 . 0 0 "[ . 1 . 2]" 1
296 1 47 ILE MD 1 50 PHE HB2 . . 4.050 3.665 3.373 3.780 . 0 0 "[ . 1 . 2]" 1
297 1 47 ILE MD 1 51 TYR H . . 4.010 3.696 3.461 3.804 . 0 0 "[ . 1 . 2]" 1
298 1 47 ILE MD 1 51 TYR HB2 . . 3.810 3.623 3.537 3.656 . 0 0 "[ . 1 . 2]" 1
299 1 47 ILE MD 1 51 TYR HB3 . . 5.000 5.031 5.002 5.042 0.042 7 0 "[ . 1 . 2]" 1
300 1 47 ILE MD 1 51 TYR QE . . 4.720 4.702 4.248 4.737 0.017 17 0 "[ . 1 . 2]" 1
301 1 47 ILE MD 1 145 VAL MG1 . . 4.300 4.274 4.049 4.304 0.004 18 0 "[ . 1 . 2]" 1
302 1 47 ILE HG12 1 47 ILE MG . . 3.380 2.350 2.339 2.366 . 0 0 "[ . 1 . 2]" 1
303 1 47 ILE HG12 1 51 TYR HB2 . . 4.470 3.607 3.458 3.681 . 0 0 "[ . 1 . 2]" 1
304 1 47 ILE HG12 1 51 TYR HB3 . . 5.080 4.857 4.796 5.012 . 0 0 "[ . 1 . 2]" 1
305 1 47 ILE HG12 1 51 TYR QE . . 4.630 4.522 4.245 4.633 0.003 8 0 "[ . 1 . 2]" 1
306 1 47 ILE HG13 1 47 ILE MG . . 3.480 2.397 2.385 2.410 . 0 0 "[ . 1 . 2]" 1
307 1 47 ILE HG13 1 51 TYR HB2 . . 4.060 2.113 1.997 2.185 . 0 0 "[ . 1 . 2]" 1
308 1 47 ILE HG13 1 51 TYR HB3 . . 4.650 3.693 3.632 3.712 . 0 0 "[ . 1 . 2]" 1
309 1 47 ILE MG 1 48 LEU H . . 3.960 2.801 2.486 2.964 . 0 0 "[ . 1 . 2]" 1
310 1 47 ILE MG 1 48 LEU HA . . 3.930 2.898 2.792 2.971 . 0 0 "[ . 1 . 2]" 1
311 1 47 ILE MG 1 51 TYR H . . 4.300 3.094 3.003 3.347 . 0 0 "[ . 1 . 2]" 1
312 1 47 ILE MG 1 51 TYR HA . . 4.900 4.380 4.315 4.644 . 0 0 "[ . 1 . 2]" 1
313 1 47 ILE MG 1 51 TYR HB2 . . 4.020 1.997 1.957 2.214 . 0 0 "[ . 1 . 2]" 1
314 1 47 ILE MG 1 51 TYR HB3 . . 4.180 2.356 2.235 2.792 . 0 0 "[ . 1 . 2]" 1
315 1 47 ILE MG 1 51 TYR QD . . 5.160 2.916 2.818 3.384 . 0 0 "[ . 1 . 2]" 1
316 1 47 ILE MG 1 51 TYR QE . . 4.620 4.635 4.471 4.673 0.053 19 0 "[ . 1 . 2]" 1
317 1 48 LEU H 1 48 LEU HB2 . . 3.760 2.118 2.043 2.291 . 0 0 "[ . 1 . 2]" 1
318 1 48 LEU H 1 48 LEU HB3 . . 3.760 3.034 2.745 3.289 . 0 0 "[ . 1 . 2]" 1
319 1 48 LEU H 1 48 LEU HG . . 4.820 4.387 3.690 4.575 . 0 0 "[ . 1 . 2]" 1
320 1 48 LEU H 1 49 VAL H . . 4.220 2.795 2.732 2.839 . 0 0 "[ . 1 . 2]" 1
321 1 48 LEU HA 1 48 LEU QD . . 2.890 2.274 1.985 2.877 . 0 0 "[ . 1 . 2]" 1
322 1 48 LEU HA 1 48 LEU HG . . 3.860 2.592 2.188 2.955 . 0 0 "[ . 1 . 2]" 1
323 1 48 LEU HA 1 50 PHE H . . 5.100 4.885 4.815 4.945 . 0 0 "[ . 1 . 2]" 1
324 1 48 LEU HB2 1 49 VAL H . . 4.110 3.499 3.203 3.770 . 0 0 "[ . 1 . 2]" 1
325 1 48 LEU HB3 1 49 VAL H . . 4.110 2.769 2.582 3.006 . 0 0 "[ . 1 . 2]" 1
326 1 48 LEU QD 1 49 VAL H . . 4.410 4.076 3.577 4.207 . 0 0 "[ . 1 . 2]" 1
327 1 49 VAL H 1 49 VAL HB . . 4.170 3.066 2.902 3.690 . 0 0 "[ . 1 . 2]" 1
328 1 49 VAL H 1 49 VAL MG1 . . 4.630 2.074 1.892 2.812 . 0 0 "[ . 1 . 2]" 1
329 1 49 VAL H 1 49 VAL QG . . 3.960 1.891 1.855 1.909 . 0 0 "[ . 1 . 2]" 1
330 1 49 VAL H 1 49 VAL MG2 . . 4.630 3.435 1.890 3.823 . 0 0 "[ . 1 . 2]" 1
331 1 49 VAL H 1 50 PHE H . . 3.960 2.136 2.124 2.145 . 0 0 "[ . 1 . 2]" 1
332 1 49 VAL H 1 50 PHE HB2 . . 4.310 4.155 3.925 4.205 . 0 0 "[ . 1 . 2]" 1
333 1 49 VAL HB 1 50 PHE H . . 4.200 3.917 3.716 3.973 . 0 0 "[ . 1 . 2]" 1
334 1 49 VAL QG 1 50 PHE H . . 4.290 2.089 2.069 2.110 . 0 0 "[ . 1 . 2]" 1
335 1 49 VAL QG 1 50 PHE HB2 . . 4.250 2.954 2.892 3.130 . 0 0 "[ . 1 . 2]" 1
336 1 49 VAL QG 1 50 PHE QD . . 4.820 3.808 3.330 3.960 . 0 0 "[ . 1 . 2]" 1
337 1 49 VAL QG 1 50 PHE QE . . 5.440 5.336 4.575 5.440 0.000 1 0 "[ . 1 . 2]" 1
338 1 49 VAL MG1 1 50 PHE HB2 . . 5.500 3.492 2.926 5.459 . 0 0 "[ . 1 . 2]" 1
339 1 49 VAL MG1 1 62 LEU HB2 . . 5.450 3.210 1.978 4.660 . 0 0 "[ . 1 . 2]" 1
340 1 49 VAL MG1 1 62 LEU HB3 . . 4.440 3.232 2.135 4.332 . 0 0 "[ . 1 . 2]" 1
341 1 49 VAL MG2 1 50 PHE HB2 . . 5.500 4.356 2.902 4.913 . 0 0 "[ . 1 . 2]" 1
342 1 49 VAL MG2 1 59 LYS HG3 . . 3.920 3.252 2.034 3.921 0.001 2 0 "[ . 1 . 2]" 1
343 1 50 PHE H 1 50 PHE HB2 . . 3.620 2.248 2.071 2.298 . 0 0 "[ . 1 . 2]" 1
344 1 50 PHE H 1 50 PHE QD . . 4.480 4.059 3.614 4.114 . 0 0 "[ . 1 . 2]" 1
345 1 50 PHE H 1 51 TYR H . . 4.060 2.867 2.815 2.915 . 0 0 "[ . 1 . 2]" 1
346 1 50 PHE HB2 1 51 TYR H . . 4.290 3.301 2.886 3.407 . 0 0 "[ . 1 . 2]" 1
347 1 50 PHE QD 1 134 MET ME . . 5.500 4.268 2.870 5.502 0.002 20 0 "[ . 1 . 2]" 1
348 1 51 TYR H 1 51 TYR HB2 . . 3.820 2.115 2.074 2.140 . 0 0 "[ . 1 . 2]" 1
349 1 51 TYR H 1 51 TYR HB3 . . 4.130 3.112 3.019 3.191 . 0 0 "[ . 1 . 2]" 1
350 1 51 TYR H 1 51 TYR QD . . 4.730 3.948 3.426 4.003 . 0 0 "[ . 1 . 2]" 1
351 1 51 TYR HA 1 51 TYR QE . . 4.380 4.233 4.183 4.394 0.014 15 0 "[ . 1 . 2]" 1
352 1 51 TYR QD 1 52 LEU H . . 5.330 4.296 4.019 4.761 . 0 0 "[ . 1 . 2]" 1
353 1 51 TYR QE 1 141 LEU MD2 . . 4.320 2.527 1.907 3.816 . 0 0 "[ . 1 . 2]" 1
354 1 52 LEU H 1 52 LEU QB . . 3.500 2.174 2.047 2.450 . 0 0 "[ . 1 . 2]" 1
355 1 52 LEU HA 1 53 PRO QD . . 3.550 2.120 1.975 2.156 . 0 0 "[ . 1 . 2]" 1
356 1 53 PRO QB 1 54 SER H . . 3.970 2.785 1.993 3.910 . 0 0 "[ . 1 . 2]" 1
357 1 54 SER H 1 54 SER QB . . 3.670 2.936 2.213 3.463 . 0 0 "[ . 1 . 2]" 1
358 1 54 SER H 1 55 ASP H . . 4.530 3.472 1.901 4.424 . 0 0 "[ . 1 . 2]" 1
359 1 54 SER QB 1 55 ASP H . . 4.040 3.127 2.034 4.004 . 0 0 "[ . 1 . 2]" 1
360 1 55 ASP H 1 55 ASP QB . . 3.540 2.808 2.104 3.444 . 0 0 "[ . 1 . 2]" 1
361 1 55 ASP H 1 56 CYS H . . 4.620 3.986 1.910 4.626 0.006 3 0 "[ . 1 . 2]" 1
362 1 55 ASP HA 1 56 CYS HA . . 4.800 4.470 4.303 4.807 0.007 11 0 "[ . 1 . 2]" 1
363 1 55 ASP QB 1 56 CYS H . . 4.000 2.926 1.936 3.900 . 0 0 "[ . 1 . 2]" 1
364 1 55 ASP QB 1 56 CYS HA . . 4.650 4.240 3.832 4.649 . 0 0 "[ . 1 . 2]" 1
365 1 56 CYS H 1 56 CYS QB . . 3.590 2.669 2.273 3.361 . 0 0 "[ . 1 . 2]" 1
366 1 56 CYS H 1 57 GLY H . . 4.770 3.420 2.203 4.526 . 0 0 "[ . 1 . 2]" 1
367 1 56 CYS QB 1 57 GLY H . . 3.950 2.375 1.928 3.598 . 0 0 "[ . 1 . 2]" 1
368 1 57 GLY QA 1 58 GLU QB . . 4.450 4.335 4.052 4.451 0.001 1 0 "[ . 1 . 2]" 1
369 1 58 GLU H 1 58 GLU QB . . 3.590 2.204 2.049 2.512 . 0 0 "[ . 1 . 2]" 1
370 1 58 GLU H 1 58 GLU QG . . 4.300 3.653 2.032 4.049 . 0 0 "[ . 1 . 2]" 1
371 1 58 GLU HA 1 58 GLU QG . . 3.910 2.492 2.140 3.337 . 0 0 "[ . 1 . 2]" 1
372 1 58 GLU HA 1 60 MET H . . 4.510 4.440 4.042 4.510 . 0 0 "[ . 1 . 2]" 1
373 1 58 GLU HA 1 61 THR H . . 4.240 3.447 3.221 3.641 . 0 0 "[ . 1 . 2]" 1
374 1 58 GLU HA 1 61 THR MG . . 3.830 3.146 2.363 3.831 0.001 2 0 "[ . 1 . 2]" 1
375 1 58 GLU HA 1 62 LEU H . . 4.170 4.100 3.692 4.175 0.005 11 0 "[ . 1 . 2]" 1
376 1 58 GLU QB 1 59 LYS H . . 3.900 2.783 2.268 3.478 . 0 0 "[ . 1 . 2]" 1
377 1 58 GLU QG 1 59 LYS HA . . 5.070 4.183 3.141 5.069 . 0 0 "[ . 1 . 2]" 1
378 1 59 LYS H 1 59 LYS QG . . 4.880 3.556 2.069 4.008 . 0 0 "[ . 1 . 2]" 1
379 1 59 LYS H 1 60 MET H . . 4.290 2.834 2.660 2.897 . 0 0 "[ . 1 . 2]" 1
380 1 59 LYS HA 1 59 LYS QE . . 4.910 4.487 3.908 4.897 . 0 0 "[ . 1 . 2]" 1
381 1 59 LYS QB 1 59 LYS QE . . 4.020 3.027 2.008 3.665 . 0 0 "[ . 1 . 2]" 1
382 1 59 LYS QG 1 60 MET H . . 4.090 3.888 3.448 4.089 . 0 0 "[ . 1 . 2]" 1
383 1 60 MET H 1 60 MET QB . . 3.550 2.231 2.135 2.262 . 0 0 "[ . 1 . 2]" 1
384 1 60 MET H 1 60 MET HG2 . . 5.000 4.484 4.352 4.663 . 0 0 "[ . 1 . 2]" 1
385 1 60 MET H 1 60 MET QG . . 4.240 3.961 3.927 4.021 . 0 0 "[ . 1 . 2]" 1
386 1 60 MET H 1 60 MET HG3 . . 5.000 4.416 4.311 4.482 . 0 0 "[ . 1 . 2]" 1
387 1 60 MET H 1 61 THR H . . 4.300 2.702 2.556 2.895 . 0 0 "[ . 1 . 2]" 1
388 1 60 MET HA 1 63 CYS H . . 4.110 3.435 3.244 3.704 . 0 0 "[ . 1 . 2]" 1
389 1 60 MET HA 1 63 CYS HB2 . . 4.730 3.032 2.232 3.901 . 0 0 "[ . 1 . 2]" 1
390 1 60 MET HA 1 63 CYS QB . . 3.970 2.946 2.214 3.263 . 0 0 "[ . 1 . 2]" 1
391 1 60 MET HA 1 63 CYS HB3 . . 4.730 4.431 3.098 4.732 0.002 16 0 "[ . 1 . 2]" 1
392 1 60 MET QB 1 61 THR H . . 4.030 2.462 2.333 2.865 . 0 0 "[ . 1 . 2]" 1
393 1 60 MET ME 1 60 MET QG . . 3.490 2.233 1.985 2.431 . 0 0 "[ . 1 . 2]" 1
394 1 60 MET ME 1 109 SER HB2 . . 4.950 4.669 3.172 4.946 . 0 0 "[ . 1 . 2]" 1
395 1 60 MET QG 1 64 ILE MD . . 4.250 4.159 3.438 4.253 0.003 9 0 "[ . 1 . 2]" 1
396 1 60 MET HG2 1 64 ILE H . . 5.500 5.261 4.672 5.502 0.002 10 0 "[ . 1 . 2]" 1
397 1 60 MET HG2 1 64 ILE MD . . 5.070 4.761 4.275 5.070 0.000 12 0 "[ . 1 . 2]" 1
398 1 60 MET HG3 1 64 ILE H . . 5.500 4.162 3.713 4.519 . 0 0 "[ . 1 . 2]" 1
399 1 60 MET HG3 1 64 ILE MD . . 5.070 4.631 3.597 5.060 . 0 0 "[ . 1 . 2]" 1
400 1 61 THR H 1 61 THR MG . . 3.820 2.557 1.926 3.775 . 0 0 "[ . 1 . 2]" 1
401 1 61 THR H 1 64 ILE MG . . 4.320 4.071 3.903 4.285 . 0 0 "[ . 1 . 2]" 1
402 1 61 THR HA 1 61 THR MG . . 3.270 2.323 2.078 2.439 . 0 0 "[ . 1 . 2]" 1
403 1 61 THR HA 1 64 ILE H . . 4.120 3.717 3.584 3.848 . 0 0 "[ . 1 . 2]" 1
404 1 61 THR HA 1 64 ILE HB . . 4.320 4.288 3.903 4.575 0.255 20 0 "[ . 1 . 2]" 1
405 1 61 THR MG 1 62 LEU H . . 4.270 3.873 3.515 4.166 . 0 0 "[ . 1 . 2]" 1
406 1 61 THR MG 1 62 LEU QB . . 5.310 5.060 4.413 5.311 0.001 16 0 "[ . 1 . 2]" 1
407 1 61 THR MG 1 64 ILE MG . . 3.880 3.408 2.634 3.893 0.013 20 0 "[ . 1 . 2]" 1
408 1 62 LEU H 1 62 LEU HB2 . . 3.970 2.181 2.048 2.802 . 0 0 "[ . 1 . 2]" 1
409 1 62 LEU H 1 62 LEU HB3 . . 3.970 3.125 2.274 3.498 . 0 0 "[ . 1 . 2]" 1
410 1 62 LEU H 1 62 LEU QD . . 4.280 3.166 2.361 3.750 . 0 0 "[ . 1 . 2]" 1
411 1 62 LEU H 1 63 CYS H . . 4.200 2.574 2.458 2.716 . 0 0 "[ . 1 . 2]" 1
412 1 62 LEU H 1 63 CYS QB . . 4.900 4.491 4.234 4.732 . 0 0 "[ . 1 . 2]" 1
413 1 62 LEU QB 1 63 CYS H . . 4.190 2.608 2.333 2.876 . 0 0 "[ . 1 . 2]" 1
414 1 62 LEU QB 1 63 CYS HA . . 5.340 3.816 3.685 4.365 . 0 0 "[ . 1 . 2]" 1
415 1 62 LEU QD 1 63 CYS H . . 4.400 3.838 3.151 4.160 . 0 0 "[ . 1 . 2]" 1
416 1 63 CYS H 1 64 ILE H . . 3.840 2.738 2.585 2.888 . 0 0 "[ . 1 . 2]" 1
417 1 63 CYS HA 1 66 VAL HB . . 4.840 3.896 3.446 4.327 . 0 0 "[ . 1 . 2]" 1
418 1 63 CYS QB 1 64 ILE H . . 4.180 2.448 2.317 2.624 . 0 0 "[ . 1 . 2]" 1
419 1 63 CYS HB2 1 64 ILE H . . 4.870 2.633 2.350 3.853 . 0 0 "[ . 1 . 2]" 1
420 1 63 CYS HB2 1 106 ILE MG . . 4.790 4.323 3.174 4.789 . 0 0 "[ . 1 . 2]" 1
421 1 63 CYS HB3 1 64 ILE H . . 4.870 3.309 2.473 3.713 . 0 0 "[ . 1 . 2]" 1
422 1 63 CYS HB3 1 106 ILE MG . . 4.900 3.441 1.973 4.846 . 0 0 "[ . 1 . 2]" 1
423 1 64 ILE H 1 64 ILE HB . . 3.870 2.754 2.528 3.606 . 0 0 "[ . 1 . 2]" 1
424 1 64 ILE H 1 64 ILE MD . . 4.430 4.261 3.704 4.375 . 0 0 "[ . 1 . 2]" 1
425 1 64 ILE H 1 64 ILE MG . . 3.910 1.971 1.925 2.103 . 0 0 "[ . 1 . 2]" 1
426 1 64 ILE H 1 65 SER H . . 3.810 2.595 2.464 2.744 . 0 0 "[ . 1 . 2]" 1
427 1 64 ILE HA 1 64 ILE MD . . 4.280 3.747 3.526 4.177 . 0 0 "[ . 1 . 2]" 1
428 1 64 ILE HB 1 65 SER H . . 4.470 3.975 3.940 4.006 . 0 0 "[ . 1 . 2]" 1
429 1 64 ILE MD 1 64 ILE MG . . 2.600 2.196 1.929 2.435 . 0 0 "[ . 1 . 2]" 1
430 1 64 ILE MG 1 65 SER H . . 3.840 2.391 2.053 3.851 0.011 11 0 "[ . 1 . 2]" 1
431 1 65 SER H 1 65 SER QB . . 3.630 2.172 2.049 2.270 . 0 0 "[ . 1 . 2]" 1
432 1 66 VAL H 1 66 VAL HB . . 3.830 2.584 2.378 2.661 . 0 0 "[ . 1 . 2]" 1
433 1 66 VAL H 1 66 VAL MG1 . . 3.970 3.537 2.080 3.764 . 0 0 "[ . 1 . 2]" 1
434 1 66 VAL H 1 66 VAL QG . . 3.130 2.119 1.918 2.345 . 0 0 "[ . 1 . 2]" 1
435 1 66 VAL H 1 66 VAL MG2 . . 3.970 2.353 1.924 3.761 . 0 0 "[ . 1 . 2]" 1
436 1 66 VAL H 1 67 LEU H . . 4.260 2.709 2.668 2.731 . 0 0 "[ . 1 . 2]" 1
437 1 66 VAL HA 1 66 VAL MG1 . . 3.210 2.438 2.212 3.204 . 0 0 "[ . 1 . 2]" 1
438 1 66 VAL HA 1 66 VAL QG . . 2.800 2.097 2.042 2.265 . 0 0 "[ . 1 . 2]" 1
439 1 66 VAL HA 1 66 VAL MG2 . . 3.210 2.348 2.217 2.434 . 0 0 "[ . 1 . 2]" 1
440 1 66 VAL HA 1 67 LEU HA . . 5.180 4.869 4.854 4.878 . 0 0 "[ . 1 . 2]" 1
441 1 66 VAL HA 1 69 ALA H . . 4.260 3.232 3.198 3.279 . 0 0 "[ . 1 . 2]" 1
442 1 66 VAL HA 1 69 ALA MB . . 3.500 2.962 2.686 3.041 . 0 0 "[ . 1 . 2]" 1
443 1 66 VAL HB 1 69 ALA MB . . 4.990 4.942 4.616 4.994 0.004 10 0 "[ . 1 . 2]" 1
444 1 66 VAL QG 1 69 ALA H . . 3.950 3.856 3.710 3.948 . 0 0 "[ . 1 . 2]" 1
445 1 66 VAL QG 1 69 ALA MB . . 3.360 2.779 2.559 2.984 . 0 0 "[ . 1 . 2]" 1
446 1 66 VAL MG1 1 69 ALA MB . . 4.500 3.091 2.665 4.522 0.022 20 0 "[ . 1 . 2]" 1
447 1 66 VAL MG2 1 69 ALA MB . . 4.500 4.018 2.573 4.395 . 0 0 "[ . 1 . 2]" 1
448 1 67 LEU H 1 67 LEU QB . . 3.500 2.121 2.025 2.541 . 0 0 "[ . 1 . 2]" 1
449 1 67 LEU HA 1 67 LEU QD . . 3.110 2.680 1.929 3.032 . 0 0 "[ . 1 . 2]" 1
450 1 68 LEU H 1 68 LEU HB2 . . 4.100 2.593 2.576 2.654 . 0 0 "[ . 1 . 2]" 1
451 1 68 LEU H 1 68 LEU QB . . 3.550 2.234 2.229 2.236 . 0 0 "[ . 1 . 2]" 1
452 1 68 LEU H 1 68 LEU HB3 . . 4.100 2.439 2.406 2.448 . 0 0 "[ . 1 . 2]" 1
453 1 68 LEU H 1 68 LEU MD1 . . 4.050 4.027 3.944 4.041 . 0 0 "[ . 1 . 2]" 1
454 1 68 LEU H 1 68 LEU MD2 . . 4.150 4.049 4.042 4.074 . 0 0 "[ . 1 . 2]" 1
455 1 68 LEU H 1 68 LEU HG . . 4.740 4.618 4.613 4.637 . 0 0 "[ . 1 . 2]" 1
456 1 68 LEU HA 1 70 LEU H . . 4.380 4.068 3.898 4.112 . 0 0 "[ . 1 . 2]" 1
457 1 68 LEU HA 1 70 LEU HG . . 5.020 5.014 4.799 5.057 0.037 15 0 "[ . 1 . 2]" 1
458 1 68 LEU HA 1 72 VAL QG . . 4.700 3.840 3.733 4.284 . 0 0 "[ . 1 . 2]" 1
459 1 68 LEU QB 1 68 LEU MD1 . . 2.960 2.068 2.062 2.085 . 0 0 "[ . 1 . 2]" 1
460 1 68 LEU QB 1 69 ALA H . . 4.430 2.581 2.453 2.634 . 0 0 "[ . 1 . 2]" 1
461 1 68 LEU QB 1 71 THR MG . . 4.240 3.934 3.798 4.305 0.065 17 0 "[ . 1 . 2]" 1
462 1 68 LEU QB 1 72 VAL QG . . 4.340 4.047 4.034 4.061 . 0 0 "[ . 1 . 2]" 1
463 1 68 LEU MD1 1 69 ALA H . . 3.640 3.056 2.669 3.137 . 0 0 "[ . 1 . 2]" 1
464 1 68 LEU MD1 1 69 ALA MB . . 4.010 3.335 3.273 3.400 . 0 0 "[ . 1 . 2]" 1
465 1 68 LEU MD1 1 72 VAL H . . 4.800 3.809 3.712 3.918 . 0 0 "[ . 1 . 2]" 1
466 1 68 LEU MD1 1 72 VAL HB . . 4.380 3.218 3.104 3.835 . 0 0 "[ . 1 . 2]" 1
467 1 68 LEU MD2 1 71 THR H . . 4.790 4.213 3.784 4.329 . 0 0 "[ . 1 . 2]" 1
468 1 68 LEU MD2 1 71 THR MG . . 2.720 2.156 1.922 2.215 . 0 0 "[ . 1 . 2]" 1
469 1 68 LEU MD2 1 72 VAL H . . 3.930 3.497 3.465 3.598 . 0 0 "[ . 1 . 2]" 1
470 1 68 LEU MD2 1 72 VAL HA . . 4.580 4.545 4.516 4.622 0.042 11 0 "[ . 1 . 2]" 1
471 1 68 LEU MD2 1 72 VAL QG . . 2.540 1.966 1.870 2.450 . 0 0 "[ . 1 . 2]" 1
472 1 68 LEU HG 1 69 ALA HA . . 5.500 5.522 5.419 5.556 0.056 20 0 "[ . 1 . 2]" 1
473 1 68 LEU HG 1 71 THR MG . . 4.650 4.550 4.420 4.584 . 0 0 "[ . 1 . 2]" 1
474 1 69 ALA H 1 69 ALA MB . . 3.170 2.224 2.072 2.240 . 0 0 "[ . 1 . 2]" 1
475 1 69 ALA H 1 70 LEU H . . 4.440 2.617 2.574 2.766 . 0 0 "[ . 1 . 2]" 1
476 1 69 ALA H 1 70 LEU HG . . 4.860 3.803 3.738 4.072 . 0 0 "[ . 1 . 2]" 1
477 1 69 ALA H 1 72 VAL QG . . 5.440 4.411 3.970 4.518 . 0 0 "[ . 1 . 2]" 1
478 1 69 ALA HA 1 72 VAL H . . 4.460 3.503 3.307 3.591 . 0 0 "[ . 1 . 2]" 1
479 1 69 ALA HA 1 72 VAL HB . . 5.020 2.521 2.403 2.608 . 0 0 "[ . 1 . 2]" 1
480 1 69 ALA HA 1 72 VAL QG . . 4.140 2.974 2.115 3.156 . 0 0 "[ . 1 . 2]" 1
481 1 69 ALA MB 1 70 LEU H . . 3.740 2.783 2.771 2.835 . 0 0 "[ . 1 . 2]" 1
482 1 69 ALA MB 1 70 LEU HA . . 4.050 3.869 3.761 3.882 . 0 0 "[ . 1 . 2]" 1
483 1 69 ALA MB 1 70 LEU QD . . 4.180 2.844 2.674 3.377 . 0 0 "[ . 1 . 2]" 1
484 1 69 ALA MB 1 70 LEU HG . . 3.710 3.710 3.702 3.721 0.011 20 0 "[ . 1 . 2]" 1
485 1 69 ALA MB 1 71 THR H . . 5.060 4.903 4.888 4.915 . 0 0 "[ . 1 . 2]" 1
486 1 69 ALA MB 1 72 VAL H . . 5.500 4.641 4.418 4.723 . 0 0 "[ . 1 . 2]" 1
487 1 69 ALA MB 1 72 VAL HB . . 5.500 3.964 3.585 4.115 . 0 0 "[ . 1 . 2]" 1
488 1 69 ALA MB 1 72 VAL QG . . 5.380 3.948 3.471 4.096 . 0 0 "[ . 1 . 2]" 1
489 1 70 LEU H 1 70 LEU QB . . 3.630 2.661 2.570 2.684 . 0 0 "[ . 1 . 2]" 1
490 1 70 LEU H 1 70 LEU QD . . 4.060 2.537 2.446 2.890 . 0 0 "[ . 1 . 2]" 1
491 1 70 LEU H 1 70 LEU HG . . 3.450 1.951 1.944 1.991 . 0 0 "[ . 1 . 2]" 1
492 1 70 LEU H 1 71 THR H . . 4.020 2.786 2.750 2.862 . 0 0 "[ . 1 . 2]" 1
493 1 70 LEU H 1 73 PHE QB . . 5.090 4.702 4.585 5.111 0.021 11 0 "[ . 1 . 2]" 1
494 1 70 LEU HA 1 73 PHE H . . 4.510 3.517 3.475 3.553 . 0 0 "[ . 1 . 2]" 1
495 1 70 LEU HA 1 73 PHE QB . . 3.760 2.758 2.604 3.067 . 0 0 "[ . 1 . 2]" 1
496 1 70 LEU HA 1 73 PHE QD . . 5.500 4.315 3.713 4.986 . 0 0 "[ . 1 . 2]" 1
497 1 70 LEU QB 1 71 THR H . . 3.800 2.226 2.223 2.229 . 0 0 "[ . 1 . 2]" 1
498 1 70 LEU QB 1 71 THR MG . . 5.340 3.828 3.683 4.418 . 0 0 "[ . 1 . 2]" 1
499 1 70 LEU QB 1 73 PHE QB . . 4.500 4.190 4.117 4.419 . 0 0 "[ . 1 . 2]" 1
500 1 70 LEU HB2 1 71 THR H . . 4.470 2.248 2.246 2.255 . 0 0 "[ . 1 . 2]" 1
501 1 70 LEU HB3 1 71 THR H . . 4.470 3.598 3.487 3.629 . 0 0 "[ . 1 . 2]" 1
502 1 70 LEU QD 1 71 THR H . . 5.030 3.811 3.779 3.861 . 0 0 "[ . 1 . 2]" 1
503 1 70 LEU QD 1 73 PHE QB . . 4.480 3.944 3.866 4.159 . 0 0 "[ . 1 . 2]" 1
504 1 70 LEU HG 1 71 THR H . . 4.220 3.758 3.676 4.030 . 0 0 "[ . 1 . 2]" 1
505 1 71 THR H 1 71 THR HB . . 4.130 2.574 2.249 2.652 . 0 0 "[ . 1 . 2]" 1
506 1 71 THR H 1 71 THR MG . . 3.670 2.053 1.902 2.694 . 0 0 "[ . 1 . 2]" 1
507 1 71 THR H 1 72 VAL H . . 3.910 2.671 2.618 2.704 . 0 0 "[ . 1 . 2]" 1
508 1 71 THR HA 1 71 THR MG . . 3.280 3.194 3.155 3.203 . 0 0 "[ . 1 . 2]" 1
509 1 71 THR HA 1 74 LEU HB2 . . 4.240 3.536 3.039 3.795 . 0 0 "[ . 1 . 2]" 1
510 1 71 THR HA 1 74 LEU HB3 . . 4.670 4.391 3.328 4.670 0.000 1 0 "[ . 1 . 2]" 1
511 1 71 THR HA 1 74 LEU QD . . 4.230 3.866 3.016 4.212 . 0 0 "[ . 1 . 2]" 1
512 1 71 THR HB 1 72 VAL H . . 4.850 3.959 3.799 3.998 . 0 0 "[ . 1 . 2]" 1
513 1 71 THR MG 1 72 VAL H . . 4.000 2.074 2.053 2.151 . 0 0 "[ . 1 . 2]" 1
514 1 71 THR MG 1 72 VAL HA . . 4.060 3.301 3.016 3.377 . 0 0 "[ . 1 . 2]" 1
515 1 71 THR MG 1 72 VAL QG . . 2.940 2.004 1.956 2.188 . 0 0 "[ . 1 . 2]" 1
516 1 72 VAL H 1 72 VAL HB . . 4.040 2.466 2.457 2.499 . 0 0 "[ . 1 . 2]" 1
517 1 72 VAL H 1 72 VAL MG1 . . 3.910 3.758 3.756 3.764 . 0 0 "[ . 1 . 2]" 1
518 1 72 VAL H 1 72 VAL QG . . 3.130 2.204 2.157 2.313 . 0 0 "[ . 1 . 2]" 1
519 1 72 VAL H 1 72 VAL MG2 . . 3.910 2.219 2.170 2.334 . 0 0 "[ . 1 . 2]" 1
520 1 72 VAL H 1 73 PHE H . . 4.160 2.522 2.518 2.538 . 0 0 "[ . 1 . 2]" 1
521 1 72 VAL HA 1 72 VAL MG1 . . 3.640 2.366 2.337 2.410 . 0 0 "[ . 1 . 2]" 1
522 1 72 VAL HA 1 72 VAL QG . . 3.120 2.117 2.090 2.137 . 0 0 "[ . 1 . 2]" 1
523 1 72 VAL HA 1 72 VAL MG2 . . 3.640 2.388 2.339 2.412 . 0 0 "[ . 1 . 2]" 1
524 1 72 VAL HB 1 73 PHE H . . 3.750 2.817 2.722 2.827 . 0 0 "[ . 1 . 2]" 1
525 1 72 VAL HB 1 73 PHE HA . . 4.480 4.285 4.250 4.334 . 0 0 "[ . 1 . 2]" 1
526 1 72 VAL HB 1 73 PHE QB . . 5.340 4.311 4.110 4.389 . 0 0 "[ . 1 . 2]" 1
527 1 72 VAL QG 1 73 PHE H . . 4.280 3.304 3.271 3.324 . 0 0 "[ . 1 . 2]" 1
528 1 72 VAL QG 1 73 PHE HA . . 4.120 3.480 3.403 3.562 . 0 0 "[ . 1 . 2]" 1
529 1 73 PHE H 1 73 PHE QB . . 3.370 2.236 2.113 2.257 . 0 0 "[ . 1 . 2]" 1
530 1 73 PHE H 1 73 PHE QD . . 5.470 4.130 3.787 4.184 . 0 0 "[ . 1 . 2]" 1
531 1 73 PHE H 1 74 LEU H . . 4.090 2.711 2.551 2.887 . 0 0 "[ . 1 . 2]" 1
532 1 73 PHE HA 1 76 LEU QB . . 3.830 2.666 2.156 3.229 . 0 0 "[ . 1 . 2]" 1
533 1 73 PHE HA 1 76 LEU QD . . 4.830 3.768 2.919 4.742 . 0 0 "[ . 1 . 2]" 1
534 1 73 PHE HA 1 77 ILE HB . . 4.630 4.542 4.436 4.631 0.001 20 0 "[ . 1 . 2]" 1
535 1 73 PHE HA 1 77 ILE MD . . 5.500 5.507 5.502 5.514 0.014 11 0 "[ . 1 . 2]" 1
536 1 73 PHE HA 1 77 ILE MG . . 4.460 4.423 4.339 4.478 0.018 8 0 "[ . 1 . 2]" 1
537 1 73 PHE QB 1 74 LEU H . . 3.790 2.779 2.352 2.852 . 0 0 "[ . 1 . 2]" 1
538 1 73 PHE QB 1 74 LEU HA . . 5.340 4.178 3.876 4.291 . 0 0 "[ . 1 . 2]" 1
539 1 73 PHE QB 1 74 LEU HB2 . . 4.830 4.142 3.808 4.406 . 0 0 "[ . 1 . 2]" 1
540 1 73 PHE QB 1 74 LEU QD . . 5.280 4.328 2.573 5.045 . 0 0 "[ . 1 . 2]" 1
541 1 73 PHE QD 1 77 ILE HB . . 5.110 4.037 3.717 4.592 . 0 0 "[ . 1 . 2]" 1
542 1 73 PHE QD 1 77 ILE MG . . 4.690 3.960 3.378 4.337 . 0 0 "[ . 1 . 2]" 1
543 1 73 PHE QE 1 77 ILE HB . . 5.440 3.769 3.304 4.699 . 0 0 "[ . 1 . 2]" 1
544 1 73 PHE QE 1 77 ILE MD . . 4.040 3.023 2.603 3.718 . 0 0 "[ . 1 . 2]" 1
545 1 73 PHE QE 1 77 ILE MG . . 4.990 4.017 3.333 4.669 . 0 0 "[ . 1 . 2]" 1
546 1 74 LEU H 1 74 LEU HB2 . . 3.800 2.200 2.054 2.302 . 0 0 "[ . 1 . 2]" 1
547 1 74 LEU H 1 74 LEU HB3 . . 4.140 2.945 2.763 3.491 . 0 0 "[ . 1 . 2]" 1
548 1 74 LEU H 1 74 LEU QD . . 4.210 3.465 2.117 3.755 . 0 0 "[ . 1 . 2]" 1
549 1 74 LEU H 1 75 LEU H . . 4.110 2.585 2.461 2.800 . 0 0 "[ . 1 . 2]" 1
550 1 74 LEU H 1 75 LEU QD . . 4.460 4.025 3.635 4.463 0.003 12 0 "[ . 1 . 2]" 1
551 1 74 LEU HA 1 74 LEU QD . . 3.180 2.596 1.951 2.982 . 0 0 "[ . 1 . 2]" 1
552 1 74 LEU HA 1 77 ILE H . . 4.780 3.946 3.797 4.094 . 0 0 "[ . 1 . 2]" 1
553 1 74 LEU HA 1 77 ILE MG . . 4.140 2.243 1.896 2.610 . 0 0 "[ . 1 . 2]" 1
554 1 74 LEU HB2 1 75 LEU H . . 3.550 3.433 2.890 3.562 0.012 15 0 "[ . 1 . 2]" 1
555 1 74 LEU HB2 1 95 LEU MD1 . . 4.100 4.104 4.056 4.122 0.022 10 0 "[ . 1 . 2]" 1
556 1 74 LEU HB3 1 74 LEU MD1 . . 3.540 2.915 2.490 3.196 . 0 0 "[ . 1 . 2]" 1
557 1 74 LEU HB3 1 74 LEU MD2 . . 3.540 2.163 2.024 2.373 . 0 0 "[ . 1 . 2]" 1
558 1 74 LEU HB3 1 75 LEU H . . 3.770 2.641 2.334 3.436 . 0 0 "[ . 1 . 2]" 1
559 1 74 LEU HB3 1 75 LEU QD . . 3.280 2.563 2.357 3.150 . 0 0 "[ . 1 . 2]" 1
560 1 74 LEU MD1 1 98 THR MG . . 4.600 4.501 3.080 4.614 0.014 15 0 "[ . 1 . 2]" 1
561 1 75 LEU H 1 75 LEU QB . . 3.530 2.400 2.117 2.688 . 0 0 "[ . 1 . 2]" 1
562 1 75 LEU H 1 75 LEU MD1 . . 4.010 3.200 2.123 4.011 0.001 11 0 "[ . 1 . 2]" 1
563 1 75 LEU H 1 75 LEU QD . . 3.370 2.421 2.115 3.042 . 0 0 "[ . 1 . 2]" 1
564 1 75 LEU H 1 75 LEU MD2 . . 4.010 3.038 2.204 4.018 0.008 20 0 "[ . 1 . 2]" 1
565 1 75 LEU H 1 75 LEU HG . . 4.070 3.042 1.960 4.094 0.024 6 0 "[ . 1 . 2]" 1
566 1 75 LEU H 1 76 LEU H . . 3.860 2.530 2.489 2.662 . 0 0 "[ . 1 . 2]" 1
567 1 75 LEU H 1 77 ILE H . . 4.480 4.357 4.148 4.489 0.009 6 0 "[ . 1 . 2]" 1
568 1 75 LEU HA 1 75 LEU QD . . 2.940 2.236 1.893 2.581 . 0 0 "[ . 1 . 2]" 1
569 1 75 LEU QD 1 76 LEU H . . 3.940 3.909 3.823 3.964 0.024 16 0 "[ . 1 . 2]" 1
570 1 75 LEU MD1 1 76 LEU H . . 4.590 4.401 4.089 4.634 0.044 6 0 "[ . 1 . 2]" 1
571 1 75 LEU MD2 1 76 LEU H . . 4.590 4.424 4.168 4.636 0.046 10 0 "[ . 1 . 2]" 1
572 1 76 LEU H 1 76 LEU HB2 . . 3.960 2.298 2.160 2.504 . 0 0 "[ . 1 . 2]" 1
573 1 76 LEU H 1 76 LEU QB . . 3.210 2.174 2.109 2.237 . 0 0 "[ . 1 . 2]" 1
574 1 76 LEU H 1 76 LEU HB3 . . 3.960 2.751 2.514 2.948 . 0 0 "[ . 1 . 2]" 1
575 1 76 LEU H 1 77 ILE H . . 3.810 2.775 2.684 2.899 . 0 0 "[ . 1 . 2]" 1
576 1 76 LEU H 1 77 ILE MG . . 4.000 3.900 3.774 4.008 0.008 12 0 "[ . 1 . 2]" 1
577 1 76 LEU HA 1 76 LEU QD . . 3.230 2.537 1.894 3.088 . 0 0 "[ . 1 . 2]" 1
578 1 76 LEU QB 1 77 ILE H . . 3.600 2.259 2.219 2.378 . 0 0 "[ . 1 . 2]" 1
579 1 76 LEU QB 1 77 ILE HA . . 4.070 3.907 3.733 4.079 0.009 12 0 "[ . 1 . 2]" 1
580 1 76 LEU QB 1 77 ILE MG . . 4.490 3.996 3.924 4.111 . 0 0 "[ . 1 . 2]" 1
581 1 76 LEU QD 1 77 ILE H . . 4.030 3.139 2.737 3.458 . 0 0 "[ . 1 . 2]" 1
582 1 76 LEU QD 1 77 ILE HA . . 3.340 3.037 2.577 3.341 0.001 3 0 "[ . 1 . 2]" 1
583 1 76 LEU QD 1 79 LYS H . . 4.800 4.210 3.694 4.799 . 0 0 "[ . 1 . 2]" 1
584 1 77 ILE H 1 77 ILE HB . . 3.640 2.454 2.425 2.513 . 0 0 "[ . 1 . 2]" 1
585 1 77 ILE H 1 77 ILE MD . . 4.370 4.170 4.099 4.240 . 0 0 "[ . 1 . 2]" 1
586 1 77 ILE H 1 77 ILE HG12 . . 4.710 4.642 4.620 4.666 . 0 0 "[ . 1 . 2]" 1
587 1 77 ILE H 1 77 ILE HG13 . . 4.710 4.364 4.341 4.381 . 0 0 "[ . 1 . 2]" 1
588 1 77 ILE H 1 77 ILE MG . . 3.480 2.194 2.113 2.241 . 0 0 "[ . 1 . 2]" 1
589 1 77 ILE H 1 78 SER H . . 4.120 2.640 2.505 2.716 . 0 0 "[ . 1 . 2]" 1
590 1 77 ILE HA 1 77 ILE MD . . 3.970 3.241 3.061 3.430 . 0 0 "[ . 1 . 2]" 1
591 1 77 ILE HA 1 77 ILE QG . . 3.690 2.227 2.173 2.287 . 0 0 "[ . 1 . 2]" 1
592 1 77 ILE HA 1 77 ILE MG . . 3.570 3.198 3.194 3.200 . 0 0 "[ . 1 . 2]" 1
593 1 77 ILE HA 1 79 LYS H . . 4.070 3.868 3.515 4.077 0.007 20 0 "[ . 1 . 2]" 1
594 1 77 ILE HB 1 78 SER H . . 4.300 3.996 3.938 4.049 . 0 0 "[ . 1 . 2]" 1
595 1 77 ILE MD 1 78 SER H . . 5.230 5.111 5.067 5.161 . 0 0 "[ . 1 . 2]" 1
596 1 77 ILE MD 1 91 VAL MG1 . . 4.330 3.626 2.743 4.332 0.002 17 0 "[ . 1 . 2]" 1
597 1 77 ILE QG 1 78 SER H . . 4.380 4.022 3.957 4.072 . 0 0 "[ . 1 . 2]" 1
598 1 77 ILE QG 1 80 ILE QG . . 4.030 3.499 2.803 4.033 0.003 12 0 "[ . 1 . 2]" 1
599 1 77 ILE QG 1 80 ILE MG . . 3.960 2.785 2.250 3.636 . 0 0 "[ . 1 . 2]" 1
600 1 77 ILE HG12 1 77 ILE MG . . 3.570 2.123 2.039 2.163 . 0 0 "[ . 1 . 2]" 1
601 1 77 ILE HG12 1 78 SER H . . 5.060 4.508 4.381 4.686 . 0 0 "[ . 1 . 2]" 1
602 1 77 ILE HG13 1 77 ILE MG . . 3.570 3.022 2.941 3.107 . 0 0 "[ . 1 . 2]" 1
603 1 77 ILE HG13 1 78 SER H . . 5.060 4.528 4.426 4.639 . 0 0 "[ . 1 . 2]" 1
604 1 77 ILE MG 1 78 SER H . . 3.850 2.278 2.073 2.412 . 0 0 "[ . 1 . 2]" 1
605 1 77 ILE MG 1 78 SER HA . . 4.100 3.204 3.102 3.302 . 0 0 "[ . 1 . 2]" 1
606 1 77 ILE MG 1 78 SER QB . . 3.960 3.204 2.851 3.519 . 0 0 "[ . 1 . 2]" 1
607 1 77 ILE MG 1 91 VAL MG2 . . 4.000 3.483 2.128 4.047 0.047 10 0 "[ . 1 . 2]" 1
608 1 78 SER H 1 79 LYS H . . 3.860 2.427 2.370 2.621 . 0 0 "[ . 1 . 2]" 1
609 1 78 SER H 1 79 LYS QG . . 4.900 4.365 3.754 4.904 0.004 18 0 "[ . 1 . 2]" 1
610 1 79 LYS H 1 79 LYS QB . . 3.500 2.277 2.067 2.445 . 0 0 "[ . 1 . 2]" 1
611 1 79 LYS H 1 79 LYS HG2 . . 4.300 3.210 2.390 4.251 . 0 0 "[ . 1 . 2]" 1
612 1 79 LYS H 1 79 LYS QG . . 3.510 2.717 2.230 3.271 . 0 0 "[ . 1 . 2]" 1
613 1 79 LYS H 1 79 LYS HG3 . . 4.300 3.174 2.273 3.793 . 0 0 "[ . 1 . 2]" 1
614 1 79 LYS H 1 80 ILE H . . 3.480 2.581 2.259 2.774 . 0 0 "[ . 1 . 2]" 1
615 1 79 LYS H 1 80 ILE QG . . 4.570 4.142 3.823 4.305 . 0 0 "[ . 1 . 2]" 1
616 1 79 LYS H 1 80 ILE MG . . 5.180 3.727 3.163 4.284 . 0 0 "[ . 1 . 2]" 1
617 1 79 LYS HA 1 79 LYS QE . . 4.480 4.357 3.540 4.482 0.002 9 0 "[ . 1 . 2]" 1
618 1 79 LYS HA 1 79 LYS HG2 . . 4.230 2.635 2.113 4.184 . 0 0 "[ . 1 . 2]" 1
619 1 79 LYS HA 1 79 LYS QG . . 3.680 2.484 2.093 3.385 . 0 0 "[ . 1 . 2]" 1
620 1 79 LYS HA 1 79 LYS HG3 . . 4.230 3.358 2.601 3.762 . 0 0 "[ . 1 . 2]" 1
621 1 79 LYS HA 1 80 ILE QG . . 5.340 4.703 4.531 4.926 . 0 0 "[ . 1 . 2]" 1
622 1 79 LYS QB 1 79 LYS QE . . 3.830 2.812 2.095 3.727 . 0 0 "[ . 1 . 2]" 1
623 1 79 LYS QB 1 80 ILE H . . 3.820 3.233 2.844 3.709 . 0 0 "[ . 1 . 2]" 1
624 1 79 LYS QD 1 79 LYS QG . . 2.370 2.045 2.007 2.092 . 0 0 "[ . 1 . 2]" 1
625 1 79 LYS QE 1 79 LYS HG2 . . 3.900 2.804 2.021 3.376 . 0 0 "[ . 1 . 2]" 1
626 1 79 LYS QE 1 79 LYS QG . . 3.380 2.177 1.975 2.306 . 0 0 "[ . 1 . 2]" 1
627 1 79 LYS QE 1 79 LYS HG3 . . 3.900 2.489 2.101 3.271 . 0 0 "[ . 1 . 2]" 1
628 1 80 ILE H 1 80 ILE HB . . 3.970 3.612 3.604 3.617 . 0 0 "[ . 1 . 2]" 1
629 1 80 ILE H 1 80 ILE HG12 . . 3.740 2.750 1.957 3.246 . 0 0 "[ . 1 . 2]" 1
630 1 80 ILE H 1 80 ILE HG13 . . 3.740 2.743 2.272 3.628 . 0 0 "[ . 1 . 2]" 1
631 1 80 ILE H 1 80 ILE MG . . 3.250 2.033 1.897 2.346 . 0 0 "[ . 1 . 2]" 1
632 1 80 ILE H 1 81 VAL H . . 3.450 2.721 2.626 2.816 . 0 0 "[ . 1 . 2]" 1
633 1 80 ILE H 1 81 VAL QG . . 4.590 4.159 4.014 4.300 . 0 0 "[ . 1 . 2]" 1
634 1 80 ILE H 1 82 PRO HD3 . . 5.120 4.422 4.145 4.927 . 0 0 "[ . 1 . 2]" 1
635 1 80 ILE HA 1 80 ILE HG12 . . 4.230 3.998 3.654 4.203 . 0 0 "[ . 1 . 2]" 1
636 1 80 ILE HA 1 80 ILE QG . . 3.670 3.336 3.301 3.374 . 0 0 "[ . 1 . 2]" 1
637 1 80 ILE HA 1 80 ILE HG13 . . 4.230 3.597 3.516 3.763 . 0 0 "[ . 1 . 2]" 1
638 1 80 ILE HA 1 80 ILE MG . . 3.290 2.382 2.223 2.448 . 0 0 "[ . 1 . 2]" 1
639 1 80 ILE HB 1 81 VAL H . . 4.270 3.983 3.644 4.199 . 0 0 "[ . 1 . 2]" 1
640 1 80 ILE MD 1 81 VAL H . . 3.950 3.459 2.963 3.972 0.022 6 0 "[ . 1 . 2]" 1
641 1 80 ILE MD 1 82 PRO QB . . 4.470 2.409 1.949 3.597 . 0 0 "[ . 1 . 2]" 1
642 1 80 ILE MD 1 82 PRO HD3 . . 3.970 2.349 1.975 2.914 . 0 0 "[ . 1 . 2]" 1
643 1 80 ILE QG 1 80 ILE MG . . 3.230 2.132 1.928 2.380 . 0 0 "[ . 1 . 2]" 1
644 1 80 ILE QG 1 81 VAL H . . 4.030 2.183 1.978 2.333 . 0 0 "[ . 1 . 2]" 1
645 1 80 ILE QG 1 82 PRO HD3 . . 4.500 2.107 1.951 2.304 . 0 0 "[ . 1 . 2]" 1
646 1 81 VAL H 1 81 VAL HB . . 4.010 3.567 3.002 3.684 . 0 0 "[ . 1 . 2]" 1
647 1 81 VAL H 1 81 VAL QG . . 3.110 2.541 2.364 2.840 . 0 0 "[ . 1 . 2]" 1
648 1 81 VAL H 1 82 PRO HD2 . . 3.920 3.201 3.094 3.504 . 0 0 "[ . 1 . 2]" 1
649 1 81 VAL H 1 82 PRO HD3 . . 4.030 2.677 2.559 3.064 . 0 0 "[ . 1 . 2]" 1
650 1 81 VAL HA 1 82 PRO HD2 . . 3.590 2.036 1.997 2.062 . 0 0 "[ . 1 . 2]" 1
651 1 81 VAL HA 1 82 PRO HD3 . . 3.420 2.848 2.780 2.888 . 0 0 "[ . 1 . 2]" 1
652 1 81 VAL QG 1 82 PRO HD2 . . 4.590 3.344 3.239 3.417 . 0 0 "[ . 1 . 2]" 1
653 1 81 VAL QG 1 82 PRO HD3 . . 4.590 3.980 3.943 4.006 . 0 0 "[ . 1 . 2]" 1
654 1 82 PRO HA 1 83 PRO QD . . 3.460 2.136 1.859 2.174 . 0 0 "[ . 1 . 2]" 1
655 1 82 PRO HA 1 83 PRO HG2 . . 5.500 4.568 4.133 4.625 . 0 0 "[ . 1 . 2]" 1
656 1 82 PRO QB 1 83 PRO QD . . 3.620 2.145 2.002 3.275 . 0 0 "[ . 1 . 2]" 1
657 1 83 PRO HB2 1 84 THR H . . 3.670 2.949 2.891 3.533 . 0 0 "[ . 1 . 2]" 1
658 1 83 PRO HB2 1 84 THR HA . . 4.620 4.366 4.232 4.475 . 0 0 "[ . 1 . 2]" 1
659 1 83 PRO HB2 1 84 THR MG . . 5.200 3.699 3.328 4.775 . 0 0 "[ . 1 . 2]" 1
660 1 83 PRO HB3 1 84 THR H . . 4.620 3.918 3.885 4.257 . 0 0 "[ . 1 . 2]" 1
661 1 83 PRO HD2 1 84 THR H . . 4.020 2.742 2.681 2.758 . 0 0 "[ . 1 . 2]" 1
662 1 83 PRO HD3 1 84 THR H . . 4.020 3.869 3.859 3.875 . 0 0 "[ . 1 . 2]" 1
663 1 83 PRO HG2 1 84 THR H . . 3.300 1.971 1.913 2.635 . 0 0 "[ . 1 . 2]" 1
664 1 84 THR H 1 84 THR HB . . 3.070 3.084 2.874 3.224 0.154 12 0 "[ . 1 . 2]" 1
665 1 84 THR H 1 84 THR MG . . 3.120 2.121 1.919 2.280 . 0 0 "[ . 1 . 2]" 1
666 1 84 THR H 1 85 SER H . . 3.280 1.964 1.861 2.193 . 0 0 "[ . 1 . 2]" 1
667 1 84 THR H 1 85 SER QB . . 5.220 4.491 4.246 4.742 . 0 0 "[ . 1 . 2]" 1
668 1 84 THR H 1 86 LEU H . . 4.140 3.785 3.193 4.150 0.010 5 0 "[ . 1 . 2]" 1
669 1 84 THR HA 1 84 THR MG . . 3.250 3.200 3.187 3.208 . 0 0 "[ . 1 . 2]" 1
670 1 84 THR MG 1 85 SER H . . 3.870 2.544 1.947 3.434 . 0 0 "[ . 1 . 2]" 1
671 1 84 THR MG 1 86 LEU H . . 4.570 2.750 1.857 4.592 0.022 16 0 "[ . 1 . 2]" 1
672 1 85 SER H 1 85 SER QB . . 3.110 2.961 2.865 3.121 0.011 11 0 "[ . 1 . 2]" 1
673 1 85 SER H 1 86 LEU H . . 3.150 2.750 2.001 3.078 . 0 0 "[ . 1 . 2]" 1
674 1 85 SER H 1 86 LEU QB . . 4.640 4.248 3.444 4.644 0.004 5 0 "[ . 1 . 2]" 1
675 1 85 SER HA 1 86 LEU H . . 3.540 2.853 2.307 3.556 0.016 16 0 "[ . 1 . 2]" 1
676 1 85 SER QB 1 86 LEU H . . 4.170 3.669 2.547 4.063 . 0 0 "[ . 1 . 2]" 1
677 1 86 LEU H 1 86 LEU QB . . 2.960 2.418 2.042 2.949 . 0 0 "[ . 1 . 2]" 1
678 1 86 LEU H 1 86 LEU QD . . 4.110 3.720 3.226 4.060 . 0 0 "[ . 1 . 2]" 1
679 1 86 LEU H 1 87 ASP H . . 2.960 2.719 2.108 3.004 0.044 6 0 "[ . 1 . 2]" 1
680 1 86 LEU H 1 87 ASP HA . . 5.500 4.912 4.366 5.311 . 0 0 "[ . 1 . 2]" 1
681 1 86 LEU HA 1 86 LEU QD . . 2.910 2.403 1.929 2.913 0.003 6 0 "[ . 1 . 2]" 1
682 1 86 LEU HA 1 87 ASP H . . 3.340 2.941 2.433 3.410 0.070 12 0 "[ . 1 . 2]" 1
683 1 86 LEU QB 1 86 LEU QD . . 2.500 1.863 1.748 2.045 . 0 0 "[ . 1 . 2]" 1
684 1 87 ASP H 1 87 ASP QB . . 2.870 2.725 2.365 3.113 0.243 10 0 "[ . 1 . 2]" 1
685 1 87 ASP H 1 88 VAL H . . 3.360 2.661 1.958 3.219 . 0 0 "[ . 1 . 2]" 1
686 1 87 ASP H 1 88 VAL QG . . 4.600 3.906 3.345 4.393 . 0 0 "[ . 1 . 2]" 1
687 1 87 ASP HA 1 88 VAL H . . 2.990 2.930 2.505 3.016 0.026 3 0 "[ . 1 . 2]" 1
688 1 87 ASP HA 1 88 VAL HB . . 5.150 5.019 4.624 5.109 . 0 0 "[ . 1 . 2]" 1
689 1 87 ASP HA 1 88 VAL QG . . 5.290 4.751 4.486 4.815 . 0 0 "[ . 1 . 2]" 1
690 1 87 ASP HA 1 89 PRO HD2 . . 3.650 3.256 2.969 3.349 . 0 0 "[ . 1 . 2]" 1
691 1 87 ASP HA 1 90 LEU QD . . 5.440 2.028 1.939 2.579 . 0 0 "[ . 1 . 2]" 1
692 1 87 ASP HA 1 91 VAL QG . . 4.970 4.018 3.836 4.246 . 0 0 "[ . 1 . 2]" 1
693 1 87 ASP QB 1 88 VAL H . . 4.060 3.782 3.737 3.925 . 0 0 "[ . 1 . 2]" 1
694 1 87 ASP QB 1 90 LEU QD . . 4.530 3.350 2.877 3.530 . 0 0 "[ . 1 . 2]" 1
695 1 87 ASP QB 1 91 VAL QG . . 3.830 2.407 2.121 2.542 . 0 0 "[ . 1 . 2]" 1
696 1 87 ASP HB2 1 88 VAL H . . 4.620 4.078 3.985 4.552 . 0 0 "[ . 1 . 2]" 1
697 1 87 ASP HB2 1 91 VAL MG1 . . 5.410 5.398 5.301 5.503 0.093 10 0 "[ . 1 . 2]" 1
698 1 87 ASP HB2 1 91 VAL MG2 . . 5.410 2.950 2.830 3.099 . 0 0 "[ . 1 . 2]" 1
699 1 87 ASP HB3 1 88 VAL H . . 4.620 4.510 4.286 4.566 . 0 0 "[ . 1 . 2]" 1
700 1 87 ASP HB3 1 91 VAL MG1 . . 5.410 5.260 4.841 5.414 0.004 16 0 "[ . 1 . 2]" 1
701 1 87 ASP HB3 1 91 VAL MG2 . . 5.410 2.579 2.176 2.823 . 0 0 "[ . 1 . 2]" 1
702 1 88 VAL H 1 88 VAL HB . . 3.500 2.214 2.209 2.218 . 0 0 "[ . 1 . 2]" 1
703 1 88 VAL H 1 88 VAL QG . . 3.030 2.711 2.668 2.763 . 0 0 "[ . 1 . 2]" 1
704 1 88 VAL H 1 89 PRO HD2 . . 3.840 1.937 1.913 1.967 . 0 0 "[ . 1 . 2]" 1
705 1 88 VAL H 1 89 PRO HD3 . . 3.250 3.000 2.987 3.018 . 0 0 "[ . 1 . 2]" 1
706 1 88 VAL H 1 90 LEU H . . 4.190 3.709 3.681 3.898 . 0 0 "[ . 1 . 2]" 1
707 1 88 VAL HA 1 88 VAL MG1 . . 3.220 2.642 2.641 2.647 . 0 0 "[ . 1 . 2]" 1
708 1 88 VAL HA 1 88 VAL MG2 . . 3.220 2.112 2.010 2.223 . 0 0 "[ . 1 . 2]" 1
709 1 88 VAL HA 1 89 PRO HD2 . . 3.780 3.758 3.758 3.760 . 0 0 "[ . 1 . 2]" 1
710 1 88 VAL HA 1 91 VAL H . . 5.210 4.018 3.882 4.226 . 0 0 "[ . 1 . 2]" 1
711 1 88 VAL HA 1 92 GLY H . . 4.560 3.971 3.617 4.349 . 0 0 "[ . 1 . 2]" 1
712 1 88 VAL HB 1 89 PRO HD2 . . 4.240 2.505 2.497 2.512 . 0 0 "[ . 1 . 2]" 1
713 1 88 VAL QG 1 89 PRO HB3 . . 3.390 3.250 3.232 3.256 . 0 0 "[ . 1 . 2]" 1
714 1 88 VAL QG 1 89 PRO HD2 . . 3.970 3.108 3.092 3.112 . 0 0 "[ . 1 . 2]" 1
715 1 88 VAL QG 1 89 PRO HD3 . . 3.420 2.032 2.002 2.041 . 0 0 "[ . 1 . 2]" 1
716 1 88 VAL QG 1 89 PRO QG . . 3.620 3.514 3.493 3.521 . 0 0 "[ . 1 . 2]" 1
717 1 88 VAL QG 1 92 GLY HA3 . . 4.560 4.016 3.722 4.561 0.001 16 0 "[ . 1 . 2]" 1
718 1 89 PRO HA 1 92 GLY H . . 4.260 3.712 3.313 4.023 . 0 0 "[ . 1 . 2]" 1
719 1 89 PRO HB2 1 90 LEU H . . 3.950 3.540 3.202 3.585 . 0 0 "[ . 1 . 2]" 1
720 1 89 PRO HB2 1 90 LEU QD . . 4.270 3.151 3.062 3.474 . 0 0 "[ . 1 . 2]" 1
721 1 89 PRO HB3 1 90 LEU H . . 4.320 4.261 4.064 4.287 . 0 0 "[ . 1 . 2]" 1
722 1 89 PRO HD2 1 90 LEU H . . 4.070 2.691 2.658 2.703 . 0 0 "[ . 1 . 2]" 1
723 1 89 PRO HD2 1 90 LEU MD1 . . 4.940 4.850 3.397 5.009 0.069 10 0 "[ . 1 . 2]" 1
724 1 89 PRO HD2 1 90 LEU QD . . 4.170 2.675 2.566 3.708 . 0 0 "[ . 1 . 2]" 1
725 1 89 PRO HD2 1 90 LEU MD2 . . 4.940 2.817 2.574 4.928 . 0 0 "[ . 1 . 2]" 1
726 1 89 PRO HD3 1 90 LEU H . . 4.510 3.865 3.838 3.872 . 0 0 "[ . 1 . 2]" 1
727 1 89 PRO QG 1 90 LEU H . . 3.690 2.616 2.199 2.676 . 0 0 "[ . 1 . 2]" 1
728 1 89 PRO QG 1 90 LEU QD . . 4.010 1.929 1.856 2.534 . 0 0 "[ . 1 . 2]" 1
729 1 90 LEU H 1 90 LEU HB2 . . 3.820 2.296 2.100 2.323 . 0 0 "[ . 1 . 2]" 1
730 1 90 LEU H 1 90 LEU QB . . 3.320 2.269 2.082 2.295 . 0 0 "[ . 1 . 2]" 1
731 1 90 LEU H 1 90 LEU HB3 . . 3.820 3.550 3.420 3.564 . 0 0 "[ . 1 . 2]" 1
732 1 90 LEU H 1 90 LEU MD1 . . 4.140 3.380 2.246 3.508 . 0 0 "[ . 1 . 2]" 1
733 1 90 LEU H 1 90 LEU QD . . 3.470 1.932 1.873 2.507 . 0 0 "[ . 1 . 2]" 1
734 1 90 LEU H 1 90 LEU MD2 . . 4.140 2.086 1.882 3.835 . 0 0 "[ . 1 . 2]" 1
735 1 90 LEU H 1 90 LEU HG . . 4.210 4.000 3.971 4.212 0.002 11 0 "[ . 1 . 2]" 1
736 1 90 LEU H 1 91 VAL H . . 3.600 2.634 2.543 2.896 . 0 0 "[ . 1 . 2]" 1
737 1 90 LEU H 1 92 GLY H . . 4.210 3.779 3.518 4.042 . 0 0 "[ . 1 . 2]" 1
738 1 90 LEU HA 1 90 LEU MD1 . . 4.030 2.051 2.014 2.403 . 0 0 "[ . 1 . 2]" 1
739 1 90 LEU HA 1 90 LEU QD . . 3.350 2.021 1.987 2.379 . 0 0 "[ . 1 . 2]" 1
740 1 90 LEU HA 1 90 LEU MD2 . . 4.030 3.070 2.973 3.802 . 0 0 "[ . 1 . 2]" 1
741 1 90 LEU QB 1 90 LEU QD . . 2.730 1.958 1.926 1.962 . 0 0 "[ . 1 . 2]" 1
742 1 90 LEU QB 1 91 VAL H . . 3.330 2.389 2.338 2.604 . 0 0 "[ . 1 . 2]" 1
743 1 90 LEU QB 1 91 VAL HA . . 4.520 3.860 3.783 3.912 . 0 0 "[ . 1 . 2]" 1
744 1 90 LEU QB 1 91 VAL QG . . 3.870 2.809 2.718 2.965 . 0 0 "[ . 1 . 2]" 1
745 1 90 LEU HB2 1 155 MET ME . . 4.000 3.948 3.453 4.002 0.002 18 0 "[ . 1 . 2]" 1
746 1 90 LEU MD1 1 158 GLN HG2 . . 4.600 3.972 3.063 4.601 0.001 11 0 "[ . 1 . 2]" 1
747 1 91 VAL H 1 91 VAL HB . . 3.170 2.588 2.484 2.634 . 0 0 "[ . 1 . 2]" 1
748 1 91 VAL H 1 91 VAL MG1 . . 3.860 3.782 3.764 3.788 . 0 0 "[ . 1 . 2]" 1
749 1 91 VAL H 1 91 VAL QG . . 2.880 2.163 2.009 2.293 . 0 0 "[ . 1 . 2]" 1
750 1 91 VAL H 1 91 VAL MG2 . . 3.860 2.176 2.016 2.313 . 0 0 "[ . 1 . 2]" 1
751 1 91 VAL HA 1 91 VAL MG1 . . 3.250 2.250 2.211 2.323 . 0 0 "[ . 1 . 2]" 1
752 1 91 VAL HA 1 91 VAL QG . . 2.800 2.070 2.041 2.115 . 0 0 "[ . 1 . 2]" 1
753 1 91 VAL HA 1 91 VAL MG2 . . 3.250 2.420 2.367 2.473 . 0 0 "[ . 1 . 2]" 1
754 1 91 VAL HA 1 93 LYS H . . 4.570 4.290 3.704 4.553 . 0 0 "[ . 1 . 2]" 1
755 1 91 VAL HA 1 94 TYR H . . 3.730 3.232 3.051 3.337 . 0 0 "[ . 1 . 2]" 1
756 1 91 VAL HA 1 94 TYR HB2 . . 3.950 3.170 3.010 3.317 . 0 0 "[ . 1 . 2]" 1
757 1 91 VAL HA 1 94 TYR HB3 . . 4.040 2.537 2.279 2.998 . 0 0 "[ . 1 . 2]" 1
758 1 91 VAL HA 1 95 LEU H . . 4.340 4.367 4.348 4.393 0.053 3 0 "[ . 1 . 2]" 1
759 1 91 VAL HB 1 92 GLY H . . 3.970 2.720 2.437 3.104 . 0 0 "[ . 1 . 2]" 1
760 1 91 VAL HB 1 92 GLY HA2 . . 4.320 4.126 4.036 4.211 . 0 0 "[ . 1 . 2]" 1
761 1 91 VAL HB 1 94 TYR HB3 . . 4.980 4.902 4.637 5.007 0.027 12 0 "[ . 1 . 2]" 1
762 1 91 VAL QG 1 92 GLY H . . 3.850 3.313 3.136 3.492 . 0 0 "[ . 1 . 2]" 1
763 1 91 VAL QG 1 92 GLY HA2 . . 4.280 3.707 3.475 3.929 . 0 0 "[ . 1 . 2]" 1
764 1 91 VAL QG 1 94 TYR H . . 4.290 3.942 3.416 4.115 . 0 0 "[ . 1 . 2]" 1
765 1 91 VAL QG 1 94 TYR HB2 . . 4.410 3.838 3.227 4.165 . 0 0 "[ . 1 . 2]" 1
766 1 91 VAL QG 1 94 TYR HB3 . . 4.500 2.734 2.020 3.089 . 0 0 "[ . 1 . 2]" 1
767 1 91 VAL QG 1 94 TYR QD . . 4.050 2.831 2.127 3.480 . 0 0 "[ . 1 . 2]" 1
768 1 91 VAL QG 1 95 LEU HG . . 3.460 3.203 2.676 3.445 . 0 0 "[ . 1 . 2]" 1
769 1 92 GLY H 1 93 LYS H . . 3.480 2.881 2.798 2.946 . 0 0 "[ . 1 . 2]" 1
770 1 92 GLY H 1 93 LYS QB . . 5.210 4.937 4.563 5.231 0.021 13 0 "[ . 1 . 2]" 1
771 1 92 GLY H 1 95 LEU HG . . 4.250 4.251 4.211 4.281 0.031 10 0 "[ . 1 . 2]" 1
772 1 92 GLY HA2 1 94 TYR H . . 4.440 4.226 3.985 4.412 . 0 0 "[ . 1 . 2]" 1
773 1 92 GLY HA2 1 95 LEU H . . 4.100 3.635 3.486 3.755 . 0 0 "[ . 1 . 2]" 1
774 1 92 GLY HA2 1 95 LEU MD2 . . 3.980 3.629 3.378 3.983 0.003 8 0 "[ . 1 . 2]" 1
775 1 92 GLY HA2 1 95 LEU HG . . 4.580 2.225 2.113 2.397 . 0 0 "[ . 1 . 2]" 1
776 1 92 GLY HA3 1 93 LYS H . . 3.270 2.771 2.673 2.931 . 0 0 "[ . 1 . 2]" 1
777 1 92 GLY HA3 1 93 LYS QB . . 5.340 4.643 4.420 4.955 . 0 0 "[ . 1 . 2]" 1
778 1 92 GLY HA3 1 95 LEU HB2 . . 5.500 5.122 4.865 5.308 . 0 0 "[ . 1 . 2]" 1
779 1 92 GLY HA3 1 95 LEU HG . . 4.220 3.843 3.693 4.070 . 0 0 "[ . 1 . 2]" 1
780 1 93 LYS H 1 93 LYS QB . . 2.910 2.427 2.128 2.644 . 0 0 "[ . 1 . 2]" 1
781 1 93 LYS H 1 93 LYS QD . . 4.320 3.793 2.592 4.383 0.063 1 0 "[ . 1 . 2]" 1
782 1 93 LYS H 1 93 LYS QE . . 5.500 4.606 3.009 5.502 0.002 8 0 "[ . 1 . 2]" 1
783 1 93 LYS H 1 93 LYS QG . . 3.850 2.759 1.935 3.930 0.080 11 0 "[ . 1 . 2]" 1
784 1 93 LYS H 1 94 TYR H . . 3.590 2.539 2.401 2.647 . 0 0 "[ . 1 . 2]" 1
785 1 93 LYS H 1 94 TYR HB2 . . 5.310 4.980 4.832 5.106 . 0 0 "[ . 1 . 2]" 1
786 1 93 LYS HA 1 93 LYS QD . . 3.940 3.478 2.001 3.962 0.022 1 0 "[ . 1 . 2]" 1
787 1 93 LYS HA 1 93 LYS QE . . 5.280 4.528 2.066 5.171 . 0 0 "[ . 1 . 2]" 1
788 1 93 LYS HA 1 93 LYS HG2 . . 4.090 3.612 2.901 4.110 0.020 10 0 "[ . 1 . 2]" 1
789 1 93 LYS HA 1 93 LYS QG . . 3.570 3.041 2.077 3.360 . 0 0 "[ . 1 . 2]" 1
790 1 93 LYS HA 1 93 LYS HG3 . . 4.090 3.414 2.109 4.110 0.020 5 0 "[ . 1 . 2]" 1
791 1 93 LYS HA 1 96 MET H . . 3.810 3.693 3.596 3.814 0.004 2 0 "[ . 1 . 2]" 1
792 1 93 LYS QB 1 93 LYS QD . . 3.210 2.095 1.965 2.354 . 0 0 "[ . 1 . 2]" 1
793 1 93 LYS QB 1 94 TYR H . . 3.380 3.213 2.957 3.470 0.090 10 0 "[ . 1 . 2]" 1
794 1 93 LYS QB 1 94 TYR HA . . 4.880 4.236 3.901 4.383 . 0 0 "[ . 1 . 2]" 1
795 1 93 LYS QG 1 94 TYR H . . 5.270 2.956 1.933 4.443 . 0 0 "[ . 1 . 2]" 1
796 1 93 LYS HG2 1 155 MET ME . . 4.200 4.186 4.052 4.203 0.003 16 0 "[ . 1 . 2]" 1
797 1 94 TYR H 1 94 TYR HB2 . . 3.280 2.677 2.523 2.768 . 0 0 "[ . 1 . 2]" 1
798 1 94 TYR H 1 94 TYR HB3 . . 3.230 2.417 2.355 2.536 . 0 0 "[ . 1 . 2]" 1
799 1 94 TYR H 1 94 TYR QD . . 4.700 4.183 4.148 4.212 . 0 0 "[ . 1 . 2]" 1
800 1 94 TYR H 1 95 LEU H . . 3.480 2.580 2.455 2.705 . 0 0 "[ . 1 . 2]" 1
801 1 94 TYR H 1 95 LEU HA . . 5.290 5.175 5.060 5.287 . 0 0 "[ . 1 . 2]" 1
802 1 94 TYR H 1 95 LEU HB2 . . 5.090 5.008 4.874 5.113 0.023 7 0 "[ . 1 . 2]" 1
803 1 94 TYR H 1 95 LEU MD2 . . 4.020 4.035 4.013 4.053 0.033 10 0 "[ . 1 . 2]" 1
804 1 94 TYR HA 1 94 TYR QD . . 4.460 2.623 2.286 2.951 . 0 0 "[ . 1 . 2]" 1
805 1 94 TYR HA 1 96 MET H . . 4.240 3.845 3.773 3.952 . 0 0 "[ . 1 . 2]" 1
806 1 94 TYR HA 1 96 MET QB . . 4.610 4.468 4.289 4.602 . 0 0 "[ . 1 . 2]" 1
807 1 94 TYR HB2 1 95 LEU H . . 4.200 3.998 3.864 4.113 . 0 0 "[ . 1 . 2]" 1
808 1 94 TYR HB2 1 95 LEU MD2 . . 4.630 4.451 4.227 4.637 0.007 16 0 "[ . 1 . 2]" 1
809 1 94 TYR HB3 1 94 TYR QE . . 4.870 4.394 4.385 4.417 . 0 0 "[ . 1 . 2]" 1
810 1 94 TYR HB3 1 95 LEU H . . 3.690 2.727 2.537 2.899 . 0 0 "[ . 1 . 2]" 1
811 1 94 TYR HB3 1 95 LEU MD2 . . 3.590 2.886 2.630 3.131 . 0 0 "[ . 1 . 2]" 1
812 1 94 TYR QD 1 95 LEU H . . 4.250 3.661 3.212 3.960 . 0 0 "[ . 1 . 2]" 1
813 1 94 TYR QD 1 95 LEU MD2 . . 4.240 2.474 2.037 2.780 . 0 0 "[ . 1 . 2]" 1
814 1 94 TYR QD 1 95 LEU HG . . 5.190 4.576 4.096 4.766 . 0 0 "[ . 1 . 2]" 1
815 1 94 TYR QD 1 98 THR HB . . 5.340 3.440 2.994 4.453 . 0 0 "[ . 1 . 2]" 1
816 1 94 TYR QD 1 98 THR MG . . 5.190 3.576 3.013 4.955 . 0 0 "[ . 1 . 2]" 1
817 1 94 TYR QE 1 95 LEU MD2 . . 4.100 4.011 3.610 4.109 0.009 6 0 "[ . 1 . 2]" 1
818 1 94 TYR QE 1 98 THR HB . . 4.460 2.918 2.581 3.746 . 0 0 "[ . 1 . 2]" 1
819 1 95 LEU H 1 95 LEU HB2 . . 3.080 2.752 2.740 2.766 . 0 0 "[ . 1 . 2]" 1
820 1 95 LEU H 1 95 LEU HB3 . . 3.660 3.564 3.562 3.566 . 0 0 "[ . 1 . 2]" 1
821 1 95 LEU H 1 95 LEU MD2 . . 3.540 2.350 2.198 2.477 . 0 0 "[ . 1 . 2]" 1
822 1 95 LEU H 1 95 LEU HG . . 4.240 2.046 1.995 2.097 . 0 0 "[ . 1 . 2]" 1
823 1 95 LEU H 1 96 MET H . . 3.540 2.744 2.693 2.773 . 0 0 "[ . 1 . 2]" 1
824 1 95 LEU H 1 98 THR H . . 5.300 4.881 4.839 5.297 . 0 0 "[ . 1 . 2]" 1
825 1 95 LEU HA 1 95 LEU HG . . 4.160 3.484 3.435 3.530 . 0 0 "[ . 1 . 2]" 1
826 1 95 LEU HA 1 98 THR H . . 3.900 3.681 3.292 3.717 . 0 0 "[ . 1 . 2]" 1
827 1 95 LEU HA 1 98 THR HA . . 5.500 5.453 5.435 5.504 0.004 20 0 "[ . 1 . 2]" 1
828 1 95 LEU HA 1 98 THR HB . . 3.460 3.471 3.195 3.489 0.029 4 0 "[ . 1 . 2]" 1
829 1 95 LEU HA 1 98 THR MG . . 3.930 1.949 1.881 2.979 . 0 0 "[ . 1 . 2]" 1
830 1 95 LEU HA 1 99 MET ME . . 5.140 4.776 4.647 4.893 . 0 0 "[ . 1 . 2]" 1
831 1 95 LEU HB2 1 96 MET H . . 3.470 2.858 2.781 2.868 . 0 0 "[ . 1 . 2]" 1
832 1 95 LEU HB2 1 96 MET QB . . 5.250 4.362 4.116 4.825 . 0 0 "[ . 1 . 2]" 1
833 1 95 LEU HB2 1 98 THR MG . . 4.430 4.246 4.219 4.434 0.004 20 0 "[ . 1 . 2]" 1
834 1 95 LEU HB3 1 96 MET H . . 4.120 4.014 3.957 4.029 . 0 0 "[ . 1 . 2]" 1
835 1 95 LEU HB3 1 98 THR MG . . 4.670 3.414 3.281 3.478 . 0 0 "[ . 1 . 2]" 1
836 1 95 LEU HB3 1 99 MET H . . 5.500 5.193 5.076 5.315 . 0 0 "[ . 1 . 2]" 1
837 1 95 LEU MD2 1 96 MET H . . 4.550 4.363 4.295 4.441 . 0 0 "[ . 1 . 2]" 1
838 1 95 LEU MD2 1 98 THR MG . . 3.690 2.829 2.734 3.482 . 0 0 "[ . 1 . 2]" 1
839 1 96 MET H 1 96 MET QB . . 3.160 2.145 2.052 2.491 . 0 0 "[ . 1 . 2]" 1
840 1 96 MET H 1 96 MET HG2 . . 4.580 3.562 2.288 4.527 . 0 0 "[ . 1 . 2]" 1
841 1 96 MET H 1 96 MET QG . . 3.840 3.276 2.251 3.830 . 0 0 "[ . 1 . 2]" 1
842 1 96 MET H 1 96 MET HG3 . . 4.580 3.968 2.966 4.467 . 0 0 "[ . 1 . 2]" 1
843 1 96 MET H 1 97 PHE H . . 3.390 2.614 2.563 2.731 . 0 0 "[ . 1 . 2]" 1
844 1 96 MET H 1 97 PHE HB2 . . 5.270 4.982 4.806 5.141 . 0 0 "[ . 1 . 2]" 1
845 1 96 MET H 1 97 PHE HB3 . . 5.500 4.953 4.792 5.298 . 0 0 "[ . 1 . 2]" 1
846 1 96 MET HA 1 96 MET QG . . 3.700 2.293 2.000 2.821 . 0 0 "[ . 1 . 2]" 1
847 1 96 MET HA 1 99 MET QB . . 3.970 2.923 2.820 2.954 . 0 0 "[ . 1 . 2]" 1
848 1 96 MET HA 1 99 MET HG2 . . 4.390 4.344 3.543 4.395 0.005 7 0 "[ . 1 . 2]" 1
849 1 96 MET HA 1 99 MET HG3 . . 4.390 3.536 3.118 3.577 . 0 0 "[ . 1 . 2]" 1
850 1 96 MET QB 1 96 MET ME . . 4.380 3.267 2.515 3.716 . 0 0 "[ . 1 . 2]" 1
851 1 96 MET QB 1 97 PHE H . . 4.020 2.628 2.515 2.877 . 0 0 "[ . 1 . 2]" 1
852 1 96 MET QB 1 97 PHE HA . . 4.440 3.839 3.783 3.920 . 0 0 "[ . 1 . 2]" 1
853 1 96 MET QB 1 97 PHE HB2 . . 4.510 3.939 3.803 4.127 . 0 0 "[ . 1 . 2]" 1
854 1 96 MET QB 1 97 PHE HB3 . . 5.190 4.733 4.528 5.155 . 0 0 "[ . 1 . 2]" 1
855 1 96 MET QG 1 97 PHE H . . 4.470 4.354 3.929 4.466 . 0 0 "[ . 1 . 2]" 1
856 1 97 PHE H 1 97 PHE HB2 . . 3.220 2.530 2.368 2.672 . 0 0 "[ . 1 . 2]" 1
857 1 97 PHE H 1 97 PHE HB3 . . 3.320 2.585 2.445 2.746 . 0 0 "[ . 1 . 2]" 1
858 1 97 PHE H 1 97 PHE QD . . 5.030 4.187 4.155 4.200 . 0 0 "[ . 1 . 2]" 1
859 1 97 PHE H 1 98 THR H . . 3.500 2.608 2.597 2.667 . 0 0 "[ . 1 . 2]" 1
860 1 97 PHE H 1 100 VAL MG1 . . 4.390 4.190 4.126 4.204 . 0 0 "[ . 1 . 2]" 1
861 1 97 PHE HA 1 97 PHE QD . . 3.880 2.967 2.856 3.100 . 0 0 "[ . 1 . 2]" 1
862 1 97 PHE HA 1 100 VAL H . . 3.690 3.415 3.409 3.426 . 0 0 "[ . 1 . 2]" 1
863 1 97 PHE HA 1 100 VAL HB . . 4.870 4.880 4.870 4.888 0.018 5 0 "[ . 1 . 2]" 1
864 1 97 PHE HA 1 100 VAL MG1 . . 3.390 2.000 1.991 2.034 . 0 0 "[ . 1 . 2]" 1
865 1 97 PHE HA 1 100 VAL MG2 . . 3.850 3.144 3.098 3.153 . 0 0 "[ . 1 . 2]" 1
866 1 97 PHE HA 1 101 LEU H . . 4.650 4.748 4.717 4.754 0.104 9 0 "[ . 1 . 2]" 1
867 1 97 PHE HB2 1 98 THR H . . 3.960 3.681 3.520 3.794 . 0 0 "[ . 1 . 2]" 1
868 1 97 PHE HB2 1 100 VAL MG1 . . 4.600 4.251 4.169 4.358 . 0 0 "[ . 1 . 2]" 1
869 1 97 PHE HB3 1 97 PHE QE . . 4.850 4.412 4.395 4.452 . 0 0 "[ . 1 . 2]" 1
870 1 97 PHE HB3 1 98 THR H . . 3.600 2.348 2.272 2.395 . 0 0 "[ . 1 . 2]" 1
871 1 97 PHE HB3 1 99 MET H . . 5.500 4.707 4.624 4.746 . 0 0 "[ . 1 . 2]" 1
872 1 97 PHE QD 1 98 THR H . . 4.160 3.289 2.963 3.544 . 0 0 "[ . 1 . 2]" 1
873 1 97 PHE QD 1 100 VAL MG2 . . 3.860 3.433 3.021 3.536 . 0 0 "[ . 1 . 2]" 1
874 1 97 PHE QD 1 101 LEU HB3 . . 4.450 3.651 3.143 3.969 . 0 0 "[ . 1 . 2]" 1
875 1 97 PHE QD 1 101 LEU MD2 . . 3.270 3.160 2.982 3.254 . 0 0 "[ . 1 . 2]" 1
876 1 98 THR H 1 98 THR HB . . 3.330 2.281 2.183 2.289 . 0 0 "[ . 1 . 2]" 1
877 1 98 THR H 1 98 THR MG . . 3.900 2.597 2.576 2.862 . 0 0 "[ . 1 . 2]" 1
878 1 98 THR H 1 100 VAL H . . 4.390 4.243 4.240 4.247 . 0 0 "[ . 1 . 2]" 1
879 1 98 THR H 1 100 VAL MG1 . . 4.500 4.403 4.399 4.410 . 0 0 "[ . 1 . 2]" 1
880 1 98 THR H 1 101 LEU H . . 5.040 4.919 4.916 4.924 . 0 0 "[ . 1 . 2]" 1
881 1 98 THR H 1 101 LEU HB3 . . 5.500 5.182 5.163 5.188 . 0 0 "[ . 1 . 2]" 1
882 1 98 THR H 1 101 LEU MD2 . . 4.230 4.128 4.124 4.145 . 0 0 "[ . 1 . 2]" 1
883 1 98 THR HA 1 98 THR MG . . 3.270 3.175 3.130 3.178 . 0 0 "[ . 1 . 2]" 1
884 1 98 THR HA 1 100 VAL MG2 . . 4.510 4.119 4.113 4.147 . 0 0 "[ . 1 . 2]" 1
885 1 98 THR HA 1 101 LEU H . . 3.980 3.226 3.223 3.250 . 0 0 "[ . 1 . 2]" 1
886 1 98 THR HA 1 101 LEU HB3 . . 4.250 2.876 2.865 2.880 . 0 0 "[ . 1 . 2]" 1
887 1 98 THR HA 1 101 LEU MD1 . . 4.420 4.258 4.250 4.301 . 0 0 "[ . 1 . 2]" 1
888 1 98 THR HA 1 101 LEU MD2 . . 3.870 1.896 1.895 1.901 . 0 0 "[ . 1 . 2]" 1
889 1 98 THR HA 1 102 VAL H . . 4.540 4.232 4.215 4.268 . 0 0 "[ . 1 . 2]" 1
890 1 98 THR HB 1 99 MET H . . 3.740 3.834 3.715 3.845 0.105 15 0 "[ . 1 . 2]" 1
891 1 98 THR MG 1 99 MET H . . 4.010 2.195 2.193 2.205 . 0 0 "[ . 1 . 2]" 1
892 1 98 THR MG 1 99 MET QB . . 4.180 3.486 3.473 3.607 . 0 0 "[ . 1 . 2]" 1
893 1 98 THR MG 1 99 MET ME . . 3.780 2.941 2.218 3.102 . 0 0 "[ . 1 . 2]" 1
894 1 98 THR MG 1 101 LEU HB3 . . 5.380 5.319 5.204 5.328 . 0 0 "[ . 1 . 2]" 1
895 1 98 THR MG 1 101 LEU MD2 . . 3.890 3.682 3.515 3.696 . 0 0 "[ . 1 . 2]" 1
896 1 98 THR MG 1 101 LEU HG . . 4.370 4.412 4.260 4.427 0.057 15 0 "[ . 1 . 2]" 1
897 1 98 THR MG 1 102 VAL H . . 4.640 4.642 4.499 4.655 0.015 11 0 "[ . 1 . 2]" 1
898 1 98 THR MG 1 102 VAL MG1 . . 4.240 3.286 2.983 3.335 . 0 0 "[ . 1 . 2]" 1
899 1 98 THR MG 1 102 VAL MG2 . . 3.860 3.532 3.432 3.550 . 0 0 "[ . 1 . 2]" 1
900 1 99 MET H 1 99 MET HB2 . . 3.710 2.194 2.181 2.336 . 0 0 "[ . 1 . 2]" 1
901 1 99 MET H 1 99 MET QB . . 3.130 2.172 2.160 2.307 . 0 0 "[ . 1 . 2]" 1
902 1 99 MET H 1 99 MET HB3 . . 3.710 3.497 3.490 3.566 . 0 0 "[ . 1 . 2]" 1
903 1 99 MET H 1 99 MET HG2 . . 3.790 2.927 2.526 2.960 . 0 0 "[ . 1 . 2]" 1
904 1 99 MET H 1 99 MET HG3 . . 3.790 3.778 3.693 3.799 0.009 10 0 "[ . 1 . 2]" 1
905 1 99 MET H 1 100 VAL H . . 3.310 2.571 2.545 2.575 . 0 0 "[ . 1 . 2]" 1
906 1 99 MET H 1 100 VAL MG1 . . 4.200 3.552 3.513 3.558 . 0 0 "[ . 1 . 2]" 1
907 1 99 MET H 1 101 LEU H . . 4.250 4.024 4.003 4.026 . 0 0 "[ . 1 . 2]" 1
908 1 99 MET HA 1 99 MET ME . . 3.790 2.492 2.068 2.720 . 0 0 "[ . 1 . 2]" 1
909 1 99 MET HA 1 99 MET QG . . 3.730 2.477 2.438 2.734 . 0 0 "[ . 1 . 2]" 1
910 1 99 MET HA 1 101 LEU H . . 4.500 4.254 4.246 4.258 . 0 0 "[ . 1 . 2]" 1
911 1 99 MET HA 1 102 VAL H . . 3.900 3.575 3.571 3.578 . 0 0 "[ . 1 . 2]" 1
912 1 99 MET HA 1 102 VAL MG1 . . 3.780 3.438 3.283 3.499 . 0 0 "[ . 1 . 2]" 1
913 1 99 MET HA 1 102 VAL MG2 . . 3.070 1.976 1.968 1.983 . 0 0 "[ . 1 . 2]" 1
914 1 99 MET QB 1 99 MET ME . . 4.030 3.489 3.306 3.561 . 0 0 "[ . 1 . 2]" 1
915 1 99 MET QB 1 100 VAL H . . 3.900 2.870 2.827 2.876 . 0 0 "[ . 1 . 2]" 1
916 1 99 MET QB 1 100 VAL MG1 . . 3.890 3.053 3.016 3.058 . 0 0 "[ . 1 . 2]" 1
917 1 99 MET ME 1 102 VAL MG1 . . 3.520 3.346 3.113 3.511 . 0 0 "[ . 1 . 2]" 1
918 1 99 MET ME 1 102 VAL MG2 . . 4.120 2.364 2.008 2.883 . 0 0 "[ . 1 . 2]" 1
919 1 99 MET QG 1 100 VAL MG1 . . 4.710 4.686 4.539 4.698 . 0 0 "[ . 1 . 2]" 1
920 1 99 MET QG 1 102 VAL MG1 . . 5.130 4.753 4.669 4.949 . 0 0 "[ . 1 . 2]" 1
921 1 99 MET QG 1 102 VAL MG2 . . 4.390 3.720 3.694 4.012 . 0 0 "[ . 1 . 2]" 1
922 1 100 VAL H 1 100 VAL HB . . 3.810 3.589 3.589 3.591 . 0 0 "[ . 1 . 2]" 1
923 1 100 VAL H 1 100 VAL MG1 . . 2.960 1.955 1.931 1.958 . 0 0 "[ . 1 . 2]" 1
924 1 100 VAL H 1 100 VAL MG2 . . 3.540 2.661 2.655 2.663 . 0 0 "[ . 1 . 2]" 1
925 1 100 VAL H 1 101 LEU H . . 3.410 2.399 2.396 2.401 . 0 0 "[ . 1 . 2]" 1
926 1 100 VAL H 1 101 LEU HB3 . . 4.260 4.327 4.306 4.331 0.071 9 0 "[ . 1 . 2]" 1
927 1 100 VAL HA 1 100 VAL MG1 . . 3.090 2.613 2.612 2.615 . 0 0 "[ . 1 . 2]" 1
928 1 100 VAL HA 1 100 VAL MG2 . . 3.460 3.126 3.125 3.126 . 0 0 "[ . 1 . 2]" 1
929 1 100 VAL HA 1 103 THR H . . 4.380 3.490 3.476 3.511 . 0 0 "[ . 1 . 2]" 1
930 1 100 VAL HA 1 103 THR HB . . 4.210 2.894 2.801 3.663 . 0 0 "[ . 1 . 2]" 1
931 1 100 VAL HA 1 103 THR MG . . 4.320 3.982 2.017 4.220 . 0 0 "[ . 1 . 2]" 1
932 1 100 VAL HA 1 104 PHE H . . 4.050 3.821 3.728 3.905 . 0 0 "[ . 1 . 2]" 1
933 1 100 VAL HA 1 104 PHE HB2 . . 4.940 4.669 4.634 4.756 . 0 0 "[ . 1 . 2]" 1
934 1 100 VAL HB 1 101 LEU H . . 4.340 4.169 4.167 4.172 . 0 0 "[ . 1 . 2]" 1
935 1 100 VAL HB 1 104 PHE HB2 . . 5.020 4.686 4.655 4.803 . 0 0 "[ . 1 . 2]" 1
936 1 100 VAL MG1 1 101 LEU H . . 3.860 3.456 3.452 3.459 . 0 0 "[ . 1 . 2]" 1
937 1 100 VAL MG2 1 101 LEU H . . 3.440 2.131 2.128 2.134 . 0 0 "[ . 1 . 2]" 1
938 1 100 VAL MG2 1 101 LEU HA . . 3.740 2.962 2.960 2.965 . 0 0 "[ . 1 . 2]" 1
939 1 100 VAL MG2 1 101 LEU HB3 . . 3.860 2.895 2.890 2.912 . 0 0 "[ . 1 . 2]" 1
940 1 100 VAL MG2 1 101 LEU HG . . 4.840 4.593 4.589 4.641 . 0 0 "[ . 1 . 2]" 1
941 1 100 VAL MG2 1 104 PHE H . . 4.560 4.495 4.452 4.561 0.001 5 0 "[ . 1 . 2]" 1
942 1 100 VAL MG2 1 104 PHE HB2 . . 3.940 3.957 3.886 3.967 0.027 18 0 "[ . 1 . 2]" 1
943 1 100 VAL MG2 1 104 PHE HB3 . . 4.460 4.258 4.206 4.487 0.027 9 0 "[ . 1 . 2]" 1
944 1 101 LEU H 1 101 LEU HB2 . . 3.890 3.513 3.503 3.515 . 0 0 "[ . 1 . 2]" 1
945 1 101 LEU H 1 101 LEU HB3 . . 3.270 2.212 2.196 2.215 . 0 0 "[ . 1 . 2]" 1
946 1 101 LEU H 1 101 LEU MD1 . . 4.400 4.115 4.107 4.150 . 0 0 "[ . 1 . 2]" 1
947 1 101 LEU H 1 101 LEU MD2 . . 3.980 3.435 3.430 3.440 . 0 0 "[ . 1 . 2]" 1
948 1 101 LEU H 1 101 LEU HG . . 3.250 2.974 2.969 3.027 . 0 0 "[ . 1 . 2]" 1
949 1 101 LEU H 1 102 VAL H . . 3.580 2.469 2.466 2.471 . 0 0 "[ . 1 . 2]" 1
950 1 101 LEU H 1 102 VAL MG1 . . 4.360 4.097 4.053 4.194 . 0 0 "[ . 1 . 2]" 1
951 1 101 LEU H 1 102 VAL MG2 . . 4.180 3.542 3.535 3.546 . 0 0 "[ . 1 . 2]" 1
952 1 101 LEU HA 1 101 LEU MD1 . . 3.270 3.240 3.165 3.276 0.006 15 0 "[ . 1 . 2]" 1
953 1 101 LEU HA 1 101 LEU MD2 . . 4.290 4.124 4.123 4.124 . 0 0 "[ . 1 . 2]" 1
954 1 101 LEU HA 1 104 PHE H . . 3.730 3.677 3.620 3.758 0.028 11 0 "[ . 1 . 2]" 1
955 1 101 LEU HA 1 104 PHE HB2 . . 3.920 3.860 3.480 3.918 . 0 0 "[ . 1 . 2]" 1
956 1 101 LEU HA 1 104 PHE HB3 . . 3.740 2.857 2.809 2.867 . 0 0 "[ . 1 . 2]" 1
957 1 101 LEU HB2 1 101 LEU MD1 . . 3.210 2.071 2.041 2.170 . 0 0 "[ . 1 . 2]" 1
958 1 101 LEU HB2 1 101 LEU MD2 . . 3.440 2.639 2.637 2.647 . 0 0 "[ . 1 . 2]" 1
959 1 101 LEU HB2 1 102 VAL H . . 4.420 4.141 4.138 4.157 . 0 0 "[ . 1 . 2]" 1
960 1 101 LEU HB3 1 102 VAL H . . 3.980 3.612 3.597 3.616 . 0 0 "[ . 1 . 2]" 1
961 1 101 LEU HB3 1 104 PHE HB3 . . 5.500 5.526 5.460 5.537 0.037 4 0 "[ . 1 . 2]" 1
962 1 101 LEU MD1 1 102 VAL H . . 4.400 3.238 3.211 3.307 . 0 0 "[ . 1 . 2]" 1
963 1 101 LEU MD1 1 102 VAL MG1 . . 2.860 2.444 2.205 2.536 . 0 0 "[ . 1 . 2]" 1
964 1 101 LEU MD1 1 104 PHE HB3 . . 5.060 4.796 4.535 4.864 . 0 0 "[ . 1 . 2]" 1
965 1 101 LEU MD1 1 147 VAL HB . . 4.430 4.157 3.441 4.431 0.001 10 0 "[ . 1 . 2]" 1
966 1 101 LEU MD2 1 102 VAL H . . 4.390 3.789 3.778 3.796 . 0 0 "[ . 1 . 2]" 1
967 1 101 LEU MD2 1 102 VAL HA . . 4.830 4.710 4.688 4.716 . 0 0 "[ . 1 . 2]" 1
968 1 101 LEU HG 1 102 VAL H . . 3.710 2.188 2.180 2.213 . 0 0 "[ . 1 . 2]" 1
969 1 101 LEU HG 1 102 VAL HB . . 4.820 4.641 4.626 4.652 . 0 0 "[ . 1 . 2]" 1
970 1 101 LEU HG 1 102 VAL MG1 . . 3.420 2.018 1.980 2.332 . 0 0 "[ . 1 . 2]" 1
971 1 101 LEU HG 1 102 VAL MG2 . . 3.680 3.423 3.417 3.434 . 0 0 "[ . 1 . 2]" 1
972 1 102 VAL H 1 102 VAL HB . . 3.660 3.624 3.623 3.627 . 0 0 "[ . 1 . 2]" 1
973 1 102 VAL H 1 102 VAL MG1 . . 3.570 2.385 2.344 2.551 . 0 0 "[ . 1 . 2]" 1
974 1 102 VAL H 1 102 VAL MG2 . . 3.100 1.874 1.867 1.879 . 0 0 "[ . 1 . 2]" 1
975 1 102 VAL H 1 103 THR H . . 3.670 2.469 2.466 2.472 . 0 0 "[ . 1 . 2]" 1
976 1 102 VAL HA 1 102 VAL MG1 . . 3.410 2.360 2.211 2.380 . 0 0 "[ . 1 . 2]" 1
977 1 102 VAL HA 1 102 VAL MG2 . . 3.510 3.202 3.201 3.202 . 0 0 "[ . 1 . 2]" 1
978 1 102 VAL HA 1 105 SER H . . 4.010 3.677 3.591 3.810 . 0 0 "[ . 1 . 2]" 1
979 1 102 VAL HA 1 105 SER QB . . 4.000 3.110 2.926 3.580 . 0 0 "[ . 1 . 2]" 1
980 1 102 VAL HA 1 106 ILE H . . 5.010 4.603 4.436 5.016 0.006 9 0 "[ . 1 . 2]" 1
981 1 102 VAL HA 1 106 ILE MD . . 4.110 4.027 3.902 4.112 0.002 8 0 "[ . 1 . 2]" 1
982 1 102 VAL HB 1 103 THR H . . 3.800 3.698 3.675 3.707 . 0 0 "[ . 1 . 2]" 1
983 1 102 VAL MG1 1 103 THR H . . 3.940 3.942 3.920 3.961 0.021 6 0 "[ . 1 . 2]" 1
984 1 102 VAL MG2 1 103 THR H . . 3.410 2.061 2.036 2.069 . 0 0 "[ . 1 . 2]" 1
985 1 102 VAL MG2 1 103 THR HB . . 4.110 3.610 2.868 3.702 . 0 0 "[ . 1 . 2]" 1
986 1 103 THR H 1 103 THR HB . . 3.750 2.454 2.400 2.471 . 0 0 "[ . 1 . 2]" 1
987 1 103 THR H 1 103 THR MG . . 3.810 3.622 2.367 3.763 . 0 0 "[ . 1 . 2]" 1
988 1 103 THR H 1 104 PHE H . . 3.690 2.547 2.506 2.595 . 0 0 "[ . 1 . 2]" 1
989 1 103 THR H 1 106 ILE MD . . 4.380 4.024 3.862 4.153 . 0 0 "[ . 1 . 2]" 1
990 1 103 THR HA 1 104 PHE HA . . 4.980 4.802 4.762 4.857 . 0 0 "[ . 1 . 2]" 1
991 1 103 THR HA 1 106 ILE H . . 3.760 3.347 3.129 3.469 . 0 0 "[ . 1 . 2]" 1
992 1 103 THR HA 1 106 ILE HB . . 3.970 2.925 2.683 3.093 . 0 0 "[ . 1 . 2]" 1
993 1 103 THR HA 1 106 ILE MD . . 3.850 2.189 1.928 2.551 . 0 0 "[ . 1 . 2]" 1
994 1 103 THR HA 1 106 ILE QG . . 4.440 3.579 3.456 3.676 . 0 0 "[ . 1 . 2]" 1
995 1 103 THR HA 1 106 ILE MG . . 4.800 4.292 4.111 4.395 . 0 0 "[ . 1 . 2]" 1
996 1 103 THR HA 1 107 VAL H . . 4.240 4.030 3.787 4.251 0.011 11 0 "[ . 1 . 2]" 1
997 1 103 THR HA 1 107 VAL QG . . 5.160 4.081 3.446 4.572 . 0 0 "[ . 1 . 2]" 1
998 1 103 THR HB 1 104 PHE H . . 3.640 2.760 2.523 3.830 0.190 9 0 "[ . 1 . 2]" 1
999 1 103 THR MG 1 104 PHE H . . 3.870 3.264 2.144 3.476 . 0 0 "[ . 1 . 2]" 1
1000 1 103 THR MG 1 104 PHE HB2 . . 4.400 4.316 3.346 4.437 0.037 11 0 "[ . 1 . 2]" 1
1001 1 103 THR MG 1 104 PHE QD . . 5.090 4.873 4.445 5.081 . 0 0 "[ . 1 . 2]" 1
1002 1 103 THR MG 1 107 VAL H . . 4.190 3.789 3.520 4.224 0.034 5 0 "[ . 1 . 2]" 1
1003 1 104 PHE H 1 104 PHE HB2 . . 3.330 2.612 2.601 2.659 . 0 0 "[ . 1 . 2]" 1
1004 1 104 PHE H 1 104 PHE HB3 . . 3.570 2.456 2.407 2.470 . 0 0 "[ . 1 . 2]" 1
1005 1 104 PHE H 1 104 PHE QD . . 4.840 4.181 4.175 4.185 . 0 0 "[ . 1 . 2]" 1
1006 1 104 PHE H 1 105 SER H . . 3.630 2.638 2.552 2.765 . 0 0 "[ . 1 . 2]" 1
1007 1 104 PHE H 1 107 VAL QG . . 3.970 3.865 3.692 3.982 0.012 20 0 "[ . 1 . 2]" 1
1008 1 104 PHE HA 1 107 VAL H . . 4.300 3.696 3.619 3.763 . 0 0 "[ . 1 . 2]" 1
1009 1 104 PHE HA 1 107 VAL HB . . 4.640 4.113 3.363 4.642 0.002 5 0 "[ . 1 . 2]" 1
1010 1 104 PHE HA 1 107 VAL QG . . 3.870 1.915 1.882 1.983 . 0 0 "[ . 1 . 2]" 1
1011 1 104 PHE HB2 1 105 SER H . . 4.180 4.054 4.034 4.097 . 0 0 "[ . 1 . 2]" 1
1012 1 104 PHE HB2 1 107 VAL QG . . 4.000 3.833 3.735 4.048 0.048 6 0 "[ . 1 . 2]" 1
1013 1 104 PHE HB3 1 105 SER H . . 4.140 2.845 2.803 2.881 . 0 0 "[ . 1 . 2]" 1
1014 1 104 PHE HB3 1 107 VAL QG . . 4.820 4.251 4.155 4.513 . 0 0 "[ . 1 . 2]" 1
1015 1 104 PHE QD 1 105 SER H . . 5.310 4.040 3.698 4.211 . 0 0 "[ . 1 . 2]" 1
1016 1 104 PHE QD 1 107 VAL QG . . 3.800 2.669 2.284 3.597 . 0 0 "[ . 1 . 2]" 1
1017 1 105 SER H 1 105 SER HB2 . . 3.800 2.533 2.141 3.603 . 0 0 "[ . 1 . 2]" 1
1018 1 105 SER H 1 105 SER HB3 . . 3.800 2.801 2.460 3.595 . 0 0 "[ . 1 . 2]" 1
1019 1 105 SER H 1 106 ILE H . . 3.550 2.515 2.466 2.617 . 0 0 "[ . 1 . 2]" 1
1020 1 105 SER H 1 107 VAL QG . . 3.960 3.867 3.738 4.024 0.064 11 0 "[ . 1 . 2]" 1
1021 1 105 SER HA 1 107 VAL H . . 5.060 4.736 4.159 4.863 . 0 0 "[ . 1 . 2]" 1
1022 1 105 SER HA 1 108 THR H . . 4.060 3.749 3.635 3.804 . 0 0 "[ . 1 . 2]" 1
1023 1 105 SER QB 1 106 ILE H . . 4.020 2.763 2.339 3.282 . 0 0 "[ . 1 . 2]" 1
1024 1 105 SER QB 1 106 ILE HA . . 4.380 4.036 3.766 4.409 0.029 18 0 "[ . 1 . 2]" 1
1025 1 106 ILE H 1 106 ILE HB . . 3.200 2.514 2.498 2.578 . 0 0 "[ . 1 . 2]" 1
1026 1 106 ILE H 1 106 ILE MD . . 3.510 3.206 2.970 3.346 . 0 0 "[ . 1 . 2]" 1
1027 1 106 ILE H 1 106 ILE HG12 . . 4.050 3.707 3.624 3.821 . 0 0 "[ . 1 . 2]" 1
1028 1 106 ILE H 1 106 ILE QG . . 3.370 2.218 2.085 2.337 . 0 0 "[ . 1 . 2]" 1
1029 1 106 ILE H 1 106 ILE HG13 . . 4.050 2.236 2.098 2.358 . 0 0 "[ . 1 . 2]" 1
1030 1 106 ILE H 1 106 ILE MG . . 3.830 3.767 3.765 3.769 . 0 0 "[ . 1 . 2]" 1
1031 1 106 ILE H 1 107 VAL H . . 3.530 2.643 2.590 2.747 . 0 0 "[ . 1 . 2]" 1
1032 1 106 ILE H 1 107 VAL QG . . 4.380 3.521 3.347 3.930 . 0 0 "[ . 1 . 2]" 1
1033 1 106 ILE HA 1 106 ILE MD . . 3.950 3.876 3.856 3.884 . 0 0 "[ . 1 . 2]" 1
1034 1 106 ILE HA 1 106 ILE HG12 . . 3.900 2.809 2.733 2.931 . 0 0 "[ . 1 . 2]" 1
1035 1 106 ILE HA 1 106 ILE QG . . 3.030 2.446 2.427 2.455 . 0 0 "[ . 1 . 2]" 1
1036 1 106 ILE HA 1 106 ILE HG13 . . 3.900 2.700 2.590 2.778 . 0 0 "[ . 1 . 2]" 1
1037 1 106 ILE HA 1 106 ILE MG . . 3.450 2.364 2.308 2.398 . 0 0 "[ . 1 . 2]" 1
1038 1 106 ILE HB 1 107 VAL H . . 3.190 2.441 2.362 2.773 . 0 0 "[ . 1 . 2]" 1
1039 1 106 ILE MD 1 107 VAL H . . 4.250 4.125 3.980 4.279 0.029 6 0 "[ . 1 . 2]" 1
1040 1 106 ILE QG 1 106 ILE MG . . 2.840 2.175 2.063 2.238 . 0 0 "[ . 1 . 2]" 1
1041 1 106 ILE MG 1 107 VAL H . . 3.740 3.287 3.201 3.608 . 0 0 "[ . 1 . 2]" 1
1042 1 107 VAL H 1 107 VAL HB . . 3.600 2.951 2.533 3.615 0.015 5 0 "[ . 1 . 2]" 1
1043 1 107 VAL H 1 107 VAL MG1 . . 3.970 2.275 1.966 3.756 . 0 0 "[ . 1 . 2]" 1
1044 1 107 VAL H 1 107 VAL QG . . 2.950 1.955 1.836 2.090 . 0 0 "[ . 1 . 2]" 1
1045 1 107 VAL H 1 107 VAL MG2 . . 3.970 2.934 2.072 3.765 . 0 0 "[ . 1 . 2]" 1
1046 1 107 VAL H 1 108 THR H . . 3.710 2.766 2.731 2.830 . 0 0 "[ . 1 . 2]" 1
1047 1 107 VAL H 1 108 THR HB . . 5.070 5.019 4.981 5.044 . 0 0 "[ . 1 . 2]" 1
1048 1 107 VAL HA 1 109 SER H . . 5.390 3.906 3.871 4.004 . 0 0 "[ . 1 . 2]" 1
1049 1 107 VAL HA 1 110 VAL H . . 4.000 3.704 3.552 3.748 . 0 0 "[ . 1 . 2]" 1
1050 1 107 VAL HA 1 110 VAL HB . . 4.110 3.899 3.718 3.923 . 0 0 "[ . 1 . 2]" 1
1051 1 107 VAL HA 1 110 VAL QG . . 3.930 3.912 3.374 3.953 0.023 2 0 "[ . 1 . 2]" 1
1052 1 107 VAL HB 1 108 THR H . . 4.180 3.707 2.484 4.023 . 0 0 "[ . 1 . 2]" 1
1053 1 107 VAL QG 1 108 THR H . . 3.170 2.287 2.093 3.204 0.034 18 0 "[ . 1 . 2]" 1
1054 1 107 VAL QG 1 109 SER H . . 4.440 4.087 3.966 4.405 . 0 0 "[ . 1 . 2]" 1
1055 1 107 VAL MG1 1 108 THR H . . 3.900 2.964 2.107 3.925 0.025 15 0 "[ . 1 . 2]" 1
1056 1 107 VAL MG2 1 108 THR H . . 3.900 3.112 2.129 3.687 . 0 0 "[ . 1 . 2]" 1
1057 1 108 THR H 1 108 THR HB . . 3.790 2.588 2.576 2.613 . 0 0 "[ . 1 . 2]" 1
1058 1 108 THR H 1 108 THR MG . . 3.910 3.767 3.767 3.768 . 0 0 "[ . 1 . 2]" 1
1059 1 108 THR H 1 109 SER H . . 3.450 2.770 2.768 2.773 . 0 0 "[ . 1 . 2]" 1
1060 1 108 THR HA 1 108 THR MG . . 3.220 2.345 2.312 2.408 . 0 0 "[ . 1 . 2]" 1
1061 1 108 THR HA 1 111 CYS H . . 4.700 3.603 3.389 3.620 . 0 0 "[ . 1 . 2]" 1
1062 1 108 THR HA 1 111 CYS QB . . 3.940 3.908 3.310 3.948 0.008 7 0 "[ . 1 . 2]" 1
1063 1 108 THR HB 1 109 SER H . . 4.680 2.829 2.767 2.836 . 0 0 "[ . 1 . 2]" 1
1064 1 108 THR MG 1 109 SER H . . 3.730 3.636 3.577 3.666 . 0 0 "[ . 1 . 2]" 1
1065 1 108 THR MG 1 111 CYS QB . . 3.720 2.830 2.731 2.983 . 0 0 "[ . 1 . 2]" 1
1066 1 108 THR MG 1 111 CYS HB3 . . 4.360 4.141 4.075 4.256 . 0 0 "[ . 1 . 2]" 1
1067 1 109 SER H 1 109 SER QB . . 3.340 2.381 2.114 2.672 . 0 0 "[ . 1 . 2]" 1
1068 1 109 SER H 1 110 VAL H . . 3.470 2.787 2.782 2.870 . 0 0 "[ . 1 . 2]" 1
1069 1 109 SER H 1 110 VAL HB . . 5.200 4.971 4.843 4.982 . 0 0 "[ . 1 . 2]" 1
1070 1 109 SER HA 1 112 VAL H . . 3.850 3.266 3.244 3.363 . 0 0 "[ . 1 . 2]" 1
1071 1 109 SER HA 1 112 VAL HB . . 3.910 3.244 3.160 3.342 . 0 0 "[ . 1 . 2]" 1
1072 1 109 SER HA 1 113 LEU QD . . 4.070 4.069 4.060 4.073 0.003 6 0 "[ . 1 . 2]" 1
1073 1 109 SER QB 1 110 VAL H . . 3.970 2.911 2.421 3.516 . 0 0 "[ . 1 . 2]" 1
1074 1 109 SER QB 1 113 LEU HB2 . . 5.340 4.547 4.327 5.073 . 0 0 "[ . 1 . 2]" 1
1075 1 110 VAL H 1 110 VAL HB . . 3.150 2.389 2.374 2.392 . 0 0 "[ . 1 . 2]" 1
1076 1 110 VAL H 1 110 VAL MG1 . . 4.120 2.451 2.345 3.726 . 0 0 "[ . 1 . 2]" 1
1077 1 110 VAL H 1 110 VAL QG . . 3.140 2.357 2.322 2.365 . 0 0 "[ . 1 . 2]" 1
1078 1 110 VAL H 1 110 VAL MG2 . . 4.120 3.665 2.366 3.734 . 0 0 "[ . 1 . 2]" 1
1079 1 110 VAL H 1 111 CYS H . . 3.340 2.767 2.766 2.768 . 0 0 "[ . 1 . 2]" 1
1080 1 110 VAL H 1 112 VAL H . . 4.800 4.454 4.336 4.515 . 0 0 "[ . 1 . 2]" 1
1081 1 110 VAL H 1 113 LEU HB2 . . 4.700 4.704 4.697 4.708 0.008 19 0 "[ . 1 . 2]" 1
1082 1 110 VAL H 1 113 LEU QD . . 5.090 3.872 3.768 3.982 . 0 0 "[ . 1 . 2]" 1
1083 1 110 VAL H 1 113 LEU HG . . 5.000 5.000 4.995 5.002 0.002 19 0 "[ . 1 . 2]" 1
1084 1 110 VAL HA 1 110 VAL QG . . 2.920 2.193 2.122 2.226 . 0 0 "[ . 1 . 2]" 1
1085 1 110 VAL HA 1 113 LEU H . . 4.100 3.428 3.345 3.504 . 0 0 "[ . 1 . 2]" 1
1086 1 110 VAL HA 1 113 LEU HB2 . . 4.030 2.392 2.320 2.436 . 0 0 "[ . 1 . 2]" 1
1087 1 110 VAL HA 1 113 LEU HB3 . . 4.060 4.004 3.945 4.026 . 0 0 "[ . 1 . 2]" 1
1088 1 110 VAL HA 1 113 LEU QD . . 4.140 2.898 2.774 2.997 . 0 0 "[ . 1 . 2]" 1
1089 1 110 VAL HA 1 114 ASN H . . 3.720 3.647 3.185 3.720 0.000 20 0 "[ . 1 . 2]" 1
1090 1 110 VAL HB 1 111 CYS H . . 3.990 3.856 2.877 3.909 . 0 0 "[ . 1 . 2]" 1
1091 1 110 VAL QG 1 113 LEU HB2 . . 4.450 3.543 3.421 3.611 . 0 0 "[ . 1 . 2]" 1
1092 1 110 VAL QG 1 113 LEU HB3 . . 5.040 4.596 4.490 4.652 . 0 0 "[ . 1 . 2]" 1
1093 1 110 VAL QG 1 114 ASN HA . . 4.210 4.197 4.132 4.216 0.006 18 0 "[ . 1 . 2]" 1
1094 1 110 VAL MG1 1 111 CYS H . . 3.910 2.013 1.932 3.264 . 0 0 "[ . 1 . 2]" 1
1095 1 110 VAL MG1 1 114 ASN HB2 . . 4.270 4.148 2.321 4.263 . 0 0 "[ . 1 . 2]" 1
1096 1 110 VAL MG2 1 111 CYS H . . 3.910 3.879 3.863 4.089 0.179 19 0 "[ . 1 . 2]" 1
1097 1 110 VAL MG2 1 114 ASN HB2 . . 4.270 3.077 2.871 4.463 0.193 19 0 "[ . 1 . 2]" 1
1098 1 111 CYS H 1 111 CYS HB2 . . 3.570 2.306 2.255 2.634 . 0 0 "[ . 1 . 2]" 1
1099 1 111 CYS H 1 111 CYS QB . . 3.090 2.278 2.230 2.571 . 0 0 "[ . 1 . 2]" 1
1100 1 111 CYS H 1 111 CYS HB3 . . 3.570 3.551 3.533 3.589 0.019 19 0 "[ . 1 . 2]" 1
1101 1 111 CYS H 1 112 VAL H . . 3.500 2.670 2.635 2.694 . 0 0 "[ . 1 . 2]" 1
1102 1 111 CYS HA 1 112 VAL HA . . 5.030 4.717 4.693 4.735 . 0 0 "[ . 1 . 2]" 1
1103 1 111 CYS HA 1 114 ASN HB2 . . 3.850 3.513 3.382 3.933 0.083 19 0 "[ . 1 . 2]" 1
1104 1 111 CYS HA 1 114 ASN HB3 . . 4.140 3.112 3.016 3.298 . 0 0 "[ . 1 . 2]" 1
1105 1 111 CYS QB 1 112 VAL QG . . 3.850 3.013 2.921 3.080 . 0 0 "[ . 1 . 2]" 1
1106 1 111 CYS HB2 1 112 VAL H . . 3.950 2.623 2.547 2.703 . 0 0 "[ . 1 . 2]" 1
1107 1 111 CYS HB2 1 133 ALA MB . . 4.590 4.571 4.202 4.595 0.005 7 0 "[ . 1 . 2]" 1
1108 1 111 CYS HB3 1 112 VAL H . . 3.950 3.369 3.281 3.812 . 0 0 "[ . 1 . 2]" 1
1109 1 112 VAL H 1 112 VAL HB . . 3.180 2.523 2.505 2.603 . 0 0 "[ . 1 . 2]" 1
1110 1 112 VAL H 1 112 VAL MG1 . . 3.830 3.771 3.767 3.780 . 0 0 "[ . 1 . 2]" 1
1111 1 112 VAL H 1 112 VAL QG . . 2.920 2.231 2.020 2.409 . 0 0 "[ . 1 . 2]" 1
1112 1 112 VAL H 1 112 VAL MG2 . . 3.830 2.248 2.028 2.437 . 0 0 "[ . 1 . 2]" 1
1113 1 112 VAL H 1 113 LEU HB2 . . 4.840 4.601 4.510 4.653 . 0 0 "[ . 1 . 2]" 1
1114 1 112 VAL HA 1 112 VAL MG1 . . 3.070 2.338 2.266 2.398 . 0 0 "[ . 1 . 2]" 1
1115 1 112 VAL HA 1 112 VAL MG2 . . 3.070 2.343 2.289 2.448 . 0 0 "[ . 1 . 2]" 1
1116 1 112 VAL HA 1 113 LEU HA . . 4.950 4.745 4.739 4.759 . 0 0 "[ . 1 . 2]" 1
1117 1 112 VAL HA 1 115 VAL H . . 3.950 3.717 3.622 3.783 . 0 0 "[ . 1 . 2]" 1
1118 1 112 VAL HA 1 115 VAL HB . . 5.120 4.604 4.450 4.730 . 0 0 "[ . 1 . 2]" 1
1119 1 112 VAL HA 1 115 VAL MG1 . . 3.580 2.377 2.122 2.537 . 0 0 "[ . 1 . 2]" 1
1120 1 112 VAL HA 1 116 HIS H . . 4.530 4.225 4.189 4.289 . 0 0 "[ . 1 . 2]" 1
1121 1 112 VAL HB 1 113 LEU H . . 3.330 2.742 2.670 2.769 . 0 0 "[ . 1 . 2]" 1
1122 1 112 VAL QG 1 113 LEU H . . 3.640 3.301 3.270 3.332 . 0 0 "[ . 1 . 2]" 1
1123 1 112 VAL QG 1 116 HIS QB . . 3.530 2.696 2.485 3.069 . 0 0 "[ . 1 . 2]" 1
1124 1 112 VAL QG 1 116 HIS HD2 . . 4.150 3.849 3.125 4.150 0.000 1 0 "[ . 1 . 2]" 1
1125 1 113 LEU H 1 113 LEU HB2 . . 3.300 2.371 2.359 2.392 . 0 0 "[ . 1 . 2]" 1
1126 1 113 LEU H 1 113 LEU HB3 . . 3.800 3.576 3.573 3.579 . 0 0 "[ . 1 . 2]" 1
1127 1 113 LEU H 1 113 LEU MD1 . . 4.000 3.619 3.569 3.672 . 0 0 "[ . 1 . 2]" 1
1128 1 113 LEU H 1 113 LEU QD . . 3.290 3.230 3.193 3.254 . 0 0 "[ . 1 . 2]" 1
1129 1 113 LEU H 1 113 LEU MD2 . . 4.000 3.633 3.562 3.685 . 0 0 "[ . 1 . 2]" 1
1130 1 113 LEU H 1 113 LEU HG . . 3.320 2.505 2.440 2.535 . 0 0 "[ . 1 . 2]" 1
1131 1 113 LEU H 1 114 ASN H . . 3.340 2.528 2.502 2.636 . 0 0 "[ . 1 . 2]" 1
1132 1 113 LEU H 1 114 ASN HB2 . . 5.290 4.822 4.743 4.949 . 0 0 "[ . 1 . 2]" 1
1133 1 113 LEU HA 1 113 LEU QD . . 2.530 2.061 1.972 2.239 . 0 0 "[ . 1 . 2]" 1
1134 1 113 LEU HA 1 113 LEU HG . . 3.670 2.968 2.936 3.012 . 0 0 "[ . 1 . 2]" 1
1135 1 113 LEU HA 1 115 VAL H . . 4.030 3.933 3.886 3.964 . 0 0 "[ . 1 . 2]" 1
1136 1 113 LEU HA 1 116 HIS H . . 3.840 2.947 2.882 3.012 . 0 0 "[ . 1 . 2]" 1
1137 1 113 LEU HA 1 116 HIS QB . . 4.090 2.065 1.908 2.816 . 0 0 "[ . 1 . 2]" 1
1138 1 113 LEU HB2 1 113 LEU QD . . 3.000 2.213 2.166 2.308 . 0 0 "[ . 1 . 2]" 1
1139 1 113 LEU HB2 1 114 ASN H . . 3.710 2.747 2.404 2.855 . 0 0 "[ . 1 . 2]" 1
1140 1 113 LEU HB3 1 114 ASN H . . 4.380 3.658 3.324 3.770 . 0 0 "[ . 1 . 2]" 1
1141 1 113 LEU QD 1 118 ARG QD . . 3.740 2.835 1.915 3.650 . 0 0 "[ . 1 . 2]" 1
1142 1 113 LEU HG 1 114 ASN H . . 4.680 4.501 4.397 4.526 . 0 0 "[ . 1 . 2]" 1
1143 1 114 ASN H 1 114 ASN HB2 . . 2.750 2.493 2.326 2.607 . 0 0 "[ . 1 . 2]" 1
1144 1 114 ASN H 1 114 ASN HB3 . . 3.040 2.572 2.455 2.762 . 0 0 "[ . 1 . 2]" 1
1145 1 114 ASN H 1 114 ASN HD21 . . 4.580 4.509 4.111 4.581 0.001 20 0 "[ . 1 . 2]" 1
1146 1 114 ASN HA 1 115 VAL HB . . 5.500 5.562 5.551 5.608 0.108 19 0 "[ . 1 . 2]" 1
1147 1 114 ASN HB2 1 115 VAL H . . 4.220 4.006 3.912 4.050 . 0 0 "[ . 1 . 2]" 1
1148 1 114 ASN HB3 1 115 VAL H . . 3.720 2.855 2.814 2.902 . 0 0 "[ . 1 . 2]" 1
1149 1 114 ASN HB3 1 115 VAL MG1 . . 4.060 4.065 4.032 4.109 0.049 19 0 "[ . 1 . 2]" 1
1150 1 115 VAL H 1 115 VAL HB . . 3.090 2.802 2.792 2.819 . 0 0 "[ . 1 . 2]" 1
1151 1 115 VAL H 1 115 VAL MG1 . . 2.990 2.069 1.958 2.081 . 0 0 "[ . 1 . 2]" 1
1152 1 115 VAL H 1 115 VAL MG2 . . 4.000 3.845 3.833 3.847 . 0 0 "[ . 1 . 2]" 1
1153 1 115 VAL H 1 116 HIS H . . 3.290 2.085 2.081 2.137 . 0 0 "[ . 1 . 2]" 1
1154 1 115 VAL H 1 116 HIS QB . . 4.810 3.899 3.867 3.961 . 0 0 "[ . 1 . 2]" 1
1155 1 115 VAL HA 1 115 VAL MG1 . . 3.220 3.200 3.199 3.201 . 0 0 "[ . 1 . 2]" 1
1156 1 115 VAL HA 1 115 VAL MG2 . . 3.420 2.310 2.217 2.325 . 0 0 "[ . 1 . 2]" 1
1157 1 115 VAL HB 1 116 HIS H . . 4.250 4.052 4.025 4.155 . 0 0 "[ . 1 . 2]" 1
1158 1 115 VAL MG1 1 116 HIS H . . 3.850 2.422 2.384 2.551 . 0 0 "[ . 1 . 2]" 1
1159 1 115 VAL MG1 1 116 HIS HA . . 3.930 3.161 3.021 3.456 . 0 0 "[ . 1 . 2]" 1
1160 1 115 VAL MG1 1 116 HIS HB2 . . 4.480 3.257 2.575 3.778 . 0 0 "[ . 1 . 2]" 1
1161 1 115 VAL MG1 1 116 HIS QB . . 3.910 3.127 2.544 3.587 . 0 0 "[ . 1 . 2]" 1
1162 1 115 VAL MG1 1 116 HIS HB3 . . 4.480 4.063 3.605 4.470 . 0 0 "[ . 1 . 2]" 1
1163 1 115 VAL MG2 1 116 HIS H . . 4.190 3.931 3.918 3.975 . 0 0 "[ . 1 . 2]" 1
1164 1 115 VAL MG2 1 116 HIS HA . . 4.280 3.940 3.879 4.016 . 0 0 "[ . 1 . 2]" 1
1165 1 115 VAL MG2 1 133 ALA HA . . 4.200 4.204 4.198 4.211 0.011 18 0 "[ . 1 . 2]" 1
1166 1 116 HIS H 1 116 HIS HB2 . . 3.530 2.641 2.432 2.899 . 0 0 "[ . 1 . 2]" 1
1167 1 116 HIS H 1 116 HIS QB . . 3.080 2.278 2.243 2.394 . 0 0 "[ . 1 . 2]" 1
1168 1 116 HIS H 1 116 HIS HB3 . . 3.530 2.518 2.391 3.012 . 0 0 "[ . 1 . 2]" 1
1169 1 118 ARG HA 1 118 ARG QD . . 4.150 3.579 2.079 4.140 . 0 0 "[ . 1 . 2]" 1
1170 1 118 ARG HA 1 118 ARG QG . . 3.650 2.414 2.055 3.081 . 0 0 "[ . 1 . 2]" 1
1171 1 119 SER H 1 120 PRO QD . . 4.730 3.861 2.338 4.370 . 0 0 "[ . 1 . 2]" 1
1172 1 120 PRO QB 1 121 THR H . . 4.080 3.141 2.051 3.911 . 0 0 "[ . 1 . 2]" 1
1173 1 121 THR H 1 121 THR HB . . 3.830 3.462 2.637 3.812 . 0 0 "[ . 1 . 2]" 1
1174 1 121 THR H 1 121 THR MG . . 3.810 3.664 3.156 3.810 . 0 0 "[ . 1 . 2]" 1
1175 1 121 THR HB 1 122 THR H . . 4.130 2.845 2.182 4.131 0.001 20 0 "[ . 1 . 2]" 1
1176 1 121 THR MG 1 122 THR H . . 5.080 3.435 2.192 4.419 . 0 0 "[ . 1 . 2]" 1
1177 1 122 THR H 1 122 THR MG . . 4.270 3.471 2.031 4.034 . 0 0 "[ . 1 . 2]" 1
1178 1 124 THR H 1 124 THR MG . . 4.010 3.566 2.041 3.999 . 0 0 "[ . 1 . 2]" 1
1179 1 124 THR MG 1 125 PRO QD . . 4.580 3.204 2.050 4.017 . 0 0 "[ . 1 . 2]" 1
1180 1 125 PRO HA 1 126 ARG H . . 3.410 2.692 2.183 3.418 0.008 3 0 "[ . 1 . 2]" 1
1181 1 125 PRO QB 1 126 ARG H . . 3.980 2.937 2.051 3.876 . 0 0 "[ . 1 . 2]" 1
1182 1 125 PRO HB2 1 126 ARG H . . 4.610 3.085 2.075 4.219 . 0 0 "[ . 1 . 2]" 1
1183 1 125 PRO HB3 1 126 ARG H . . 4.610 3.838 3.210 4.519 . 0 0 "[ . 1 . 2]" 1
1184 1 126 ARG H 1 126 ARG QB . . 3.480 2.811 2.045 3.418 . 0 0 "[ . 1 . 2]" 1
1185 1 126 ARG HA 1 126 ARG QG . . 3.900 2.442 2.007 2.993 . 0 0 "[ . 1 . 2]" 1
1186 1 130 GLY H 1 131 TYR QB . . 4.430 4.113 3.788 4.434 0.004 15 0 "[ . 1 . 2]" 1
1187 1 130 GLY QA 1 131 TYR H . . 3.100 2.700 2.429 2.873 . 0 0 "[ . 1 . 2]" 1
1188 1 131 TYR H 1 131 TYR QB . . 3.260 2.353 2.091 2.620 . 0 0 "[ . 1 . 2]" 1
1189 1 131 TYR H 1 131 TYR QD . . 4.120 3.077 1.962 4.119 . 0 0 "[ . 1 . 2]" 1
1190 1 131 TYR H 1 132 VAL H . . 3.670 2.397 2.275 2.624 . 0 0 "[ . 1 . 2]" 1
1191 1 131 TYR H 1 132 VAL MG1 . . 3.980 3.859 3.582 3.984 0.004 15 0 "[ . 1 . 2]" 1
1192 1 131 TYR H 1 132 VAL MG2 . . 3.780 3.544 3.370 3.775 . 0 0 "[ . 1 . 2]" 1
1193 1 131 TYR HA 1 132 VAL MG2 . . 4.820 4.733 4.635 4.827 0.007 15 0 "[ . 1 . 2]" 1
1194 1 131 TYR QB 1 132 VAL H . . 3.910 2.960 2.524 3.581 . 0 0 "[ . 1 . 2]" 1
1195 1 132 VAL H 1 132 VAL HB . . 3.720 3.613 3.608 3.617 . 0 0 "[ . 1 . 2]" 1
1196 1 132 VAL H 1 132 VAL MG1 . . 3.170 2.231 2.039 2.511 . 0 0 "[ . 1 . 2]" 1
1197 1 132 VAL HA 1 135 VAL H . . 5.410 3.846 3.729 3.978 . 0 0 "[ . 1 . 2]" 1
1198 1 132 VAL HB 1 133 ALA H . . 3.940 3.823 3.692 3.940 0.000 11 0 "[ . 1 . 2]" 1
1199 1 132 VAL MG2 1 133 ALA H . . 3.740 2.191 1.968 2.340 . 0 0 "[ . 1 . 2]" 1
1200 1 132 VAL MG2 1 133 ALA HA . . 3.840 3.265 3.100 3.442 . 0 0 "[ . 1 . 2]" 1
1201 1 132 VAL MG2 1 133 ALA MB . . 3.710 3.131 2.847 3.329 . 0 0 "[ . 1 . 2]" 1
1202 1 133 ALA H 1 133 ALA MB . . 3.140 2.054 2.031 2.094 . 0 0 "[ . 1 . 2]" 1
1203 1 133 ALA H 1 134 MET H . . 3.750 2.636 2.494 2.725 . 0 0 "[ . 1 . 2]" 1
1204 1 133 ALA HA 1 136 ILE HB . . 4.310 3.949 3.857 4.095 . 0 0 "[ . 1 . 2]" 1
1205 1 133 ALA MB 1 134 MET H . . 3.630 2.947 2.873 2.971 . 0 0 "[ . 1 . 2]" 1
1206 1 134 MET H 1 134 MET HB2 . . 3.810 2.596 2.075 3.569 . 0 0 "[ . 1 . 2]" 1
1207 1 134 MET H 1 134 MET QB . . 3.100 2.372 2.048 2.579 . 0 0 "[ . 1 . 2]" 1
1208 1 134 MET H 1 134 MET HB3 . . 3.810 3.340 2.342 3.591 . 0 0 "[ . 1 . 2]" 1
1209 1 134 MET H 1 134 MET HG2 . . 4.300 2.609 1.954 4.185 . 0 0 "[ . 1 . 2]" 1
1210 1 134 MET H 1 134 MET QG . . 3.690 2.459 1.944 3.656 . 0 0 "[ . 1 . 2]" 1
1211 1 134 MET H 1 134 MET HG3 . . 4.300 3.605 2.968 4.301 0.001 4 0 "[ . 1 . 2]" 1
1212 1 134 MET HA 1 137 ASP H . . 4.060 3.471 3.284 3.613 . 0 0 "[ . 1 . 2]" 1
1213 1 134 MET HA 1 137 ASP HB3 . . 4.310 2.424 2.027 3.412 . 0 0 "[ . 1 . 2]" 1
1214 1 134 MET QB 1 135 VAL H . . 4.160 2.919 2.781 3.530 . 0 0 "[ . 1 . 2]" 1
1215 1 135 VAL H 1 135 VAL QG . . 3.280 2.014 1.926 2.181 . 0 0 "[ . 1 . 2]" 1
1216 1 135 VAL H 1 136 ILE H . . 4.100 2.912 2.671 3.019 . 0 0 "[ . 1 . 2]" 1
1217 1 135 VAL HA 1 137 ASP H . . 4.690 4.654 4.375 4.691 0.001 4 0 "[ . 1 . 2]" 1
1218 1 135 VAL HA 1 138 ARG H . . 4.540 3.915 3.569 4.111 . 0 0 "[ . 1 . 2]" 1
1219 1 135 VAL HB 1 136 ILE H . . 4.210 2.295 2.062 3.943 . 0 0 "[ . 1 . 2]" 1
1220 1 135 VAL QG 1 136 ILE H . . 4.120 2.921 2.048 3.152 . 0 0 "[ . 1 . 2]" 1
1221 1 136 ILE H 1 136 ILE HB . . 3.690 2.572 2.515 2.644 . 0 0 "[ . 1 . 2]" 1
1222 1 136 ILE H 1 136 ILE MD . . 4.170 2.891 2.000 3.631 . 0 0 "[ . 1 . 2]" 1
1223 1 136 ILE H 1 136 ILE HG12 . . 4.050 3.111 2.021 3.865 . 0 0 "[ . 1 . 2]" 1
1224 1 136 ILE H 1 136 ILE HG13 . . 4.050 2.802 2.006 3.621 . 0 0 "[ . 1 . 2]" 1
1225 1 136 ILE H 1 136 ILE MG . . 4.530 3.773 3.769 3.776 . 0 0 "[ . 1 . 2]" 1
1226 1 136 ILE H 1 137 ASP H . . 3.820 2.516 2.472 2.579 . 0 0 "[ . 1 . 2]" 1
1227 1 136 ILE HA 1 136 ILE MD . . 3.850 3.176 1.998 3.853 0.003 7 0 "[ . 1 . 2]" 1
1228 1 136 ILE HA 1 138 ARG H . . 5.230 4.007 3.805 4.256 . 0 0 "[ . 1 . 2]" 1
1229 1 136 ILE HA 1 139 LEU H . . 5.500 3.744 3.201 3.928 . 0 0 "[ . 1 . 2]" 1
1230 1 136 ILE HB 1 137 ASP H . . 3.800 2.692 2.442 2.973 . 0 0 "[ . 1 . 2]" 1
1231 1 136 ILE QG 1 137 ASP H . . 5.140 4.042 3.770 4.400 . 0 0 "[ . 1 . 2]" 1
1232 1 136 ILE MG 1 137 ASP H . . 3.900 3.617 3.505 3.806 . 0 0 "[ . 1 . 2]" 1
1233 1 136 ILE MG 1 137 ASP QB . . 4.880 4.558 4.251 4.852 . 0 0 "[ . 1 . 2]" 1
1234 1 137 ASP H 1 137 ASP HB2 . . 3.730 2.384 2.170 2.773 . 0 0 "[ . 1 . 2]" 1
1235 1 137 ASP H 1 137 ASP HB3 . . 3.730 2.793 2.312 3.510 . 0 0 "[ . 1 . 2]" 1
1236 1 137 ASP H 1 138 ARG H . . 3.690 2.636 2.531 2.683 . 0 0 "[ . 1 . 2]" 1
1237 1 137 ASP HA 1 140 PHE H . . 3.690 3.286 3.122 3.687 . 0 0 "[ . 1 . 2]" 1
1238 1 137 ASP HA 1 140 PHE QB . . 3.930 3.119 2.771 3.506 . 0 0 "[ . 1 . 2]" 1
1239 1 137 ASP HA 1 141 LEU H . . 4.100 3.972 3.648 4.103 0.003 7 0 "[ . 1 . 2]" 1
1240 1 137 ASP QB 1 138 ARG H . . 3.870 2.834 2.782 2.894 . 0 0 "[ . 1 . 2]" 1
1241 1 137 ASP HB2 1 138 ARG H . . 4.440 3.792 3.038 4.167 . 0 0 "[ . 1 . 2]" 1
1242 1 137 ASP HB3 1 138 ARG H . . 4.440 2.994 2.875 3.564 . 0 0 "[ . 1 . 2]" 1
1243 1 138 ARG H 1 138 ARG QB . . 3.300 2.082 2.042 2.305 . 0 0 "[ . 1 . 2]" 1
1244 1 138 ARG H 1 138 ARG QG . . 3.780 3.278 2.541 3.878 0.098 19 0 "[ . 1 . 2]" 1
1245 1 138 ARG H 1 139 LEU H . . 3.510 2.720 2.389 2.762 . 0 0 "[ . 1 . 2]" 1
1246 1 138 ARG HA 1 138 ARG QD . . 4.410 3.310 2.035 3.986 . 0 0 "[ . 1 . 2]" 1
1247 1 138 ARG HA 1 138 ARG QG . . 3.620 2.237 2.004 3.429 . 0 0 "[ . 1 . 2]" 1
1248 1 138 ARG QB 1 139 LEU H . . 3.910 2.963 2.889 3.537 . 0 0 "[ . 1 . 2]" 1
1249 1 138 ARG QG 1 139 LEU H . . 4.780 4.397 2.075 4.677 . 0 0 "[ . 1 . 2]" 1
1250 1 139 LEU H 1 139 LEU QB . . 3.270 2.170 2.044 2.274 . 0 0 "[ . 1 . 2]" 1
1251 1 139 LEU H 1 139 LEU QD . . 4.500 3.528 2.049 3.742 . 0 0 "[ . 1 . 2]" 1
1252 1 139 LEU HA 1 142 TRP H . . 4.300 3.931 3.733 4.095 . 0 0 "[ . 1 . 2]" 1
1253 1 139 LEU QB 1 140 PHE H . . 3.890 2.422 2.306 2.683 . 0 0 "[ . 1 . 2]" 1
1254 1 140 PHE H 1 140 PHE QB . . 3.420 2.274 2.104 2.506 . 0 0 "[ . 1 . 2]" 1
1255 1 140 PHE H 1 141 LEU H . . 3.900 2.578 2.471 2.767 . 0 0 "[ . 1 . 2]" 1
1256 1 140 PHE HA 1 143 ILE H . . 4.350 3.401 3.050 3.650 . 0 0 "[ . 1 . 2]" 1
1257 1 140 PHE HA 1 143 ILE HB . . 4.480 3.305 2.647 3.809 . 0 0 "[ . 1 . 2]" 1
1258 1 140 PHE HA 1 144 PHE H . . 4.610 4.170 3.877 4.525 . 0 0 "[ . 1 . 2]" 1
1259 1 140 PHE QB 1 141 LEU H . . 3.970 2.583 2.290 2.891 . 0 0 "[ . 1 . 2]" 1
1260 1 141 LEU H 1 141 LEU QB . . 3.130 2.101 2.023 2.259 . 0 0 "[ . 1 . 2]" 1
1261 1 141 LEU H 1 141 LEU QD . . 3.920 3.290 2.357 3.706 . 0 0 "[ . 1 . 2]" 1
1262 1 141 LEU H 1 144 PHE H . . 4.730 4.687 4.577 4.732 0.002 9 0 "[ . 1 . 2]" 1
1263 1 141 LEU HA 1 144 PHE H . . 4.400 3.352 3.130 3.760 . 0 0 "[ . 1 . 2]" 1
1264 1 141 LEU HA 1 144 PHE HB3 . . 4.140 2.552 2.008 4.124 . 0 0 "[ . 1 . 2]" 1
1265 1 141 LEU QB 1 142 TRP H . . 3.830 2.770 2.536 2.858 . 0 0 "[ . 1 . 2]" 1
1266 1 142 TRP H 1 142 TRP HB2 . . 3.890 2.273 2.069 2.652 . 0 0 "[ . 1 . 2]" 1
1267 1 142 TRP H 1 142 TRP QB . . 3.360 2.165 2.047 2.310 . 0 0 "[ . 1 . 2]" 1
1268 1 142 TRP H 1 142 TRP HB3 . . 3.890 3.053 2.418 3.566 . 0 0 "[ . 1 . 2]" 1
1269 1 142 TRP HA 1 145 VAL H . . 4.510 4.105 3.781 4.276 . 0 0 "[ . 1 . 2]" 1
1270 1 142 TRP HB2 1 143 ILE H . . 5.500 3.301 2.484 3.941 . 0 0 "[ . 1 . 2]" 1
1271 1 142 TRP HB3 1 143 ILE H . . 5.500 2.797 2.376 3.426 . 0 0 "[ . 1 . 2]" 1
1272 1 143 ILE H 1 143 ILE HB . . 4.050 2.547 2.510 2.613 . 0 0 "[ . 1 . 2]" 1
1273 1 143 ILE H 1 143 ILE MD . . 4.750 3.319 2.689 3.621 . 0 0 "[ . 1 . 2]" 1
1274 1 143 ILE H 1 143 ILE HG12 . . 4.390 3.119 2.028 3.886 . 0 0 "[ . 1 . 2]" 1
1275 1 143 ILE H 1 143 ILE QG . . 3.780 2.172 2.014 2.469 . 0 0 "[ . 1 . 2]" 1
1276 1 143 ILE H 1 143 ILE HG13 . . 4.390 2.639 2.033 3.708 . 0 0 "[ . 1 . 2]" 1
1277 1 143 ILE H 1 143 ILE MG . . 4.330 3.774 3.764 3.782 . 0 0 "[ . 1 . 2]" 1
1278 1 143 ILE HA 1 146 PHE HB3 . . 4.140 3.347 2.027 3.830 . 0 0 "[ . 1 . 2]" 1
1279 1 143 ILE HB 1 143 ILE MD . . 3.270 2.560 2.050 3.230 . 0 0 "[ . 1 . 2]" 1
1280 1 143 ILE HB 1 144 PHE H . . 4.900 2.795 2.585 2.832 . 0 0 "[ . 1 . 2]" 1
1281 1 143 ILE QG 1 143 ILE MG . . 2.950 2.231 2.055 2.318 . 0 0 "[ . 1 . 2]" 1
1282 1 143 ILE QG 1 144 PHE H . . 4.320 4.023 3.900 4.202 . 0 0 "[ . 1 . 2]" 1
1283 1 143 ILE MG 1 144 PHE H . . 4.060 3.663 3.480 3.793 . 0 0 "[ . 1 . 2]" 1
1284 1 144 PHE H 1 144 PHE HB2 . . 4.020 2.547 2.099 2.628 . 0 0 "[ . 1 . 2]" 1
1285 1 144 PHE H 1 144 PHE QB . . 3.480 2.233 2.081 2.251 . 0 0 "[ . 1 . 2]" 1
1286 1 144 PHE H 1 144 PHE HB3 . . 4.020 2.604 2.435 3.522 . 0 0 "[ . 1 . 2]" 1
1287 1 144 PHE H 1 145 VAL H . . 4.230 2.901 2.756 2.914 . 0 0 "[ . 1 . 2]" 1
1288 1 144 PHE H 1 147 VAL H . . 5.440 4.783 4.647 4.979 . 0 0 "[ . 1 . 2]" 1
1289 1 144 PHE HA 1 147 VAL HB . . 4.180 3.355 2.842 3.983 . 0 0 "[ . 1 . 2]" 1
1290 1 144 PHE QB 1 145 VAL H . . 4.220 2.328 2.267 2.623 . 0 0 "[ . 1 . 2]" 1
1291 1 145 VAL H 1 145 VAL HB . . 3.930 2.942 2.593 3.612 . 0 0 "[ . 1 . 2]" 1
1292 1 145 VAL H 1 145 VAL MG1 . . 4.360 3.153 1.942 3.775 . 0 0 "[ . 1 . 2]" 1
1293 1 145 VAL H 1 145 VAL QG . . 3.500 2.008 1.834 2.201 . 0 0 "[ . 1 . 2]" 1
1294 1 145 VAL H 1 145 VAL MG2 . . 4.360 2.223 1.925 3.772 . 0 0 "[ . 1 . 2]" 1
1295 1 145 VAL H 1 146 PHE H . . 4.040 2.694 2.504 2.766 . 0 0 "[ . 1 . 2]" 1
1296 1 145 VAL H 1 147 VAL H . . 4.320 4.212 4.104 4.324 0.004 9 0 "[ . 1 . 2]" 1
1297 1 145 VAL HA 1 147 VAL QG . . 5.440 4.966 4.562 5.422 . 0 0 "[ . 1 . 2]" 1
1298 1 145 VAL HB 1 146 PHE H . . 4.130 3.143 2.503 4.000 . 0 0 "[ . 1 . 2]" 1
1299 1 145 VAL QG 1 146 PHE H . . 4.150 2.833 1.912 3.351 . 0 0 "[ . 1 . 2]" 1
1300 1 145 VAL QG 1 146 PHE HA . . 5.060 3.520 3.029 3.812 . 0 0 "[ . 1 . 2]" 1
1301 1 146 PHE H 1 146 PHE HB2 . . 3.870 2.178 2.066 2.584 . 0 0 "[ . 1 . 2]" 1
1302 1 146 PHE H 1 146 PHE HB3 . . 3.870 3.189 2.476 3.493 . 0 0 "[ . 1 . 2]" 1
1303 1 146 PHE H 1 147 VAL H . . 4.190 2.627 2.538 2.807 . 0 0 "[ . 1 . 2]" 1
1304 1 146 PHE HB2 1 147 VAL H . . 4.370 3.298 2.860 3.986 . 0 0 "[ . 1 . 2]" 1
1305 1 146 PHE HB3 1 147 VAL H . . 4.370 3.066 2.487 3.442 . 0 0 "[ . 1 . 2]" 1
1306 1 147 VAL H 1 147 VAL HB . . 3.890 2.578 2.518 2.626 . 0 0 "[ . 1 . 2]" 1
1307 1 147 VAL H 1 147 VAL MG1 . . 4.080 3.765 3.764 3.770 . 0 0 "[ . 1 . 2]" 1
1308 1 147 VAL H 1 147 VAL QG . . 3.470 2.186 2.107 2.300 . 0 0 "[ . 1 . 2]" 1
1309 1 147 VAL H 1 147 VAL MG2 . . 4.080 2.200 2.118 2.320 . 0 0 "[ . 1 . 2]" 1
1310 1 147 VAL H 1 148 CYS H . . 4.140 2.704 2.553 2.870 . 0 0 "[ . 1 . 2]" 1
1311 1 147 VAL HA 1 147 VAL MG1 . . 3.660 2.334 2.241 2.393 . 0 0 "[ . 1 . 2]" 1
1312 1 147 VAL HA 1 147 VAL QG . . 2.700 2.084 2.046 2.126 . 0 0 "[ . 1 . 2]" 1
1313 1 147 VAL HA 1 147 VAL MG2 . . 3.660 2.349 2.285 2.391 . 0 0 "[ . 1 . 2]" 1
1314 1 147 VAL HA 1 150 PHE H . . 4.340 3.271 3.059 3.580 . 0 0 "[ . 1 . 2]" 1
1315 1 147 VAL HA 1 150 PHE HB2 . . 4.450 2.640 2.004 4.414 . 0 0 "[ . 1 . 2]" 1
1316 1 147 VAL HA 1 150 PHE HB3 . . 4.350 2.952 2.187 4.253 . 0 0 "[ . 1 . 2]" 1
1317 1 147 VAL HA 1 151 GLY H . . 4.640 4.177 3.582 4.640 . 0 0 "[ . 1 . 2]" 1
1318 1 147 VAL HB 1 148 CYS H . . 4.210 2.698 2.338 2.787 . 0 0 "[ . 1 . 2]" 1
1319 1 147 VAL QG 1 150 PHE QB . . 3.780 2.999 2.630 3.612 . 0 0 "[ . 1 . 2]" 1
1320 1 147 VAL QG 1 150 PHE QD . . 4.220 3.759 2.701 4.167 . 0 0 "[ . 1 . 2]" 1
1321 1 147 VAL MG1 1 148 CYS H . . 4.250 3.547 3.186 3.690 . 0 0 "[ . 1 . 2]" 1
1322 1 147 VAL MG2 1 148 CYS H . . 4.250 3.852 3.683 3.904 . 0 0 "[ . 1 . 2]" 1
1323 1 148 CYS H 1 148 CYS QB . . 3.690 2.259 2.048 2.544 . 0 0 "[ . 1 . 2]" 1
1324 1 148 CYS H 1 149 VAL H . . 3.980 2.828 2.671 2.910 . 0 0 "[ . 1 . 2]" 1
1325 1 148 CYS HA 1 150 PHE H . . 4.590 4.458 4.244 4.584 . 0 0 "[ . 1 . 2]" 1
1326 1 148 CYS QB 1 149 VAL H . . 3.740 2.508 2.311 2.870 . 0 0 "[ . 1 . 2]" 1
1327 1 148 CYS HB2 1 149 VAL H . . 4.250 2.883 2.342 3.650 . 0 0 "[ . 1 . 2]" 1
1328 1 148 CYS HB3 1 149 VAL H . . 4.250 3.102 2.395 3.653 . 0 0 "[ . 1 . 2]" 1
1329 1 149 VAL H 1 149 VAL HB . . 3.770 2.692 2.506 3.623 . 0 0 "[ . 1 . 2]" 1
1330 1 149 VAL H 1 149 VAL MG1 . . 4.010 3.631 2.282 3.779 . 0 0 "[ . 1 . 2]" 1
1331 1 149 VAL H 1 149 VAL QG . . 3.340 2.106 1.825 2.287 . 0 0 "[ . 1 . 2]" 1
1332 1 149 VAL H 1 149 VAL MG2 . . 4.010 2.125 1.920 2.306 . 0 0 "[ . 1 . 2]" 1
1333 1 149 VAL H 1 150 PHE H . . 4.010 2.516 2.457 2.826 . 0 0 "[ . 1 . 2]" 1
1334 1 149 VAL H 1 150 PHE QB . . 4.700 4.234 4.106 4.609 . 0 0 "[ . 1 . 2]" 1
1335 1 149 VAL HB 1 150 PHE H . . 3.760 2.849 2.360 3.769 0.009 2 0 "[ . 1 . 2]" 1
1336 1 149 VAL QG 1 150 PHE H . . 3.830 3.206 2.120 3.369 . 0 0 "[ . 1 . 2]" 1
1337 1 149 VAL MG1 1 150 PHE H . . 4.430 3.715 3.482 3.959 . 0 0 "[ . 1 . 2]" 1
1338 1 149 VAL MG2 1 150 PHE H . . 4.430 3.621 2.128 3.864 . 0 0 "[ . 1 . 2]" 1
1339 1 150 PHE H 1 150 PHE HB2 . . 4.150 2.279 2.066 2.700 . 0 0 "[ . 1 . 2]" 1
1340 1 150 PHE H 1 150 PHE HB3 . . 4.150 2.943 2.403 3.527 . 0 0 "[ . 1 . 2]" 1
1341 1 150 PHE H 1 151 GLY H . . 4.190 2.744 2.497 2.942 . 0 0 "[ . 1 . 2]" 1
1342 1 150 PHE QB 1 151 GLY H . . 4.180 2.641 2.245 2.973 . 0 0 "[ . 1 . 2]" 1
1343 1 151 GLY H 1 152 THR H . . 3.670 2.593 2.427 3.017 . 0 0 "[ . 1 . 2]" 1
1344 1 152 THR H 1 152 THR HB . . 3.660 2.496 2.409 2.669 . 0 0 "[ . 1 . 2]" 1
1345 1 152 THR H 1 152 THR MG . . 3.850 3.239 1.918 3.766 . 0 0 "[ . 1 . 2]" 1
1346 1 152 THR H 1 153 ILE H . . 4.060 2.737 2.573 2.927 . 0 0 "[ . 1 . 2]" 1
1347 1 152 THR HB 1 153 ILE H . . 4.070 2.886 2.373 4.070 . 0 0 "[ . 1 . 2]" 1
1348 1 152 THR MG 1 153 ILE H . . 3.930 2.780 1.934 3.385 . 0 0 "[ . 1 . 2]" 1
1349 1 152 THR MG 1 153 ILE HB . . 4.580 4.308 3.051 4.631 0.051 12 0 "[ . 1 . 2]" 1
1350 1 153 ILE H 1 153 ILE HB . . 3.790 2.473 2.402 2.540 . 0 0 "[ . 1 . 2]" 1
1351 1 153 ILE H 1 153 ILE MD . . 4.280 3.565 3.054 4.299 0.019 7 0 "[ . 1 . 2]" 1
1352 1 153 ILE H 1 153 ILE QG . . 3.880 2.677 2.082 3.965 0.085 7 0 "[ . 1 . 2]" 1
1353 1 153 ILE H 1 153 ILE MG . . 3.870 3.394 2.210 3.768 . 0 0 "[ . 1 . 2]" 1
1354 1 153 ILE HA 1 156 PHE H . . 4.930 3.246 3.063 3.585 . 0 0 "[ . 1 . 2]" 1
1355 1 153 ILE HB 1 154 GLY H . . 3.990 3.173 2.227 4.005 0.015 4 0 "[ . 1 . 2]" 1
1356 1 153 ILE QG 1 153 ILE MG . . 3.150 2.195 2.107 2.290 . 0 0 "[ . 1 . 2]" 1
1357 1 153 ILE QG 1 154 GLY H . . 4.280 4.107 3.838 4.226 . 0 0 "[ . 1 . 2]" 1
1358 1 153 ILE MG 1 154 GLY H . . 3.950 3.298 2.167 3.780 . 0 0 "[ . 1 . 2]" 1
1359 1 153 ILE MG 1 154 GLY QA . . 4.030 3.398 2.931 3.646 . 0 0 "[ . 1 . 2]" 1
1360 1 153 ILE MG 1 156 PHE QB . . 4.370 3.431 2.644 4.382 0.012 4 0 "[ . 1 . 2]" 1
1361 1 154 GLY H 1 155 MET H . . 3.830 2.866 2.697 2.926 . 0 0 "[ . 1 . 2]" 1
1362 1 154 GLY QA 1 157 LEU H . . 4.010 3.545 3.096 3.702 . 0 0 "[ . 1 . 2]" 1
1363 1 154 GLY QA 1 157 LEU QD . . 3.730 2.382 1.972 2.887 . 0 0 "[ . 1 . 2]" 1
1364 1 154 GLY QA 1 157 LEU HG . . 4.420 4.120 3.102 4.414 . 0 0 "[ . 1 . 2]" 1
1365 1 154 GLY HA2 1 157 LEU H . . 4.010 3.676 3.162 3.857 . 0 0 "[ . 1 . 2]" 1
1366 1 154 GLY HA2 1 157 LEU HB3 . . 4.570 4.495 4.003 4.571 0.001 5 0 "[ . 1 . 2]" 1
1367 1 154 GLY HA2 1 157 LEU HG . . 4.520 4.217 3.138 4.520 0.000 14 0 "[ . 1 . 2]" 1
1368 1 155 MET H 1 155 MET HB2 . . 3.740 2.165 2.065 2.784 . 0 0 "[ . 1 . 2]" 1
1369 1 155 MET H 1 155 MET QB . . 3.220 2.115 2.043 2.369 . 0 0 "[ . 1 . 2]" 1
1370 1 155 MET H 1 155 MET HB3 . . 3.740 3.285 2.355 3.586 . 0 0 "[ . 1 . 2]" 1
1371 1 155 MET H 1 155 MET QG . . 3.900 3.351 2.367 3.918 0.018 11 0 "[ . 1 . 2]" 1
1372 1 155 MET H 1 156 PHE H . . 3.840 2.498 2.405 2.639 . 0 0 "[ . 1 . 2]" 1
1373 1 155 MET QB 1 156 PHE H . . 3.790 2.856 2.772 2.879 . 0 0 "[ . 1 . 2]" 1
1374 1 155 MET HB2 1 156 PHE H . . 4.440 3.240 2.852 4.076 . 0 0 "[ . 1 . 2]" 1
1375 1 155 MET HB3 1 156 PHE H . . 4.440 3.266 2.840 3.774 . 0 0 "[ . 1 . 2]" 1
1376 1 156 PHE H 1 156 PHE HB2 . . 3.830 2.477 2.102 2.758 . 0 0 "[ . 1 . 2]" 1
1377 1 156 PHE H 1 156 PHE QB . . 3.300 2.217 2.073 2.289 . 0 0 "[ . 1 . 2]" 1
1378 1 156 PHE H 1 156 PHE HB3 . . 3.830 2.743 2.380 3.566 . 0 0 "[ . 1 . 2]" 1
1379 1 156 PHE H 1 157 LEU H . . 4.450 2.502 2.379 2.554 . 0 0 "[ . 1 . 2]" 1
1380 1 156 PHE QB 1 157 LEU H . . 4.290 2.994 2.891 3.152 . 0 0 "[ . 1 . 2]" 1
1381 1 156 PHE QB 1 157 LEU QB . . 5.180 4.489 4.370 4.640 . 0 0 "[ . 1 . 2]" 1
1382 1 157 LEU H 1 157 LEU HB2 . . 3.880 2.193 2.095 2.418 . 0 0 "[ . 1 . 2]" 1
1383 1 157 LEU H 1 157 LEU HB3 . . 3.880 3.482 3.388 3.598 . 0 0 "[ . 1 . 2]" 1
1384 1 157 LEU H 1 157 LEU QD . . 3.440 3.246 2.257 3.444 0.004 2 0 "[ . 1 . 2]" 1
1385 1 157 LEU H 1 157 LEU HG . . 4.050 3.116 2.483 4.051 0.001 17 0 "[ . 1 . 2]" 1
1386 1 157 LEU H 1 158 GLN H . . 3.560 2.445 2.389 2.553 . 0 0 "[ . 1 . 2]" 1
1387 1 157 LEU QB 1 157 LEU QD . . 2.680 1.877 1.798 2.036 . 0 0 "[ . 1 . 2]" 1
1388 1 157 LEU QD 1 158 GLN H . . 4.240 4.223 3.908 4.253 0.013 14 0 "[ . 1 . 2]" 1
1389 1 157 LEU HG 1 158 GLN H . . 5.170 4.866 4.485 5.175 0.005 17 0 "[ . 1 . 2]" 1
1390 1 158 GLN H 1 158 GLN QB . . 3.030 2.074 2.047 2.152 . 0 0 "[ . 1 . 2]" 1
1391 1 158 GLN H 1 158 GLN HG2 . . 4.850 4.276 3.422 4.557 . 0 0 "[ . 1 . 2]" 1
1392 1 158 GLN H 1 158 GLN QG . . 4.150 3.718 3.297 3.853 . 0 0 "[ . 1 . 2]" 1
1393 1 158 GLN H 1 158 GLN HG3 . . 4.850 4.146 3.828 4.482 . 0 0 "[ . 1 . 2]" 1
1394 1 158 GLN H 1 159 PRO HD2 . . 3.700 2.187 2.162 2.201 . 0 0 "[ . 1 . 2]" 1
1395 1 158 GLN H 1 159 PRO HD3 . . 3.700 3.223 3.179 3.243 . 0 0 "[ . 1 . 2]" 1
1396 1 158 GLN QB 1 159 PRO QD . . 4.320 1.853 1.848 1.882 . 0 0 "[ . 1 . 2]" 1
1397 1 159 PRO HA 1 161 PHE H . . 4.620 3.946 3.588 4.590 . 0 0 "[ . 1 . 2]" 1
1398 1 159 PRO QB 1 160 LEU H . . 3.880 3.386 3.110 3.481 . 0 0 "[ . 1 . 2]" 1
1399 1 159 PRO QD 1 160 LEU H . . 3.780 2.658 2.602 2.693 . 0 0 "[ . 1 . 2]" 1
1400 1 159 PRO HD2 1 160 LEU H . . 4.480 2.707 2.647 2.745 . 0 0 "[ . 1 . 2]" 1
1401 1 159 PRO HD3 1 160 LEU H . . 4.480 3.873 3.836 3.895 . 0 0 "[ . 1 . 2]" 1
1402 1 160 LEU H 1 160 LEU HB2 . . 3.740 2.312 2.045 2.911 . 0 0 "[ . 1 . 2]" 1
1403 1 160 LEU H 1 160 LEU QB . . 3.130 2.220 2.024 2.828 . 0 0 "[ . 1 . 2]" 1
1404 1 160 LEU H 1 160 LEU HB3 . . 3.740 3.066 2.294 3.845 0.105 12 0 "[ . 1 . 2]" 1
1405 1 160 LEU H 1 160 LEU MD1 . . 4.530 3.877 2.965 4.306 . 0 0 "[ . 1 . 2]" 1
1406 1 160 LEU H 1 160 LEU QD . . 3.760 3.394 2.933 3.757 . 0 0 "[ . 1 . 2]" 1
1407 1 160 LEU H 1 160 LEU MD2 . . 4.530 3.977 3.078 4.641 0.111 12 0 "[ . 1 . 2]" 1
1408 1 160 LEU H 1 161 PHE H . . 3.410 2.977 2.334 3.194 . 0 0 "[ . 1 . 2]" 1
1409 1 160 LEU QB 1 161 PHE H . . 3.850 3.298 2.138 3.857 0.007 15 0 "[ . 1 . 2]" 1
1410 1 160 LEU HB2 1 161 PHE H . . 4.530 4.028 2.789 4.495 . 0 0 "[ . 1 . 2]" 1
1411 1 160 LEU HB3 1 161 PHE H . . 4.530 3.566 2.158 4.367 . 0 0 "[ . 1 . 2]" 1
1412 1 161 PHE H 1 161 PHE HB2 . . 3.680 2.789 2.079 3.655 . 0 0 "[ . 1 . 2]" 1
1413 1 161 PHE H 1 161 PHE QB . . 3.140 2.514 2.060 3.054 . 0 0 "[ . 1 . 2]" 1
1414 1 161 PHE H 1 161 PHE HB3 . . 3.680 3.284 2.477 3.820 0.140 12 0 "[ . 1 . 2]" 1
1415 1 161 PHE H 1 161 PHE QD . . 4.130 3.465 1.952 4.056 . 0 0 "[ . 1 . 2]" 1
1416 1 161 PHE H 1 162 GLN H . . 3.240 2.658 2.207 3.464 0.224 12 0 "[ . 1 . 2]" 1
1417 1 161 PHE QB 1 162 GLN H . . 3.660 3.054 2.124 3.608 . 0 0 "[ . 1 . 2]" 1
1418 1 161 PHE HB2 1 162 GLN H . . 4.170 3.692 2.417 4.328 0.158 17 0 "[ . 1 . 2]" 1
1419 1 161 PHE HB3 1 162 GLN H . . 4.170 3.302 2.196 4.158 . 0 0 "[ . 1 . 2]" 1
1420 1 162 GLN H 1 162 GLN HB2 . . 3.790 2.961 2.285 3.171 . 0 0 "[ . 1 . 2]" 1
1421 1 162 GLN H 1 162 GLN QB . . 3.310 2.797 2.186 3.020 . 0 0 "[ . 1 . 2]" 1
1422 1 162 GLN H 1 162 GLN HB3 . . 3.790 3.482 2.439 3.795 0.005 18 0 "[ . 1 . 2]" 1
1423 1 162 GLN H 1 162 GLN QG . . 4.270 4.094 3.880 4.269 . 0 0 "[ . 1 . 2]" 1
1424 1 162 GLN H 1 163 ASN H . . 3.860 3.193 1.901 3.793 . 0 0 "[ . 1 . 2]" 1
1425 1 162 GLN QB 1 163 ASN H . . 3.980 3.063 1.918 3.980 0.000 15 0 "[ . 1 . 2]" 1
1426 1 162 GLN HB2 1 163 ASN H . . 4.830 3.923 2.604 4.637 . 0 0 "[ . 1 . 2]" 1
1427 1 162 GLN HB3 1 163 ASN H . . 4.830 3.265 1.930 4.347 . 0 0 "[ . 1 . 2]" 1
1428 1 162 GLN QG 1 163 ASN H . . 4.400 3.718 3.165 4.295 . 0 0 "[ . 1 . 2]" 1
1429 1 163 ASN H 1 163 ASN HB2 . . 3.640 2.933 2.070 3.625 . 0 0 "[ . 1 . 2]" 1
1430 1 163 ASN H 1 163 ASN HB3 . . 3.640 3.187 2.293 3.763 0.123 16 0 "[ . 1 . 2]" 1
1431 1 163 ASN H 1 164 TYR H . . 3.960 3.198 2.375 3.960 . 0 0 "[ . 1 . 2]" 1
1432 1 163 ASN QB 1 164 TYR H . . 4.100 3.377 1.901 4.055 . 0 0 "[ . 1 . 2]" 1
1433 1 164 TYR H 1 164 TYR HB2 . . 3.810 2.937 2.077 3.585 . 0 0 "[ . 1 . 2]" 1
1434 1 164 TYR H 1 164 TYR QB . . 3.270 2.670 2.052 2.963 . 0 0 "[ . 1 . 2]" 1
1435 1 164 TYR H 1 164 TYR HB3 . . 3.810 3.302 2.375 3.804 . 0 0 "[ . 1 . 2]" 1
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