Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
590139 | 2mxx RC | 25435 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2mxx
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 1619
_Distance_constraint_stats_list.Viol_count 3148
_Distance_constraint_stats_list.Viol_total 5961.723
_Distance_constraint_stats_list.Viol_max 0.980
_Distance_constraint_stats_list.Viol_rms 0.0475
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0092
_Distance_constraint_stats_list.Viol_average_violations_only 0.0947
_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 4 GLU 1.297 0.100 11 0 "[ . 1 . 2]"
1 5 ALA 0.984 0.090 10 0 "[ . 1 . 2]"
1 6 THR 1.358 0.100 11 0 "[ . 1 . 2]"
1 7 ASP 4.009 0.764 11 2 "[ -. 1+ . 2]"
1 8 ALA 0.478 0.105 17 0 "[ . 1 . 2]"
1 9 ALA 2.533 0.102 9 0 "[ . 1 . 2]"
1 10 ARG 3.226 0.102 13 0 "[ . 1 . 2]"
1 11 ASN 2.730 0.397 20 0 "[ . 1 . 2]"
1 12 ASN 0.440 0.094 5 0 "[ . 1 . 2]"
1 13 ASP 1.142 0.096 18 0 "[ . 1 . 2]"
1 14 GLY 3.088 0.402 8 0 "[ . 1 . 2]"
1 15 ALA 6.607 0.231 8 0 "[ . 1 . 2]"
1 16 TYR 6.417 0.402 8 0 "[ . 1 . 2]"
1 17 TYR 10.170 0.884 18 1 "[ . 1 . + 2]"
1 18 LEU 12.270 0.884 18 4 "[ *. - 1 . +*2]"
1 19 GLN 10.729 0.564 4 3 "[ +. - 1 . *2]"
1 20 THR 14.226 0.958 19 4 "[ * * 1 . +-]"
1 21 GLN 3.537 0.178 4 0 "[ . 1 . 2]"
1 22 PHE 10.980 0.958 19 4 "[ * * 1 . +-]"
1 23 THR 3.167 0.310 8 0 "[ . 1 . 2]"
1 24 ASN 5.526 0.368 12 0 "[ . 1 . 2]"
1 25 ALA 3.111 0.368 12 0 "[ . 1 . 2]"
1 26 ASP 0.234 0.074 6 0 "[ . 1 . 2]"
1 27 LYS 2.782 0.113 10 0 "[ . 1 . 2]"
1 28 VAL 7.816 0.563 7 2 "[ . +- 1 . 2]"
1 29 ASN 2.723 0.173 9 0 "[ . 1 . 2]"
1 30 GLU 3.370 0.150 9 0 "[ . 1 . 2]"
1 31 TYR 2.721 0.548 19 1 "[ . 1 . +2]"
1 32 LEU 2.992 0.341 7 0 "[ . 1 . 2]"
1 33 ALA 1.956 0.110 4 0 "[ . 1 . 2]"
1 34 GLN 8.384 0.980 19 4 "[ . * * . +*]"
1 35 HIS 11.129 0.980 19 7 "[ . * *** . - +*]"
1 36 ASP 5.260 0.790 7 3 "[ . + 1* . - 2]"
1 37 GLY 2.040 0.098 20 0 "[ . 1 . 2]"
1 38 GLU 0.717 0.083 14 0 "[ . 1 . 2]"
1 39 ILE 3.041 0.113 9 0 "[ . 1 . 2]"
1 40 ARG 0.194 0.086 12 0 "[ . 1 . 2]"
1 41 ALA 1.156 0.098 20 0 "[ . 1 . 2]"
1 42 GLU 1.894 0.103 13 0 "[ . 1 . 2]"
1 43 ALA 2.467 0.098 3 0 "[ . 1 . 2]"
1 44 ALA 0.789 0.129 5 0 "[ . 1 . 2]"
1 45 ALA 0.831 0.129 5 0 "[ . 1 . 2]"
1 46 ASP 1.405 0.102 15 0 "[ . 1 . 2]"
1 47 PRO 1.700 0.120 15 0 "[ . 1 . 2]"
1 48 ALA 2.452 0.120 15 0 "[ . 1 . 2]"
1 49 VAL 3.954 0.123 16 0 "[ . 1 . 2]"
1 50 VAL 2.385 0.084 6 0 "[ . 1 . 2]"
1 51 ALA 2.767 0.088 19 0 "[ . 1 . 2]"
1 52 ALA 0.209 0.087 16 0 "[ . 1 . 2]"
1 53 LYS 2.629 0.875 6 2 "[ .+ - 1 . 2]"
1 54 ALA 0.191 0.073 20 0 "[ . 1 . 2]"
1 55 ALA 0.702 0.099 5 0 "[ . 1 . 2]"
1 56 LEU 2.334 0.297 8 0 "[ . 1 . 2]"
1 57 ASP 4.250 0.875 6 2 "[ .+ - 1 . 2]"
1 58 ALA 5.554 0.945 9 2 "[- . +1 . 2]"
1 59 VAL 7.602 0.945 9 2 "[* . +1 . 2]"
1 60 GLU 2.156 0.239 4 0 "[ . 1 . 2]"
1 61 GLY 3.356 0.431 10 0 "[ . 1 . 2]"
1 62 GLY 0.247 0.063 12 0 "[ . 1 . 2]"
1 63 SER 3.002 0.089 14 0 "[ . 1 . 2]"
1 64 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 ASN 1.095 0.083 19 0 "[ . 1 . 2]"
1 66 TYR 5.935 0.436 14 0 "[ . 1 . 2]"
1 67 GLY 1.835 0.226 10 0 "[ . 1 . 2]"
1 68 GLU 3.699 0.723 8 2 "[ . + 1 . - 2]"
1 69 VAL 1.890 0.230 10 0 "[ . 1 . 2]"
1 70 LYS 6.120 0.836 12 2 "[ - . 1 + . 2]"
1 71 ALA 0.908 0.147 11 0 "[ . 1 . 2]"
1 72 ALA 1.320 0.329 10 0 "[ . 1 . 2]"
1 73 TYR 3.801 0.126 20 0 "[ . 1 . 2]"
1 74 GLU 4.637 0.836 12 2 "[ - . 1 + . 2]"
1 75 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ALA 2.559 0.471 17 0 "[ . 1 . 2]"
1 77 PHE 2.121 0.471 17 0 "[ . 1 . 2]"
1 78 ASN 1.264 0.240 12 0 "[ . 1 . 2]"
1 79 ASN 1.106 0.089 15 0 "[ . 1 . 2]"
1 80 ALA 2.205 0.102 15 0 "[ . 1 . 2]"
1 81 PHE 1.239 0.092 2 0 "[ . 1 . 2]"
1 82 ASN 1.280 0.093 11 0 "[ . 1 . 2]"
1 83 ALA 1.656 0.098 15 0 "[ . 1 . 2]"
1 84 VAL 2.089 0.113 9 0 "[ . 1 . 2]"
1 85 ARG 3.090 0.105 7 0 "[ . 1 . 2]"
1 86 ASN 1.147 0.656 20 1 "[ . 1 . +]"
1 87 LYS 3.693 0.795 19 3 "[ *. 1 . +-]"
1 88 TYR 0.289 0.088 18 0 "[ . 1 . 2]"
1 89 VAL 1.852 0.106 2 0 "[ . 1 . 2]"
1 90 GLN 7.586 0.818 4 2 "[ +. 1 . *2]"
1 91 ARG 1.683 0.127 4 0 "[ . 1 . 2]"
1 92 PHE 3.435 0.122 18 0 "[ . 1 . 2]"
1 93 GLN 4.563 0.563 7 2 "[ . +- 1 . 2]"
1 94 ALA 2.144 0.339 14 0 "[ . 1 . 2]"
1 95 THR 4.915 0.127 4 0 "[ . 1 . 2]"
1 96 TYR 3.567 0.136 3 0 "[ . 1 . 2]"
1 97 ASN 3.414 0.744 12 1 "[ . 1 + . 2]"
1 98 ASN 1.197 0.096 6 0 "[ . 1 . 2]"
1 99 ALA 0.990 0.103 3 0 "[ . 1 . 2]"
1 100 THR 5.873 0.744 12 1 "[ . 1 + . 2]"
1 101 GLU 0.549 0.126 15 0 "[ . 1 . 2]"
1 102 GLN 3.325 0.725 8 1 "[ . + 1 . 2]"
1 103 GLU 6.627 0.924 5 5 "[- *+ 1* .* 2]"
1 104 GLY 1.135 0.098 9 0 "[ . 1 . 2]"
1 105 LYS 9.707 0.924 5 4 "[ + - 1* .* 2]"
1 106 THR 3.069 0.834 17 1 "[ . 1 . + 2]"
1 107 TYR 7.078 0.834 17 1 "[ . 1 . + 2]"
1 108 ILE 13.429 0.964 1 8 "[+**-. 1* * . * *]"
1 109 GLN 16.679 0.964 1 8 "[+***. 1* * . * *]"
1 110 GLY 1.413 0.145 15 0 "[ . 1 . 2]"
1 111 GLU 4.820 0.595 19 2 "[ -. 1 . +2]"
1 112 THR 8.183 0.287 19 0 "[ . 1 . 2]"
1 113 PRO 4.126 0.123 14 0 "[ . 1 . 2]"
1 114 GLU 1.164 0.109 13 0 "[ . 1 . 2]"
1 115 GLN 4.957 0.818 4 1 "[ +. 1 . 2]"
1 116 ALA 0.987 0.118 6 0 "[ . 1 . 2]"
1 117 ASN 1.374 0.097 4 0 "[ . 1 . 2]"
1 118 ALA 1.097 0.075 17 0 "[ . 1 . 2]"
1 119 ARG 0.848 0.096 20 0 "[ . 1 . 2]"
1 120 TYR 2.144 0.085 5 0 "[ . 1 . 2]"
1 121 LEU 3.385 0.242 7 0 "[ . 1 . 2]"
1 122 LYS 6.390 0.980 15 4 "[ .* -1 + * 2]"
1 123 ARG 2.989 0.461 4 0 "[ . 1 . 2]"
1 124 VAL 4.650 0.148 5 0 "[ . 1 . 2]"
1 125 GLY 2.984 0.111 11 0 "[ . 1 . 2]"
1 126 ALA 0.275 0.107 13 0 "[ . 1 . 2]"
1 127 ALA 1.149 0.126 14 0 "[ . 1 . 2]"
1 128 ASN 0.602 0.210 2 0 "[ . 1 . 2]"
1 129 ASN 1.638 0.204 6 0 "[ . 1 . 2]"
1 130 GLN 3.348 0.295 10 0 "[ . 1 . 2]"
1 131 ASN 2.972 0.295 10 0 "[ . 1 . 2]"
1 132 PRO 0.120 0.073 10 0 "[ . 1 . 2]"
1 133 ALA 2.280 0.254 8 0 "[ . 1 . 2]"
1 134 ALA 3.739 0.254 8 0 "[ . 1 . 2]"
1 135 GLU 0.578 0.080 15 0 "[ . 1 . 2]"
1 136 ASP 1.920 0.105 20 0 "[ . 1 . 2]"
1 137 LYS 0.583 0.089 9 0 "[ . 1 . 2]"
1 138 GLY 1.081 0.086 2 0 "[ . 1 . 2]"
1 139 ALA 9.626 0.854 6 9 "[* **.+-* 1 * . **2]"
1 140 THR 1.783 0.126 19 0 "[ . 1 . 2]"
1 141 THR 3.798 0.641 8 1 "[ . + 1 . 2]"
1 142 PRO 10.731 0.854 6 9 "[* **.+-* 1 * . **2]"
1 143 ALA 2.406 0.353 8 0 "[ . 1 . 2]"
1 144 SER 6.184 0.641 8 2 "[ . + 1 - 2]"
1 145 LYS 5.891 0.431 19 0 "[ . 1 . 2]"
1 146 GLU 4.787 0.584 15 3 "[* - 1 + 2]"
1 147 GLU 0.655 0.086 17 0 "[ . 1 . 2]"
1 148 ALA 0.608 0.086 17 0 "[ . 1 . 2]"
1 149 LYS 0.373 0.078 14 0 "[ . 1 . 2]"
1 150 LYS 2.780 0.691 11 3 "[ . -+ * 2]"
1 151 SER 5.816 0.691 11 3 "[ . -+ * 2]"
1 152 GLU 3.835 0.615 17 3 "[ . 1 -* + 2]"
1 153 ALA 0.013 0.008 20 0 "[ . 1 . 2]"
1 154 ALA 0.082 0.069 16 0 "[ . 1 . 2]"
1 155 ALA 0.069 0.069 16 0 "[ . 1 . 2]"
1 156 LYS 1.571 0.205 3 0 "[ . 1 . 2]"
1 157 ASN 1.395 0.205 3 0 "[ . 1 . 2]"
1 158 ALA 0.229 0.118 9 0 "[ . 1 . 2]"
1 159 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 162 ALA 0.467 0.084 16 0 "[ . 1 . 2]"
1 163 GLY 0.467 0.084 16 0 "[ . 1 . 2]"
1 164 LYS 0.081 0.081 6 0 "[ . 1 . 2]"
1 165 ALA 0.776 0.116 12 0 "[ . 1 . 2]"
1 166 LEU 7.840 0.898 10 1 "[ . + . 2]"
1 167 PRO 4.419 0.460 3 0 "[ . 1 . 2]"
1 168 LYS 0.050 0.050 12 0 "[ . 1 . 2]"
1 169 THR 1.210 0.084 18 0 "[ . 1 . 2]"
1 170 SER 1.641 0.084 18 0 "[ . 1 . 2]"
1 171 ALA 1.244 0.099 16 0 "[ . 1 . 2]"
1 172 VAL 1.844 0.099 16 0 "[ . 1 . 2]"
1 173 LYS 0.179 0.063 7 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 4 GLU H 1 4 GLU QG . . 5.080 3.266 1.870 4.389 . 0 0 "[ . 1 . 2]" 1
2 1 4 GLU H 1 5 ALA H . . 3.810 3.251 1.604 3.900 0.090 10 0 "[ . 1 . 2]" 1
3 1 4 GLU QG 1 6 THR H . . 5.320 4.749 3.070 5.420 0.100 11 0 "[ . 1 . 2]" 1
4 1 5 ALA H 1 6 THR H . . 4.290 3.410 1.735 4.325 0.035 14 0 "[ . 1 . 2]" 1
5 1 5 ALA HA 1 6 THR H . . 3.350 2.578 2.180 3.436 0.086 15 0 "[ . 1 . 2]" 1
6 1 5 ALA MB 1 6 THR H . . 4.490 3.296 2.360 3.809 . 0 0 "[ . 1 . 2]" 1
7 1 6 THR H 1 6 THR MG . . 4.670 3.082 2.064 4.039 . 0 0 "[ . 1 . 2]" 1
8 1 6 THR H 1 7 ASP H . . 4.090 3.378 2.199 4.177 0.087 12 0 "[ . 1 . 2]" 1
9 1 6 THR HA 1 7 ASP H . . 3.170 2.533 2.156 3.248 0.078 17 0 "[ . 1 . 2]" 1
10 1 6 THR HA 1 7 ASP HA . . 4.740 4.542 4.334 4.824 0.084 4 0 "[ . 1 . 2]" 1
11 1 7 ASP H 1 7 ASP HB3 . . 3.410 3.145 2.427 4.174 0.764 11 2 "[ -. 1+ . 2]" 1
12 1 7 ASP HA 1 8 ALA H . . 3.300 2.474 2.042 3.376 0.076 7 0 "[ . 1 . 2]" 1
13 1 7 ASP HA 1 8 ALA MB . . 4.260 4.035 3.686 4.365 0.105 17 0 "[ . 1 . 2]" 1
14 1 7 ASP HA 1 9 ALA H . . 4.290 4.075 3.166 4.375 0.085 2 0 "[ . 1 . 2]" 1
15 1 7 ASP HB3 1 8 ALA H . . 4.290 3.731 2.419 4.362 0.072 1 0 "[ . 1 . 2]" 1
16 1 9 ALA H 1 9 ALA MB . . 3.300 2.756 2.283 3.047 . 0 0 "[ . 1 . 2]" 1
17 1 9 ALA H 1 10 ARG QG . . 4.470 4.492 4.039 4.572 0.102 9 0 "[ . 1 . 2]" 1
18 1 9 ALA HA 1 10 ARG QD . . 3.930 3.669 2.656 4.028 0.098 11 0 "[ . 1 . 2]" 1
19 1 10 ARG H 1 10 ARG QD . . 5.240 3.126 2.229 3.914 . 0 0 "[ . 1 . 2]" 1
20 1 10 ARG H 1 10 ARG QG . . 4.950 3.321 2.120 4.050 . 0 0 "[ . 1 . 2]" 1
21 1 10 ARG H 1 11 ASN HA . . 4.080 4.119 3.927 4.182 0.102 13 0 "[ . 1 . 2]" 1
22 1 10 ARG HA 1 11 ASN H . . 3.130 2.675 2.124 3.151 0.021 12 0 "[ . 1 . 2]" 1
23 1 10 ARG QG 1 11 ASN H . . 5.070 4.507 3.134 5.083 0.013 14 0 "[ . 1 . 2]" 1
24 1 11 ASN H 1 11 ASN HB2 . . 3.420 2.759 2.121 3.817 0.397 20 0 "[ . 1 . 2]" 1
25 1 11 ASN HA 1 12 ASN H . . 3.150 2.510 2.128 3.244 0.094 5 0 "[ . 1 . 2]" 1
26 1 12 ASN HA 1 13 ASP H . . 3.470 2.749 2.173 3.545 0.075 11 0 "[ . 1 . 2]" 1
27 1 13 ASP H 1 13 ASP QB . . 3.000 2.581 1.995 2.988 . 0 0 "[ . 1 . 2]" 1
28 1 13 ASP H 1 14 GLY QA . . 4.950 4.779 4.323 5.046 0.096 18 0 "[ . 1 . 2]" 1
29 1 13 ASP HA 1 14 GLY H . . 3.250 2.547 2.086 2.987 . 0 0 "[ . 1 . 2]" 1
30 1 13 ASP HA 1 15 ALA H . . 4.710 4.438 3.453 4.796 0.086 18 0 "[ . 1 . 2]" 1
31 1 13 ASP QB 1 14 GLY H . . 3.840 2.696 1.843 3.614 . 0 0 "[ . 1 . 2]" 1
32 1 13 ASP QB 1 14 GLY QA . . 5.220 3.853 3.165 4.473 . 0 0 "[ . 1 . 2]" 1
33 1 13 ASP QB 1 15 ALA H . . 4.650 3.606 2.904 4.519 . 0 0 "[ . 1 . 2]" 1
34 1 14 GLY H 1 15 ALA H . . 3.560 2.525 1.541 3.398 . 0 0 "[ . 1 . 2]" 1
35 1 14 GLY H 1 15 ALA MB . . 5.450 3.968 3.278 4.739 . 0 0 "[ . 1 . 2]" 1
36 1 14 GLY QA 1 15 ALA H . . 3.100 2.768 2.435 3.105 0.005 10 0 "[ . 1 . 2]" 1
37 1 14 GLY QA 1 15 ALA HA . . 3.990 4.052 3.927 4.102 0.112 8 0 "[ . 1 . 2]" 1
38 1 14 GLY QA 1 15 ALA MB . . 4.850 4.071 3.620 4.266 . 0 0 "[ . 1 . 2]" 1
39 1 14 GLY QA 1 16 TYR H . . 4.580 4.293 2.980 4.982 0.402 8 0 "[ . 1 . 2]" 1
40 1 15 ALA H 1 15 ALA MB . . 3.150 2.326 2.095 2.877 . 0 0 "[ . 1 . 2]" 1
41 1 15 ALA H 1 18 LEU HB2 . . 4.760 4.708 4.232 4.991 0.231 8 0 "[ . 1 . 2]" 1
42 1 15 ALA H 1 19 GLN H . . 3.670 3.339 2.300 3.811 0.141 8 0 "[ . 1 . 2]" 1
43 1 15 ALA H 1 20 THR MG . . 5.500 5.541 5.111 5.620 0.120 10 0 "[ . 1 . 2]" 1
44 1 15 ALA HA 1 16 TYR H . . 2.960 2.335 1.981 3.047 0.087 4 0 "[ . 1 . 2]" 1
45 1 15 ALA HA 1 16 TYR QD . . 3.850 3.710 3.207 3.939 0.089 9 0 "[ . 1 . 2]" 1
46 1 15 ALA MB 1 16 TYR H . . 3.830 3.468 3.193 3.748 . 0 0 "[ . 1 . 2]" 1
47 1 15 ALA MB 1 16 TYR HA . . 5.260 4.836 4.593 5.180 . 0 0 "[ . 1 . 2]" 1
48 1 15 ALA MB 1 16 TYR QB . . 5.500 4.575 3.474 5.176 . 0 0 "[ . 1 . 2]" 1
49 1 15 ALA MB 1 16 TYR QD . . 4.790 4.197 3.216 4.681 . 0 0 "[ . 1 . 2]" 1
50 1 15 ALA MB 1 17 TYR H . . 5.100 4.060 2.709 5.164 0.064 4 0 "[ . 1 . 2]" 1
51 1 15 ALA MB 1 18 LEU HB2 . . 4.310 2.255 1.783 3.604 . 0 0 "[ . 1 . 2]" 1
52 1 15 ALA MB 1 18 LEU QD . . 5.370 2.662 1.794 4.196 . 0 0 "[ . 1 . 2]" 1
53 1 15 ALA MB 1 19 GLN H . . 4.880 2.568 1.763 3.214 . 0 0 "[ . 1 . 2]" 1
54 1 15 ALA MB 1 19 GLN HA . . 4.580 2.840 1.982 3.918 . 0 0 "[ . 1 . 2]" 1
55 1 15 ALA MB 1 19 GLN HB2 . . 5.460 4.578 3.865 5.644 0.184 4 0 "[ . 1 . 2]" 1
56 1 15 ALA MB 1 20 THR MG . . 4.670 4.256 3.317 4.838 0.168 16 0 "[ . 1 . 2]" 1
57 1 16 TYR H 1 16 TYR QB . . 3.540 3.041 2.486 3.481 . 0 0 "[ . 1 . 2]" 1
58 1 16 TYR H 1 16 TYR QD . . 3.880 2.751 2.068 3.693 . 0 0 "[ . 1 . 2]" 1
59 1 16 TYR H 1 17 TYR H . . 3.870 3.512 2.394 3.957 0.087 9 0 "[ . 1 . 2]" 1
60 1 16 TYR H 1 19 GLN H . . 4.480 4.417 3.389 4.586 0.106 8 0 "[ . 1 . 2]" 1
61 1 16 TYR HA 1 16 TYR QD . . 3.450 2.897 2.180 3.569 0.119 15 0 "[ . 1 . 2]" 1
62 1 16 TYR QB 1 17 TYR H . . 2.870 2.540 1.914 3.007 0.137 7 0 "[ . 1 . 2]" 1
63 1 16 TYR QB 1 19 GLN H . . 5.300 5.107 4.040 5.445 0.145 15 0 "[ . 1 . 2]" 1
64 1 16 TYR QD 1 17 TYR H . . 3.960 3.662 2.286 4.091 0.131 16 0 "[ . 1 . 2]" 1
65 1 16 TYR QD 1 18 LEU QD . . 4.800 4.005 2.942 4.831 0.031 4 0 "[ . 1 . 2]" 1
66 1 17 TYR H 1 17 TYR HA . . 2.910 2.792 2.220 2.985 0.075 20 0 "[ . 1 . 2]" 1
67 1 17 TYR H 1 17 TYR HB2 . . 4.040 2.964 2.213 3.674 . 0 0 "[ . 1 . 2]" 1
68 1 17 TYR H 1 17 TYR QD . . 3.360 3.132 2.152 3.473 0.113 17 0 "[ . 1 . 2]" 1
69 1 17 TYR H 1 18 LEU HA . . 4.900 4.821 4.297 5.051 0.151 8 0 "[ . 1 . 2]" 1
70 1 17 TYR H 1 18 LEU QD . . 5.500 3.500 2.145 4.828 . 0 0 "[ . 1 . 2]" 1
71 1 17 TYR HA 1 17 TYR QD . . 3.340 2.747 2.085 3.451 0.111 18 0 "[ . 1 . 2]" 1
72 1 17 TYR HA 1 18 LEU H . . 3.550 3.342 2.382 3.631 0.081 1 0 "[ . 1 . 2]" 1
73 1 17 TYR HA 1 19 GLN H . . 4.240 4.126 3.508 4.328 0.088 18 0 "[ . 1 . 2]" 1
74 1 17 TYR HA 1 19 GLN QG . . 4.850 4.348 3.440 4.944 0.094 7 0 "[ . 1 . 2]" 1
75 1 17 TYR HB2 1 18 LEU QD . . 4.580 3.406 2.094 4.621 0.041 15 0 "[ . 1 . 2]" 1
76 1 17 TYR HB3 1 18 LEU H . . 4.080 3.805 2.760 4.605 0.525 18 1 "[ . 1 . + 2]" 1
77 1 17 TYR HB3 1 18 LEU HA . . 4.690 4.475 3.619 5.574 0.884 18 1 "[ . 1 . + 2]" 1
78 1 17 TYR QD 1 18 LEU H . . 4.580 4.339 2.801 4.824 0.244 8 0 "[ . 1 . 2]" 1
79 1 18 LEU H 1 18 LEU HB2 . . 3.120 2.685 2.240 3.125 0.005 8 0 "[ . 1 . 2]" 1
80 1 18 LEU H 1 18 LEU QD . . 4.380 2.550 1.731 3.579 . 0 0 "[ . 1 . 2]" 1
81 1 18 LEU H 1 18 LEU HG . . 3.560 2.966 1.825 3.653 0.093 1 0 "[ . 1 . 2]" 1
82 1 18 LEU H 1 19 GLN H . . 3.570 2.312 1.715 2.860 . 0 0 "[ . 1 . 2]" 1
83 1 18 LEU H 1 19 GLN QG . . 5.500 4.494 3.078 5.591 0.091 15 0 "[ . 1 . 2]" 1
84 1 18 LEU H 1 20 THR H . . 4.630 4.403 3.734 4.713 0.083 6 0 "[ . 1 . 2]" 1
85 1 18 LEU H 1 20 THR MG . . 5.500 5.039 3.980 5.829 0.329 8 0 "[ . 1 . 2]" 1
86 1 18 LEU HA 1 18 LEU QD . . 3.650 2.497 2.043 3.236 . 0 0 "[ . 1 . 2]" 1
87 1 18 LEU HA 1 19 GLN H . . 3.560 3.475 3.246 3.616 0.056 11 0 "[ . 1 . 2]" 1
88 1 18 LEU HA 1 20 THR MG . . 4.990 4.020 2.722 5.079 0.089 8 0 "[ . 1 . 2]" 1
89 1 18 LEU HB2 1 19 GLN H . . 3.900 3.023 2.196 3.779 . 0 0 "[ . 1 . 2]" 1
90 1 18 LEU HB2 1 19 GLN HB3 . . 5.500 5.437 4.760 6.064 0.564 4 3 "[ +. - 1 . *2]" 1
91 1 18 LEU HB2 1 20 THR H . . 4.790 3.175 1.965 4.868 0.078 16 0 "[ . 1 . 2]" 1
92 1 18 LEU HB2 1 22 PHE H . . 5.500 3.642 2.594 5.230 . 0 0 "[ . 1 . 2]" 1
93 1 18 LEU HB2 1 22 PHE HB3 . . 5.030 4.388 2.733 5.346 0.316 16 0 "[ . 1 . 2]" 1
94 1 18 LEU HB3 1 19 GLN H . . 5.500 4.033 3.507 4.430 . 0 0 "[ . 1 . 2]" 1
95 1 18 LEU HB3 1 22 PHE HB3 . . 4.280 3.533 2.153 4.617 0.337 16 0 "[ . 1 . 2]" 1
96 1 18 LEU QD 1 19 GLN H . . 4.700 3.914 2.769 4.320 . 0 0 "[ . 1 . 2]" 1
97 1 18 LEU QD 1 20 THR H . . 5.500 4.211 3.426 4.951 . 0 0 "[ . 1 . 2]" 1
98 1 18 LEU QD 1 21 GLN H . . 5.500 4.473 3.548 5.245 . 0 0 "[ . 1 . 2]" 1
99 1 18 LEU QD 1 22 PHE H . . 4.440 3.191 2.147 4.105 . 0 0 "[ . 1 . 2]" 1
100 1 18 LEU HG 1 22 PHE H . . 5.310 4.395 2.645 5.413 0.103 20 0 "[ . 1 . 2]" 1
101 1 19 GLN H 1 19 GLN HA . . 2.910 2.383 2.113 2.872 . 0 0 "[ . 1 . 2]" 1
102 1 19 GLN H 1 19 GLN HB2 . . 3.560 3.374 2.745 3.801 0.241 8 0 "[ . 1 . 2]" 1
103 1 19 GLN H 1 19 GLN QG . . 3.710 2.897 2.073 3.585 . 0 0 "[ . 1 . 2]" 1
104 1 19 GLN H 1 20 THR MG . . 4.590 3.979 2.812 4.606 0.016 8 0 "[ . 1 . 2]" 1
105 1 19 GLN HA 1 19 GLN QG . . 3.930 2.746 2.094 3.428 . 0 0 "[ . 1 . 2]" 1
106 1 19 GLN HA 1 20 THR H . . 3.100 3.015 2.504 3.265 0.165 8 0 "[ . 1 . 2]" 1
107 1 19 GLN HA 1 20 THR MG . . 4.450 4.183 3.791 4.573 0.123 15 0 "[ . 1 . 2]" 1
108 1 19 GLN HB2 1 20 THR H . . 4.350 4.181 3.452 4.423 0.073 12 0 "[ . 1 . 2]" 1
109 1 19 GLN HB2 1 20 THR MG . . 5.110 3.997 2.375 5.203 0.093 18 0 "[ . 1 . 2]" 1
110 1 19 GLN HB3 1 20 THR H . . 4.230 4.179 3.706 4.459 0.229 8 0 "[ . 1 . 2]" 1
111 1 19 GLN QG 1 20 THR H . . 4.570 4.140 3.106 4.610 0.040 13 0 "[ . 1 . 2]" 1
112 1 20 THR H 1 20 THR HA . . 2.870 2.913 2.716 2.957 0.087 3 0 "[ . 1 . 2]" 1
113 1 20 THR H 1 20 THR MG . . 3.850 2.481 1.927 3.124 . 0 0 "[ . 1 . 2]" 1
114 1 20 THR H 1 21 GLN H . . 3.330 2.700 1.983 3.262 . 0 0 "[ . 1 . 2]" 1
115 1 20 THR H 1 21 GLN QE . . 5.380 4.906 4.513 5.293 . 0 0 "[ . 1 . 2]" 1
116 1 20 THR H 1 22 PHE H . . 3.700 3.437 2.837 3.806 0.106 12 0 "[ . 1 . 2]" 1
117 1 20 THR H 1 22 PHE HB2 . . 5.500 5.086 3.216 6.458 0.958 19 4 "[ * * 1 . +-]" 1
118 1 20 THR HA 1 21 GLN H . . 3.510 3.356 2.783 3.583 0.073 6 0 "[ . 1 . 2]" 1
119 1 20 THR HB 1 21 GLN H . . 4.360 3.758 2.434 4.458 0.098 14 0 "[ . 1 . 2]" 1
120 1 20 THR HB 1 21 GLN QE . . 5.500 4.146 1.914 5.422 . 0 0 "[ . 1 . 2]" 1
121 1 20 THR MG 1 21 GLN H . . 4.480 2.696 1.629 4.229 . 0 0 "[ . 1 . 2]" 1
122 1 20 THR MG 1 21 GLN HB3 . . 5.380 5.060 4.087 5.558 0.178 4 0 "[ . 1 . 2]" 1
123 1 20 THR MG 1 22 PHE H . . 4.490 3.364 2.161 4.591 0.101 16 0 "[ . 1 . 2]" 1
124 1 21 GLN H 1 21 GLN HA . . 2.890 2.687 2.102 2.958 0.068 11 0 "[ . 1 . 2]" 1
125 1 21 GLN H 1 21 GLN HB3 . . 3.850 3.284 2.534 3.848 . 0 0 "[ . 1 . 2]" 1
126 1 21 GLN H 1 21 GLN QE . . 5.260 3.031 1.938 4.358 . 0 0 "[ . 1 . 2]" 1
127 1 21 GLN H 1 21 GLN QG . . 3.630 3.320 2.765 3.765 0.135 14 0 "[ . 1 . 2]" 1
128 1 21 GLN H 1 22 PHE HB2 . . 5.500 4.534 3.063 5.485 . 0 0 "[ . 1 . 2]" 1
129 1 21 GLN H 1 22 PHE HB3 . . 5.410 5.025 4.042 5.559 0.149 15 0 "[ . 1 . 2]" 1
130 1 21 GLN HA 1 21 GLN QE . . 5.500 4.091 2.019 4.653 . 0 0 "[ . 1 . 2]" 1
131 1 21 GLN HA 1 22 PHE H . . 3.030 2.896 2.173 3.116 0.086 7 0 "[ . 1 . 2]" 1
132 1 21 GLN QE 1 22 PHE HA . . 5.500 3.643 2.478 5.349 . 0 0 "[ . 1 . 2]" 1
133 1 21 GLN QE 1 23 THR H . . 5.220 4.366 2.272 5.132 . 0 0 "[ . 1 . 2]" 1
134 1 22 PHE H 1 22 PHE HB2 . . 3.490 2.678 1.944 3.823 0.333 3 0 "[ . 1 . 2]" 1
135 1 22 PHE H 1 22 PHE HB3 . . 3.760 2.822 2.024 3.598 . 0 0 "[ . 1 . 2]" 1
136 1 22 PHE H 1 22 PHE QD . . 4.200 3.959 3.036 4.287 0.087 10 0 "[ . 1 . 2]" 1
137 1 22 PHE H 1 23 THR H . . 4.460 3.995 2.581 4.539 0.079 6 0 "[ . 1 . 2]" 1
138 1 22 PHE H 1 23 THR MG . . 5.500 5.085 3.609 5.603 0.103 12 0 "[ . 1 . 2]" 1
139 1 22 PHE HA 1 22 PHE HB2 . . 2.960 2.561 2.205 3.024 0.064 18 0 "[ . 1 . 2]" 1
140 1 22 PHE HA 1 22 PHE QD . . 3.950 2.772 2.195 3.740 . 0 0 "[ . 1 . 2]" 1
141 1 22 PHE HA 1 23 THR H . . 3.070 2.360 1.953 3.089 0.019 18 0 "[ . 1 . 2]" 1
142 1 22 PHE HA 1 23 THR HA . . 4.490 4.417 4.075 4.576 0.086 18 0 "[ . 1 . 2]" 1
143 1 22 PHE HB2 1 23 THR H . . 4.250 3.901 2.642 4.560 0.310 8 0 "[ . 1 . 2]" 1
144 1 22 PHE HB3 1 23 THR H . . 4.240 3.820 2.520 4.331 0.091 12 0 "[ . 1 . 2]" 1
145 1 22 PHE QD 1 23 THR H . . 4.910 3.527 1.745 4.981 0.071 20 0 "[ . 1 . 2]" 1
146 1 23 THR H 1 23 THR HB . . 3.860 3.478 2.340 3.931 0.071 5 0 "[ . 1 . 2]" 1
147 1 23 THR H 1 23 THR MG . . 4.050 3.177 2.287 3.970 . 0 0 "[ . 1 . 2]" 1
148 1 23 THR HA 1 23 THR MG . . 3.520 2.528 2.134 3.294 . 0 0 "[ . 1 . 2]" 1
149 1 23 THR HA 1 24 ASN H . . 3.340 2.686 2.135 3.430 0.090 6 0 "[ . 1 . 2]" 1
150 1 23 THR MG 1 24 ASN H . . 4.650 3.646 2.431 4.485 . 0 0 "[ . 1 . 2]" 1
151 1 24 ASN H 1 24 ASN QB . . 3.480 2.560 2.079 3.081 . 0 0 "[ . 1 . 2]" 1
152 1 24 ASN H 1 24 ASN HD21 . . 4.920 4.267 1.722 4.997 0.077 4 0 "[ . 1 . 2]" 1
153 1 24 ASN H 1 25 ALA HA . . 5.210 4.905 3.669 5.300 0.090 5 0 "[ . 1 . 2]" 1
154 1 24 ASN H 1 25 ALA MB . . 5.420 4.510 3.527 5.514 0.094 9 0 "[ . 1 . 2]" 1
155 1 24 ASN HA 1 24 ASN HD21 . . 4.900 2.681 1.885 3.812 . 0 0 "[ . 1 . 2]" 1
156 1 24 ASN HA 1 25 ALA H . . 3.310 2.432 2.069 3.381 0.071 3 0 "[ . 1 . 2]" 1
157 1 24 ASN HA 1 25 ALA HA . . 4.410 4.387 3.915 4.507 0.097 3 0 "[ . 1 . 2]" 1
158 1 24 ASN HA 1 27 LYS H . . 4.260 4.238 3.978 4.373 0.113 10 0 "[ . 1 . 2]" 1
159 1 24 ASN HA 1 27 LYS QD . . 5.060 4.977 3.928 5.156 0.096 2 0 "[ . 1 . 2]" 1
160 1 24 ASN HA 1 28 VAL H . . 5.480 5.485 5.254 5.561 0.081 1 0 "[ . 1 . 2]" 1
161 1 24 ASN QB 1 27 LYS H . . 5.390 4.754 3.961 5.491 0.101 3 0 "[ . 1 . 2]" 1
162 1 24 ASN HD21 1 25 ALA H . . 5.090 3.923 2.807 4.738 . 0 0 "[ . 1 . 2]" 1
163 1 24 ASN HD21 1 25 ALA HA . . 5.390 4.917 3.546 5.758 0.368 12 0 "[ . 1 . 2]" 1
164 1 24 ASN HD21 1 25 ALA MB . . 5.500 5.142 4.513 5.557 0.057 6 0 "[ . 1 . 2]" 1
165 1 24 ASN HD21 1 27 LYS QD . . 5.420 4.002 2.415 5.134 . 0 0 "[ . 1 . 2]" 1
166 1 24 ASN HD21 1 27 LYS QG . . 5.500 2.930 2.019 3.975 . 0 0 "[ . 1 . 2]" 1
167 1 24 ASN HD21 1 28 VAL H . . 5.500 4.942 4.166 5.546 0.046 6 0 "[ . 1 . 2]" 1
168 1 24 ASN HD22 1 27 LYS QB . . 5.500 3.835 1.976 5.013 . 0 0 "[ . 1 . 2]" 1
169 1 24 ASN HD22 1 27 LYS QG . . 5.500 3.110 1.889 4.713 . 0 0 "[ . 1 . 2]" 1
170 1 25 ALA H 1 25 ALA MB . . 3.130 2.366 2.221 2.576 . 0 0 "[ . 1 . 2]" 1
171 1 25 ALA H 1 26 ASP H . . 3.780 2.275 1.747 2.875 . 0 0 "[ . 1 . 2]" 1
172 1 25 ALA H 1 27 LYS QG . . 5.500 4.687 4.088 5.310 . 0 0 "[ . 1 . 2]" 1
173 1 25 ALA HA 1 28 VAL HB . . 4.140 2.423 2.122 2.682 . 0 0 "[ . 1 . 2]" 1
174 1 25 ALA HA 1 28 VAL MG1 . . 4.810 3.689 3.306 4.094 . 0 0 "[ . 1 . 2]" 1
175 1 25 ALA HA 1 28 VAL MG2 . . 4.340 2.819 2.253 3.400 . 0 0 "[ . 1 . 2]" 1
176 1 25 ALA MB 1 26 ASP H . . 3.840 2.884 2.657 3.503 . 0 0 "[ . 1 . 2]" 1
177 1 25 ALA MB 1 26 ASP QB . . 4.670 4.237 3.948 4.702 0.032 4 0 "[ . 1 . 2]" 1
178 1 25 ALA MB 1 27 LYS H . . 5.420 4.955 4.544 5.257 . 0 0 "[ . 1 . 2]" 1
179 1 25 ALA MB 1 28 VAL HB . . 3.910 3.585 2.519 3.975 0.065 14 0 "[ . 1 . 2]" 1
180 1 25 ALA MB 1 28 VAL MG1 . . 4.200 4.099 3.098 4.302 0.102 6 0 "[ . 1 . 2]" 1
181 1 25 ALA MB 1 28 VAL MG2 . . 5.360 4.033 3.263 4.578 . 0 0 "[ . 1 . 2]" 1
182 1 25 ALA MB 1 29 ASN H . . 5.500 4.147 3.538 4.540 . 0 0 "[ . 1 . 2]" 1
183 1 26 ASP H 1 26 ASP QB . . 3.180 2.185 1.868 2.704 . 0 0 "[ . 1 . 2]" 1
184 1 26 ASP H 1 27 LYS H . . 3.440 2.926 2.729 3.226 . 0 0 "[ . 1 . 2]" 1
185 1 26 ASP H 1 27 LYS QB . . 5.300 5.088 4.904 5.143 . 0 0 "[ . 1 . 2]" 1
186 1 26 ASP H 1 28 VAL MG2 . . 5.260 4.934 4.454 5.334 0.074 6 0 "[ . 1 . 2]" 1
187 1 26 ASP H 1 29 ASN H . . 4.880 4.796 4.634 4.943 0.063 6 0 "[ . 1 . 2]" 1
188 1 26 ASP QB 1 27 LYS H . . 3.790 2.391 2.051 2.777 . 0 0 "[ . 1 . 2]" 1
189 1 26 ASP QB 1 27 LYS QG . . 4.680 4.122 3.211 4.581 . 0 0 "[ . 1 . 2]" 1
190 1 27 LYS H 1 27 LYS QB . . 3.500 2.476 2.164 2.729 . 0 0 "[ . 1 . 2]" 1
191 1 27 LYS H 1 27 LYS QD . . 4.540 4.149 3.866 4.476 . 0 0 "[ . 1 . 2]" 1
192 1 27 LYS H 1 27 LYS QG . . 3.940 2.370 1.986 2.686 . 0 0 "[ . 1 . 2]" 1
193 1 27 LYS H 1 28 VAL MG2 . . 4.920 4.201 3.874 4.502 . 0 0 "[ . 1 . 2]" 1
194 1 27 LYS HA 1 27 LYS QG . . 3.950 3.353 2.576 3.524 . 0 0 "[ . 1 . 2]" 1
195 1 27 LYS QD 1 93 GLN HA . . 5.420 4.644 3.110 5.497 0.077 6 0 "[ . 1 . 2]" 1
196 1 27 LYS QD 1 93 GLN HE21 . . 5.240 4.824 3.233 5.337 0.097 20 0 "[ . 1 . 2]" 1
197 1 27 LYS QD 1 93 GLN QG . . 4.750 3.780 2.585 4.637 . 0 0 "[ . 1 . 2]" 1
198 1 28 VAL H 1 28 VAL HB . . 3.470 2.359 2.168 2.507 . 0 0 "[ . 1 . 2]" 1
199 1 28 VAL H 1 28 VAL MG2 . . 3.670 2.558 2.173 2.893 . 0 0 "[ . 1 . 2]" 1
200 1 28 VAL H 1 29 ASN H . . 3.700 2.446 1.971 2.806 . 0 0 "[ . 1 . 2]" 1
201 1 28 VAL HA 1 30 GLU QB . . 5.470 4.676 3.588 5.307 . 0 0 "[ . 1 . 2]" 1
202 1 28 VAL HA 1 31 TYR H . . 4.660 3.738 3.495 3.933 . 0 0 "[ . 1 . 2]" 1
203 1 28 VAL HA 1 92 PHE QD . . 4.460 4.094 3.301 4.582 0.122 18 0 "[ . 1 . 2]" 1
204 1 28 VAL HB 1 29 ASN H . . 3.630 2.526 2.286 2.993 . 0 0 "[ . 1 . 2]" 1
205 1 28 VAL HB 1 29 ASN HB3 . . 5.380 4.486 4.000 5.163 . 0 0 "[ . 1 . 2]" 1
206 1 28 VAL MG1 1 29 ASN H . . 3.910 3.076 2.768 3.640 . 0 0 "[ . 1 . 2]" 1
207 1 28 VAL MG1 1 29 ASN HA . . 3.910 3.260 2.994 3.704 . 0 0 "[ . 1 . 2]" 1
208 1 28 VAL MG1 1 30 GLU H . . 4.740 4.816 4.650 4.846 0.106 12 0 "[ . 1 . 2]" 1
209 1 28 VAL MG1 1 31 TYR QB . . 5.500 4.160 3.124 5.269 . 0 0 "[ . 1 . 2]" 1
210 1 28 VAL MG1 1 32 LEU H . . 5.500 3.974 3.624 4.197 . 0 0 "[ . 1 . 2]" 1
211 1 28 VAL MG1 1 89 VAL H . . 5.500 5.073 4.496 5.588 0.088 2 0 "[ . 1 . 2]" 1
212 1 28 VAL MG1 1 89 VAL HA . . 4.840 4.337 3.715 4.946 0.106 2 0 "[ . 1 . 2]" 1
213 1 28 VAL MG1 1 89 VAL HB . . 4.710 3.144 2.200 3.945 . 0 0 "[ . 1 . 2]" 1
214 1 28 VAL MG1 1 89 VAL QG . . 3.480 1.923 1.744 2.133 . 0 0 "[ . 1 . 2]" 1
215 1 28 VAL MG1 1 93 GLN HE21 . . 5.210 4.885 3.092 5.773 0.563 7 2 "[ . +- 1 . 2]" 1
216 1 28 VAL MG1 1 113 PRO QD . . 5.380 5.144 3.879 5.503 0.123 14 0 "[ . 1 . 2]" 1
217 1 28 VAL MG2 1 29 ASN H . . 5.350 3.927 3.769 4.072 . 0 0 "[ . 1 . 2]" 1
218 1 28 VAL MG2 1 29 ASN HA . . 5.500 5.441 5.258 5.576 0.076 13 0 "[ . 1 . 2]" 1
219 1 28 VAL MG2 1 89 VAL HA . . 5.500 4.647 3.927 5.156 . 0 0 "[ . 1 . 2]" 1
220 1 28 VAL MG2 1 92 PHE QD . . 4.440 4.314 3.386 4.555 0.115 11 0 "[ . 1 . 2]" 1
221 1 28 VAL MG2 1 93 GLN HE21 . . 4.480 3.280 2.387 4.484 0.004 8 0 "[ . 1 . 2]" 1
222 1 28 VAL MG2 1 93 GLN HE22 . . 5.140 3.168 1.916 4.893 . 0 0 "[ . 1 . 2]" 1
223 1 29 ASN H 1 29 ASN HA . . 2.840 2.787 2.703 2.846 0.006 6 0 "[ . 1 . 2]" 1
224 1 29 ASN H 1 29 ASN HB2 . . 3.440 3.056 2.408 3.613 0.173 9 0 "[ . 1 . 2]" 1
225 1 29 ASN H 1 29 ASN HB3 . . 3.730 2.346 2.168 2.531 . 0 0 "[ . 1 . 2]" 1
226 1 29 ASN H 1 29 ASN HD21 . . 4.610 3.967 2.757 4.683 0.073 12 0 "[ . 1 . 2]" 1
227 1 29 ASN H 1 30 GLU H . . 3.570 2.813 2.530 2.978 . 0 0 "[ . 1 . 2]" 1
228 1 29 ASN H 1 30 GLU QB . . 5.210 4.626 3.851 5.053 . 0 0 "[ . 1 . 2]" 1
229 1 29 ASN H 1 31 TYR H . . 4.880 4.643 4.305 4.956 0.076 20 0 "[ . 1 . 2]" 1
230 1 29 ASN H 1 32 LEU HG . . 5.170 4.588 4.185 5.250 0.080 3 0 "[ . 1 . 2]" 1
231 1 29 ASN HA 1 29 ASN HD22 . . 5.500 4.844 4.475 5.142 . 0 0 "[ . 1 . 2]" 1
232 1 29 ASN HA 1 31 TYR H . . 5.330 4.472 4.155 4.840 . 0 0 "[ . 1 . 2]" 1
233 1 29 ASN HA 1 32 LEU HA . . 5.360 5.040 4.749 5.390 0.030 7 0 "[ . 1 . 2]" 1
234 1 29 ASN HA 1 32 LEU HB2 . . 4.540 2.280 2.048 2.626 . 0 0 "[ . 1 . 2]" 1
235 1 29 ASN HA 1 32 LEU HB3 . . 4.170 3.923 3.688 4.227 0.057 7 0 "[ . 1 . 2]" 1
236 1 29 ASN HA 1 32 LEU QD . . 4.270 2.735 2.450 3.315 . 0 0 "[ . 1 . 2]" 1
237 1 29 ASN HA 1 33 ALA H . . 5.270 3.804 3.533 4.058 . 0 0 "[ . 1 . 2]" 1
238 1 29 ASN HB2 1 32 LEU QD . . 4.540 4.108 3.743 4.449 . 0 0 "[ . 1 . 2]" 1
239 1 29 ASN HB3 1 30 GLU H . . 4.040 3.371 2.494 4.190 0.150 9 0 "[ . 1 . 2]" 1
240 1 29 ASN HD21 1 30 GLU H . . 5.500 2.966 2.228 3.700 . 0 0 "[ . 1 . 2]" 1
241 1 29 ASN HD21 1 30 GLU QB . . 5.500 4.259 3.255 5.127 . 0 0 "[ . 1 . 2]" 1
242 1 29 ASN HD21 1 30 GLU HG2 . . 5.020 4.165 2.417 5.077 0.057 18 0 "[ . 1 . 2]" 1
243 1 29 ASN HD21 1 33 ALA MB . . 5.500 4.232 3.110 5.610 0.110 4 0 "[ . 1 . 2]" 1
244 1 29 ASN HD22 1 30 GLU H . . 4.940 4.077 3.214 5.010 0.070 6 0 "[ . 1 . 2]" 1
245 1 29 ASN HD22 1 30 GLU HG2 . . 5.500 4.724 2.850 5.586 0.086 18 0 "[ . 1 . 2]" 1
246 1 30 GLU H 1 30 GLU QB . . 3.190 2.277 1.927 2.560 . 0 0 "[ . 1 . 2]" 1
247 1 30 GLU H 1 30 GLU HG2 . . 4.180 3.439 2.125 4.225 0.045 2 0 "[ . 1 . 2]" 1
248 1 30 GLU H 1 30 GLU HG3 . . 4.140 3.265 2.140 4.233 0.093 20 0 "[ . 1 . 2]" 1
249 1 30 GLU H 1 31 TYR H . . 3.600 2.908 2.566 3.234 . 0 0 "[ . 1 . 2]" 1
250 1 30 GLU H 1 31 TYR HA . . 5.500 5.468 5.225 5.556 0.056 6 0 "[ . 1 . 2]" 1
251 1 30 GLU QB 1 31 TYR H . . 3.840 2.421 1.919 3.063 . 0 0 "[ . 1 . 2]" 1
252 1 30 GLU QB 1 31 TYR HA . . 4.700 3.915 3.553 4.397 . 0 0 "[ . 1 . 2]" 1
253 1 30 GLU HG3 1 31 TYR H . . 5.000 4.518 1.835 5.072 0.072 10 0 "[ . 1 . 2]" 1
254 1 31 TYR H 1 31 TYR QB . . 3.330 2.283 2.032 2.946 . 0 0 "[ . 1 . 2]" 1
255 1 31 TYR H 1 31 TYR QD . . 4.480 3.863 2.532 4.292 . 0 0 "[ . 1 . 2]" 1
256 1 31 TYR H 1 32 LEU H . . 3.850 2.616 2.353 2.824 . 0 0 "[ . 1 . 2]" 1
257 1 31 TYR H 1 32 LEU HA . . 5.500 5.278 5.056 5.459 . 0 0 "[ . 1 . 2]" 1
258 1 31 TYR H 1 32 LEU QD . . 4.920 4.473 3.599 4.756 . 0 0 "[ . 1 . 2]" 1
259 1 31 TYR H 1 33 ALA H . . 4.820 4.125 3.848 4.448 . 0 0 "[ . 1 . 2]" 1
260 1 31 TYR H 1 92 PHE QD . . 5.500 5.292 4.283 5.597 0.097 6 0 "[ . 1 . 2]" 1
261 1 31 TYR HA 1 31 TYR QD . . 3.970 2.806 2.147 3.506 . 0 0 "[ . 1 . 2]" 1
262 1 31 TYR HA 1 34 GLN H . . 4.810 3.508 3.148 3.807 . 0 0 "[ . 1 . 2]" 1
263 1 31 TYR HA 1 34 GLN HB2 . . 5.500 3.594 2.325 5.019 . 0 0 "[ . 1 . 2]" 1
264 1 31 TYR HA 1 34 GLN HG2 . . 5.500 4.122 2.071 6.048 0.548 19 1 "[ . 1 . +2]" 1
265 1 31 TYR QB 1 32 LEU H . . 3.950 2.616 2.273 3.348 . 0 0 "[ . 1 . 2]" 1
266 1 31 TYR QB 1 32 LEU HA . . 5.500 3.981 3.456 4.286 . 0 0 "[ . 1 . 2]" 1
267 1 31 TYR QB 1 32 LEU HG . . 5.110 3.826 3.189 5.051 . 0 0 "[ . 1 . 2]" 1
268 1 31 TYR QB 1 33 ALA H . . 5.030 4.691 4.492 4.843 . 0 0 "[ . 1 . 2]" 1
269 1 31 TYR QD 1 32 LEU H . . 4.900 3.906 3.015 4.414 . 0 0 "[ . 1 . 2]" 1
270 1 31 TYR QD 1 32 LEU HA . . 4.580 4.008 2.811 4.681 0.101 20 0 "[ . 1 . 2]" 1
271 1 31 TYR QD 1 32 LEU QD . . 3.370 3.057 2.340 3.453 0.083 7 0 "[ . 1 . 2]" 1
272 1 31 TYR QD 1 32 LEU HG . . 5.500 4.622 2.579 5.463 . 0 0 "[ . 1 . 2]" 1
273 1 31 TYR QD 1 92 PHE QD . . 4.300 3.292 2.350 3.950 . 0 0 "[ . 1 . 2]" 1
274 1 32 LEU H 1 32 LEU HB2 . . 3.700 2.583 2.485 2.647 . 0 0 "[ . 1 . 2]" 1
275 1 32 LEU H 1 32 LEU QD . . 4.190 2.812 2.091 3.045 . 0 0 "[ . 1 . 2]" 1
276 1 32 LEU H 1 32 LEU HG . . 4.630 2.518 2.165 3.944 . 0 0 "[ . 1 . 2]" 1
277 1 32 LEU H 1 33 ALA H . . 4.020 2.725 2.624 2.845 . 0 0 "[ . 1 . 2]" 1
278 1 32 LEU HA 1 32 LEU QD . . 3.760 2.070 1.982 2.171 . 0 0 "[ . 1 . 2]" 1
279 1 32 LEU HA 1 35 HIS H . . 4.600 3.829 3.578 4.181 . 0 0 "[ . 1 . 2]" 1
280 1 32 LEU HA 1 35 HIS HB2 . . 5.490 4.175 3.070 5.831 0.341 7 0 "[ . 1 . 2]" 1
281 1 32 LEU HA 1 39 ILE MD . . 4.540 2.449 2.048 3.081 . 0 0 "[ . 1 . 2]" 1
282 1 32 LEU HA 1 85 ARG HA . . 5.500 5.159 4.545 5.520 0.020 20 0 "[ . 1 . 2]" 1
283 1 32 LEU HA 1 85 ARG QB . . 5.400 4.874 3.582 5.309 . 0 0 "[ . 1 . 2]" 1
284 1 32 LEU HB2 1 33 ALA H . . 4.310 2.838 2.389 3.191 . 0 0 "[ . 1 . 2]" 1
285 1 32 LEU HB2 1 33 ALA MB . . 3.930 3.954 3.744 4.035 0.105 14 0 "[ . 1 . 2]" 1
286 1 32 LEU HB2 1 39 ILE MD . . 5.500 4.588 4.216 5.233 . 0 0 "[ . 1 . 2]" 1
287 1 32 LEU HB3 1 85 ARG QG . . 4.790 4.056 2.479 4.878 0.088 2 0 "[ . 1 . 2]" 1
288 1 32 LEU QD 1 33 ALA H . . 5.010 4.162 3.963 4.343 . 0 0 "[ . 1 . 2]" 1
289 1 32 LEU QD 1 39 ILE MD . . 3.930 2.291 1.903 2.857 . 0 0 "[ . 1 . 2]" 1
290 1 32 LEU QD 1 85 ARG HA . . 4.770 2.968 2.129 3.710 . 0 0 "[ . 1 . 2]" 1
291 1 32 LEU QD 1 85 ARG QB . . 3.940 2.714 1.857 3.546 . 0 0 "[ . 1 . 2]" 1
292 1 32 LEU QD 1 85 ARG QD . . 4.310 2.232 1.737 3.477 . 0 0 "[ . 1 . 2]" 1
293 1 32 LEU QD 1 85 ARG HE . . 5.050 3.698 2.846 4.270 . 0 0 "[ . 1 . 2]" 1
294 1 32 LEU QD 1 86 ASN H . . 5.500 4.639 4.219 5.080 . 0 0 "[ . 1 . 2]" 1
295 1 32 LEU QD 1 86 ASN HA . . 4.900 4.253 3.700 4.781 . 0 0 "[ . 1 . 2]" 1
296 1 32 LEU QD 1 88 TYR H . . 5.500 5.043 4.102 5.582 0.082 9 0 "[ . 1 . 2]" 1
297 1 32 LEU QD 1 89 VAL H . . 5.500 3.512 2.334 4.055 . 0 0 "[ . 1 . 2]" 1
298 1 32 LEU QD 1 89 VAL HA . . 5.300 3.978 3.031 4.436 . 0 0 "[ . 1 . 2]" 1
299 1 32 LEU QD 1 89 VAL HB . . 4.900 2.800 1.922 4.053 . 0 0 "[ . 1 . 2]" 1
300 1 32 LEU QD 1 89 VAL QG . . 4.290 2.376 1.741 3.201 . 0 0 "[ . 1 . 2]" 1
301 1 33 ALA H 1 33 ALA MB . . 2.930 2.230 2.110 2.291 . 0 0 "[ . 1 . 2]" 1
302 1 33 ALA H 1 34 GLN H . . 3.860 2.563 2.302 2.817 . 0 0 "[ . 1 . 2]" 1
303 1 33 ALA H 1 35 HIS H . . 5.200 3.994 3.637 4.399 . 0 0 "[ . 1 . 2]" 1
304 1 33 ALA HA 1 35 HIS H . . 4.550 4.414 4.039 4.606 0.056 7 0 "[ . 1 . 2]" 1
305 1 33 ALA HA 1 36 ASP H . . 4.150 3.631 3.321 4.073 . 0 0 "[ . 1 . 2]" 1
306 1 33 ALA HA 1 36 ASP HB2 . . 4.280 3.042 2.181 4.333 0.053 10 0 "[ . 1 . 2]" 1
307 1 33 ALA MB 1 34 GLN H . . 3.850 2.425 2.249 2.738 . 0 0 "[ . 1 . 2]" 1
308 1 33 ALA MB 1 34 GLN HA . . 5.470 3.835 3.630 4.081 . 0 0 "[ . 1 . 2]" 1
309 1 33 ALA MB 1 34 GLN HE21 . . 5.500 4.730 2.522 5.600 0.100 3 0 "[ . 1 . 2]" 1
310 1 33 ALA MB 1 35 HIS H . . 5.460 4.489 4.237 4.732 . 0 0 "[ . 1 . 2]" 1
311 1 33 ALA MB 1 36 ASP H . . 5.440 4.604 4.440 4.939 . 0 0 "[ . 1 . 2]" 1
312 1 34 GLN H 1 34 GLN HB2 . . 3.480 2.567 2.070 3.627 0.147 14 0 "[ . 1 . 2]" 1
313 1 34 GLN H 1 34 GLN HB3 . . 3.770 2.811 2.322 3.707 . 0 0 "[ . 1 . 2]" 1
314 1 34 GLN H 1 34 GLN HE21 . . 5.500 3.789 2.342 4.823 . 0 0 "[ . 1 . 2]" 1
315 1 34 GLN H 1 34 GLN HG2 . . 4.270 3.864 2.119 4.528 0.258 1 0 "[ . 1 . 2]" 1
316 1 34 GLN H 1 34 GLN HG3 . . 4.570 4.067 3.142 4.480 . 0 0 "[ . 1 . 2]" 1
317 1 34 GLN H 1 35 HIS H . . 3.660 2.795 2.662 2.920 . 0 0 "[ . 1 . 2]" 1
318 1 34 GLN H 1 36 ASP H . . 4.530 4.208 4.009 4.406 . 0 0 "[ . 1 . 2]" 1
319 1 34 GLN HA 1 34 GLN HG2 . . 3.980 3.374 2.416 3.851 . 0 0 "[ . 1 . 2]" 1
320 1 34 GLN HA 1 34 GLN HG3 . . 3.800 2.928 2.321 4.024 0.224 10 0 "[ . 1 . 2]" 1
321 1 34 GLN HA 1 36 ASP H . . 4.550 3.981 3.601 4.385 . 0 0 "[ . 1 . 2]" 1
322 1 34 GLN HB2 1 35 HIS H . . 4.350 3.656 2.677 4.376 0.026 14 0 "[ . 1 . 2]" 1
323 1 34 GLN HB3 1 35 HIS H . . 4.310 3.145 2.402 4.376 0.066 14 0 "[ . 1 . 2]" 1
324 1 34 GLN HE21 1 35 HIS H . . 5.420 5.180 4.561 5.507 0.087 16 0 "[ . 1 . 2]" 1
325 1 34 GLN HG3 1 35 HIS HA . . 5.500 5.198 3.888 6.480 0.980 19 4 "[ . - * . +*]" 1
326 1 35 HIS H 1 35 HIS HB2 . . 4.080 2.628 2.111 3.772 . 0 0 "[ . 1 . 2]" 1
327 1 35 HIS H 1 36 ASP H . . 3.600 2.659 2.325 2.987 . 0 0 "[ . 1 . 2]" 1
328 1 35 HIS H 1 36 ASP HA . . 4.700 4.595 4.339 4.771 0.071 6 0 "[ . 1 . 2]" 1
329 1 35 HIS H 1 36 ASP HB3 . . 4.820 4.911 4.009 5.610 0.790 7 3 "[ . + 1* . - 2]" 1
330 1 35 HIS H 1 37 GLY H . . 5.040 5.047 4.701 5.122 0.082 13 0 "[ . 1 . 2]" 1
331 1 35 HIS H 1 39 ILE MD . . 5.500 4.027 3.564 5.184 . 0 0 "[ . 1 . 2]" 1
332 1 35 HIS HA 1 37 GLY H . . 4.870 3.623 3.147 4.030 . 0 0 "[ . 1 . 2]" 1
333 1 35 HIS HA 1 38 GLU H . . 4.460 3.394 3.141 3.870 . 0 0 "[ . 1 . 2]" 1
334 1 35 HIS HA 1 39 ILE H . . 4.590 4.512 4.129 4.666 0.076 20 0 "[ . 1 . 2]" 1
335 1 35 HIS HB2 1 39 ILE MD . . 4.960 3.305 2.299 4.573 . 0 0 "[ . 1 . 2]" 1
336 1 35 HIS HB2 1 39 ILE QG . . 5.500 3.608 2.783 4.550 . 0 0 "[ . 1 . 2]" 1
337 1 35 HIS HB3 1 36 ASP H . . 5.500 4.368 3.592 4.668 . 0 0 "[ . 1 . 2]" 1
338 1 36 ASP H 1 36 ASP HB2 . . 3.530 2.867 2.158 3.585 0.055 14 0 "[ . 1 . 2]" 1
339 1 36 ASP H 1 36 ASP HB3 . . 3.500 2.470 2.190 2.928 . 0 0 "[ . 1 . 2]" 1
340 1 36 ASP H 1 37 GLY H . . 4.070 2.823 2.636 2.977 . 0 0 "[ . 1 . 2]" 1
341 1 36 ASP H 1 38 GLU H . . 5.300 4.542 4.169 5.022 . 0 0 "[ . 1 . 2]" 1
342 1 36 ASP H 1 39 ILE H . . 5.500 4.938 4.819 5.111 . 0 0 "[ . 1 . 2]" 1
343 1 36 ASP H 1 39 ILE MD . . 5.500 4.035 3.414 5.576 0.076 14 0 "[ . 1 . 2]" 1
344 1 36 ASP HA 1 39 ILE HB . . 4.390 2.711 2.346 3.143 . 0 0 "[ . 1 . 2]" 1
345 1 36 ASP HA 1 39 ILE MD . . 4.250 2.692 2.102 4.261 0.011 14 0 "[ . 1 . 2]" 1
346 1 36 ASP HA 1 39 ILE MG . . 4.800 4.005 3.576 4.286 . 0 0 "[ . 1 . 2]" 1
347 1 36 ASP HA 1 40 ARG H . . 4.740 3.761 3.430 4.104 . 0 0 "[ . 1 . 2]" 1
348 1 36 ASP HB2 1 37 GLY H . . 4.100 4.025 3.698 4.183 0.083 13 0 "[ . 1 . 2]" 1
349 1 36 ASP HB3 1 37 GLY H . . 4.410 3.101 2.412 3.996 . 0 0 "[ . 1 . 2]" 1
350 1 37 GLY H 1 38 GLU H . . 3.780 2.791 2.582 3.038 . 0 0 "[ . 1 . 2]" 1
351 1 37 GLY H 1 38 GLU HA . . 5.500 5.394 5.207 5.564 0.064 15 0 "[ . 1 . 2]" 1
352 1 37 GLY H 1 38 GLU QB . . 5.500 4.497 4.213 4.972 . 0 0 "[ . 1 . 2]" 1
353 1 37 GLY H 1 39 ILE H . . 5.040 4.227 3.937 4.511 . 0 0 "[ . 1 . 2]" 1
354 1 37 GLY H 1 40 ARG H . . 5.500 4.688 4.451 4.819 . 0 0 "[ . 1 . 2]" 1
355 1 37 GLY HA2 1 40 ARG H . . 5.500 3.795 3.124 4.275 . 0 0 "[ . 1 . 2]" 1
356 1 37 GLY HA2 1 41 ALA MB . . 4.330 4.263 3.964 4.428 0.098 20 0 "[ . 1 . 2]" 1
357 1 37 GLY HA3 1 39 ILE H . . 5.180 4.825 4.614 5.096 . 0 0 "[ . 1 . 2]" 1
358 1 38 GLU H 1 38 GLU QB . . 3.300 2.220 2.118 2.422 . 0 0 "[ . 1 . 2]" 1
359 1 38 GLU H 1 38 GLU HG2 . . 5.190 4.296 2.782 4.571 . 0 0 "[ . 1 . 2]" 1
360 1 38 GLU H 1 38 GLU HG3 . . 4.540 4.403 3.977 4.499 . 0 0 "[ . 1 . 2]" 1
361 1 38 GLU H 1 39 ILE H . . 3.580 2.669 2.368 2.891 . 0 0 "[ . 1 . 2]" 1
362 1 38 GLU H 1 39 ILE HB . . 5.100 4.788 4.455 5.153 0.053 9 0 "[ . 1 . 2]" 1
363 1 38 GLU H 1 39 ILE QG . . 5.500 4.278 3.891 4.650 . 0 0 "[ . 1 . 2]" 1
364 1 38 GLU H 1 40 ARG H . . 4.900 4.249 3.963 4.582 . 0 0 "[ . 1 . 2]" 1
365 1 38 GLU H 1 41 ALA MB . . 5.480 4.570 4.297 4.851 . 0 0 "[ . 1 . 2]" 1
366 1 38 GLU HA 1 38 GLU HG2 . . 3.660 3.433 3.114 3.743 0.083 14 0 "[ . 1 . 2]" 1
367 1 38 GLU HA 1 38 GLU HG3 . . 3.940 2.627 2.349 3.608 . 0 0 "[ . 1 . 2]" 1
368 1 38 GLU HA 1 41 ALA MB . . 3.380 2.607 2.145 3.100 . 0 0 "[ . 1 . 2]" 1
369 1 38 GLU HA 1 42 GLU H . . 4.000 3.907 3.711 4.064 0.064 14 0 "[ . 1 . 2]" 1
370 1 38 GLU QB 1 39 ILE H . . 4.160 2.559 2.301 3.514 . 0 0 "[ . 1 . 2]" 1
371 1 38 GLU QB 1 41 ALA MB . . 5.290 4.326 3.634 4.745 . 0 0 "[ . 1 . 2]" 1
372 1 38 GLU HG2 1 39 ILE H . . 4.590 3.601 2.355 4.559 . 0 0 "[ . 1 . 2]" 1
373 1 38 GLU HG2 1 39 ILE QG . . 4.830 3.757 2.642 4.623 . 0 0 "[ . 1 . 2]" 1
374 1 38 GLU HG3 1 42 GLU H . . 4.850 4.567 3.939 4.905 0.055 19 0 "[ . 1 . 2]" 1
375 1 38 GLU HG3 1 42 GLU QB . . 4.260 3.824 2.962 4.208 . 0 0 "[ . 1 . 2]" 1
376 1 39 ILE H 1 39 ILE HB . . 4.130 2.505 2.299 2.783 . 0 0 "[ . 1 . 2]" 1
377 1 39 ILE H 1 39 ILE MD . . 4.530 3.478 3.290 3.925 . 0 0 "[ . 1 . 2]" 1
378 1 39 ILE H 1 39 ILE QG . . 4.790 2.151 1.925 2.290 . 0 0 "[ . 1 . 2]" 1
379 1 39 ILE H 1 39 ILE MG . . 4.710 3.789 3.713 3.830 . 0 0 "[ . 1 . 2]" 1
380 1 39 ILE H 1 40 ARG H . . 4.100 2.840 2.699 2.982 . 0 0 "[ . 1 . 2]" 1
381 1 39 ILE H 1 41 ALA MB . . 5.140 4.793 4.592 5.036 . 0 0 "[ . 1 . 2]" 1
382 1 39 ILE H 1 42 GLU QB . . 5.450 4.869 4.557 5.369 . 0 0 "[ . 1 . 2]" 1
383 1 39 ILE H 1 84 VAL QG . . 5.500 4.308 3.999 4.664 . 0 0 "[ . 1 . 2]" 1
384 1 39 ILE HA 1 41 ALA H . . 4.860 4.490 4.208 4.750 . 0 0 "[ . 1 . 2]" 1
385 1 39 ILE HA 1 42 GLU H . . 4.320 3.660 3.392 3.869 . 0 0 "[ . 1 . 2]" 1
386 1 39 ILE HA 1 42 GLU QB . . 5.480 2.958 2.613 3.971 . 0 0 "[ . 1 . 2]" 1
387 1 39 ILE HA 1 43 ALA H . . 5.250 3.958 3.701 4.222 . 0 0 "[ . 1 . 2]" 1
388 1 39 ILE HA 1 84 VAL QG . . 3.960 2.180 1.881 2.590 . 0 0 "[ . 1 . 2]" 1
389 1 39 ILE HB 1 40 ARG H . . 4.070 2.510 2.344 2.872 . 0 0 "[ . 1 . 2]" 1
390 1 39 ILE MD 1 84 VAL QG . . 5.500 3.553 2.627 3.822 . 0 0 "[ . 1 . 2]" 1
391 1 39 ILE MD 1 85 ARG H . . 5.500 4.251 3.797 4.739 . 0 0 "[ . 1 . 2]" 1
392 1 39 ILE MD 1 85 ARG HA . . 4.540 2.629 2.120 3.191 . 0 0 "[ . 1 . 2]" 1
393 1 39 ILE MD 1 85 ARG QB . . 4.580 2.602 1.996 3.353 . 0 0 "[ . 1 . 2]" 1
394 1 39 ILE QG 1 40 ARG H . . 5.500 4.105 3.838 4.222 . 0 0 "[ . 1 . 2]" 1
395 1 39 ILE QG 1 84 VAL QG . . 3.830 2.429 2.138 2.888 . 0 0 "[ . 1 . 2]" 1
396 1 39 ILE MG 1 40 ARG H . . 4.690 3.314 2.997 3.679 . 0 0 "[ . 1 . 2]" 1
397 1 39 ILE MG 1 40 ARG HA . . 4.890 3.378 2.866 3.784 . 0 0 "[ . 1 . 2]" 1
398 1 39 ILE MG 1 42 GLU H . . 4.840 4.923 4.841 4.943 0.103 13 0 "[ . 1 . 2]" 1
399 1 39 ILE MG 1 43 ALA H . . 5.500 4.046 3.801 4.295 . 0 0 "[ . 1 . 2]" 1
400 1 39 ILE MG 1 43 ALA MB . . 5.070 3.214 2.795 3.867 . 0 0 "[ . 1 . 2]" 1
401 1 39 ILE MG 1 81 PHE HA . . 4.900 3.034 2.601 3.588 . 0 0 "[ . 1 . 2]" 1
402 1 39 ILE MG 1 81 PHE QD . . 3.580 2.690 2.061 3.535 . 0 0 "[ . 1 . 2]" 1
403 1 39 ILE MG 1 84 VAL H . . 5.500 4.304 3.847 4.854 . 0 0 "[ . 1 . 2]" 1
404 1 39 ILE MG 1 84 VAL HB . . 4.120 2.988 2.068 4.233 0.113 9 0 "[ . 1 . 2]" 1
405 1 39 ILE MG 1 84 VAL QG . . 3.980 2.113 1.823 2.739 . 0 0 "[ . 1 . 2]" 1
406 1 39 ILE MG 1 85 ARG H . . 4.600 2.797 2.320 3.572 . 0 0 "[ . 1 . 2]" 1
407 1 39 ILE MG 1 85 ARG HA . . 4.060 3.005 2.452 3.499 . 0 0 "[ . 1 . 2]" 1
408 1 39 ILE MG 1 85 ARG QB . . 4.240 2.277 1.922 2.883 . 0 0 "[ . 1 . 2]" 1
409 1 39 ILE MG 1 85 ARG QD . . 5.130 4.091 2.532 5.152 0.022 10 0 "[ . 1 . 2]" 1
410 1 39 ILE MG 1 85 ARG HE . . 4.950 4.235 3.150 5.055 0.105 7 0 "[ . 1 . 2]" 1
411 1 40 ARG H 1 41 ALA H . . 3.890 2.716 2.593 2.872 . 0 0 "[ . 1 . 2]" 1
412 1 40 ARG H 1 42 GLU H . . 5.250 4.334 4.151 4.565 . 0 0 "[ . 1 . 2]" 1
413 1 40 ARG H 1 43 ALA MB . . 5.500 4.652 4.459 5.040 . 0 0 "[ . 1 . 2]" 1
414 1 40 ARG HA 1 43 ALA MB . . 4.580 2.569 2.117 2.923 . 0 0 "[ . 1 . 2]" 1
415 1 40 ARG HA 1 44 ALA MB . . 4.720 4.276 3.836 4.682 . 0 0 "[ . 1 . 2]" 1
416 1 40 ARG HA 1 81 PHE QD . . 4.550 3.202 2.124 4.636 0.086 12 0 "[ . 1 . 2]" 1
417 1 41 ALA H 1 41 ALA MB . . 3.380 2.211 2.119 2.272 . 0 0 "[ . 1 . 2]" 1
418 1 41 ALA H 1 43 ALA MB . . 5.500 4.784 4.563 5.074 . 0 0 "[ . 1 . 2]" 1
419 1 41 ALA HA 1 43 ALA MB . . 5.130 5.064 4.778 5.218 0.088 11 0 "[ . 1 . 2]" 1
420 1 41 ALA MB 1 42 GLU H . . 3.910 2.490 2.334 2.636 . 0 0 "[ . 1 . 2]" 1
421 1 41 ALA MB 1 42 GLU QB . . 4.690 3.727 3.497 3.966 . 0 0 "[ . 1 . 2]" 1
422 1 42 GLU H 1 42 GLU QG . . 4.070 3.916 2.764 4.047 . 0 0 "[ . 1 . 2]" 1
423 1 42 GLU H 1 43 ALA H . . 3.700 2.724 2.548 2.939 . 0 0 "[ . 1 . 2]" 1
424 1 42 GLU H 1 43 ALA MB . . 4.730 4.319 4.127 4.565 . 0 0 "[ . 1 . 2]" 1
425 1 42 GLU H 1 84 VAL QG . . 4.860 3.896 3.526 4.366 . 0 0 "[ . 1 . 2]" 1
426 1 42 GLU HA 1 43 ALA MB . . 5.140 5.026 4.974 5.101 . 0 0 "[ . 1 . 2]" 1
427 1 42 GLU HA 1 44 ALA H . . 5.260 4.417 4.010 4.709 . 0 0 "[ . 1 . 2]" 1
428 1 42 GLU HA 1 45 ALA H . . 4.010 3.470 3.131 3.682 . 0 0 "[ . 1 . 2]" 1
429 1 42 GLU QB 1 43 ALA H . . 3.850 2.497 2.137 3.336 . 0 0 "[ . 1 . 2]" 1
430 1 42 GLU QB 1 84 VAL QG . . 5.050 2.201 1.874 3.398 . 0 0 "[ . 1 . 2]" 1
431 1 42 GLU QG 1 43 ALA H . . 5.370 3.558 2.330 3.968 . 0 0 "[ . 1 . 2]" 1
432 1 42 GLU QG 1 43 ALA HA . . 5.500 3.865 3.191 4.247 . 0 0 "[ . 1 . 2]" 1
433 1 42 GLU QG 1 45 ALA H . . 5.490 4.993 4.563 5.383 . 0 0 "[ . 1 . 2]" 1
434 1 42 GLU QG 1 84 VAL QG . . 4.910 2.296 1.831 3.115 . 0 0 "[ . 1 . 2]" 1
435 1 43 ALA H 1 43 ALA MB . . 3.500 2.194 2.135 2.256 . 0 0 "[ . 1 . 2]" 1
436 1 43 ALA H 1 44 ALA H . . 3.110 2.783 2.584 2.947 . 0 0 "[ . 1 . 2]" 1
437 1 43 ALA H 1 44 ALA MB . . 4.670 4.475 4.288 4.624 . 0 0 "[ . 1 . 2]" 1
438 1 43 ALA H 1 45 ALA H . . 4.510 4.099 3.941 4.275 . 0 0 "[ . 1 . 2]" 1
439 1 43 ALA H 1 80 ALA MB . . 4.470 4.522 4.367 4.568 0.098 3 0 "[ . 1 . 2]" 1
440 1 43 ALA H 1 84 VAL QG . . 4.560 2.951 2.524 3.317 . 0 0 "[ . 1 . 2]" 1
441 1 43 ALA HA 1 45 ALA H . . 4.870 4.212 4.009 4.565 . 0 0 "[ . 1 . 2]" 1
442 1 43 ALA HA 1 46 ASP H . . 4.200 3.722 3.350 4.252 0.052 15 0 "[ . 1 . 2]" 1
443 1 43 ALA HA 1 80 ALA MB . . 4.120 2.212 2.081 2.481 . 0 0 "[ . 1 . 2]" 1
444 1 43 ALA HA 1 81 PHE H . . 5.200 4.641 4.038 5.242 0.042 17 0 "[ . 1 . 2]" 1
445 1 43 ALA HA 1 81 PHE HA . . 5.040 4.349 3.839 5.072 0.032 17 0 "[ . 1 . 2]" 1
446 1 43 ALA HA 1 84 VAL H . . 5.500 5.399 4.967 5.577 0.077 12 0 "[ . 1 . 2]" 1
447 1 43 ALA HA 1 84 VAL QG . . 3.910 3.145 2.547 3.843 . 0 0 "[ . 1 . 2]" 1
448 1 43 ALA MB 1 44 ALA H . . 3.780 2.641 2.343 3.065 . 0 0 "[ . 1 . 2]" 1
449 1 43 ALA MB 1 44 ALA HA . . 5.270 3.930 3.704 4.177 . 0 0 "[ . 1 . 2]" 1
450 1 43 ALA MB 1 44 ALA MB . . 5.270 3.703 3.411 4.008 . 0 0 "[ . 1 . 2]" 1
451 1 43 ALA MB 1 80 ALA MB . . 4.240 2.331 2.072 2.596 . 0 0 "[ . 1 . 2]" 1
452 1 43 ALA MB 1 81 PHE H . . 4.460 2.786 2.578 3.154 . 0 0 "[ . 1 . 2]" 1
453 1 43 ALA MB 1 81 PHE HA . . 3.740 2.137 1.944 2.640 . 0 0 "[ . 1 . 2]" 1
454 1 43 ALA MB 1 81 PHE QB . . 4.640 2.672 1.984 3.267 . 0 0 "[ . 1 . 2]" 1
455 1 43 ALA MB 1 81 PHE QD . . 4.080 3.006 2.235 4.054 . 0 0 "[ . 1 . 2]" 1
456 1 43 ALA MB 1 82 ASN H . . 5.000 4.733 4.515 5.063 0.063 17 0 "[ . 1 . 2]" 1
457 1 43 ALA MB 1 84 VAL HB . . 4.920 3.572 2.740 4.498 . 0 0 "[ . 1 . 2]" 1
458 1 43 ALA MB 1 84 VAL QG . . 4.420 2.558 2.000 3.193 . 0 0 "[ . 1 . 2]" 1
459 1 44 ALA H 1 44 ALA MB . . 3.110 2.253 2.205 2.330 . 0 0 "[ . 1 . 2]" 1
460 1 44 ALA H 1 45 ALA H . . 3.470 2.543 2.242 2.778 . 0 0 "[ . 1 . 2]" 1
461 1 44 ALA H 1 45 ALA MB . . 4.740 4.204 3.894 4.383 . 0 0 "[ . 1 . 2]" 1
462 1 44 ALA H 1 46 ASP H . . 4.660 4.116 3.807 4.389 . 0 0 "[ . 1 . 2]" 1
463 1 44 ALA H 1 46 ASP QB . . 5.500 4.909 4.458 5.342 . 0 0 "[ . 1 . 2]" 1
464 1 44 ALA H 1 49 VAL MG1 . . 5.370 4.629 4.322 5.283 . 0 0 "[ . 1 . 2]" 1
465 1 44 ALA HA 1 49 VAL HB . . 5.330 3.369 2.926 4.005 . 0 0 "[ . 1 . 2]" 1
466 1 44 ALA HA 1 49 VAL MG1 . . 3.450 2.260 2.018 2.947 . 0 0 "[ . 1 . 2]" 1
467 1 44 ALA HA 1 49 VAL MG2 . . 4.440 3.451 2.835 3.897 . 0 0 "[ . 1 . 2]" 1
468 1 44 ALA MB 1 45 ALA H . . 3.690 2.918 2.674 3.096 . 0 0 "[ . 1 . 2]" 1
469 1 44 ALA MB 1 45 ALA MB . . 3.800 3.781 3.581 3.929 0.129 5 0 "[ . 1 . 2]" 1
470 1 44 ALA MB 1 46 ASP H . . 5.290 4.438 4.250 4.583 . 0 0 "[ . 1 . 2]" 1
471 1 44 ALA MB 1 49 VAL MG1 . . 4.870 3.351 2.846 3.757 . 0 0 "[ . 1 . 2]" 1
472 1 45 ALA H 1 45 ALA MB . . 3.320 2.237 2.153 2.405 . 0 0 "[ . 1 . 2]" 1
473 1 45 ALA H 1 46 ASP H . . 3.360 2.616 2.386 2.840 . 0 0 "[ . 1 . 2]" 1
474 1 45 ALA H 1 46 ASP HA . . 5.200 4.916 4.779 5.071 . 0 0 "[ . 1 . 2]" 1
475 1 45 ALA HA 1 50 VAL QG . . 3.500 2.496 2.169 3.332 . 0 0 "[ . 1 . 2]" 1
476 1 45 ALA MB 1 46 ASP H . . 4.010 3.287 2.966 3.689 . 0 0 "[ . 1 . 2]" 1
477 1 45 ALA MB 1 50 VAL QG . . 4.230 3.566 3.252 4.272 0.042 15 0 "[ . 1 . 2]" 1
478 1 46 ASP H 1 46 ASP QB . . 3.400 2.144 1.945 2.272 . 0 0 "[ . 1 . 2]" 1
479 1 46 ASP H 1 48 ALA H . . 5.500 5.459 4.818 5.574 0.074 14 0 "[ . 1 . 2]" 1
480 1 46 ASP H 1 49 VAL H . . 4.530 4.459 4.051 4.604 0.074 13 0 "[ . 1 . 2]" 1
481 1 46 ASP H 1 49 VAL HB . . 3.920 3.304 2.848 3.696 . 0 0 "[ . 1 . 2]" 1
482 1 46 ASP H 1 49 VAL MG1 . . 4.860 4.265 3.861 4.928 0.068 15 0 "[ . 1 . 2]" 1
483 1 46 ASP H 1 49 VAL MG2 . . 4.360 3.829 3.243 4.428 0.068 20 0 "[ . 1 . 2]" 1
484 1 46 ASP H 1 50 VAL H . . 5.500 4.446 4.127 4.739 . 0 0 "[ . 1 . 2]" 1
485 1 46 ASP H 1 50 VAL QG . . 4.540 3.533 3.236 3.776 . 0 0 "[ . 1 . 2]" 1
486 1 46 ASP H 1 80 ALA MB . . 4.750 4.273 3.992 4.852 0.102 15 0 "[ . 1 . 2]" 1
487 1 46 ASP HA 1 47 PRO HB3 . . 5.400 4.932 4.144 5.202 . 0 0 "[ . 1 . 2]" 1
488 1 46 ASP HA 1 47 PRO HD2 . . 3.950 2.461 2.166 2.819 . 0 0 "[ . 1 . 2]" 1
489 1 46 ASP HA 1 47 PRO HG2 . . 5.010 4.591 4.340 4.831 . 0 0 "[ . 1 . 2]" 1
490 1 46 ASP HA 1 47 PRO HG3 . . 5.100 4.638 4.140 4.757 . 0 0 "[ . 1 . 2]" 1
491 1 46 ASP HA 1 48 ALA H . . 4.800 4.295 3.926 4.526 . 0 0 "[ . 1 . 2]" 1
492 1 46 ASP HA 1 49 VAL H . . 5.500 4.768 4.422 5.376 . 0 0 "[ . 1 . 2]" 1
493 1 46 ASP HA 1 50 VAL QG . . 5.050 4.082 3.712 4.283 . 0 0 "[ . 1 . 2]" 1
494 1 46 ASP QB 1 48 ALA H . . 5.500 3.358 2.452 3.907 . 0 0 "[ . 1 . 2]" 1
495 1 46 ASP QB 1 49 VAL H . . 4.470 2.943 2.232 3.821 . 0 0 "[ . 1 . 2]" 1
496 1 46 ASP QB 1 49 VAL MG2 . . 5.470 2.517 2.010 4.044 . 0 0 "[ . 1 . 2]" 1
497 1 46 ASP QB 1 80 ALA MB . . 3.920 2.690 2.308 3.086 . 0 0 "[ . 1 . 2]" 1
498 1 47 PRO HA 1 50 VAL H . . 4.750 3.699 3.422 3.796 . 0 0 "[ . 1 . 2]" 1
499 1 47 PRO HA 1 50 VAL QG . . 3.960 2.083 1.947 2.732 . 0 0 "[ . 1 . 2]" 1
500 1 47 PRO HA 1 51 ALA H . . 4.680 3.742 3.078 3.958 . 0 0 "[ . 1 . 2]" 1
501 1 47 PRO HA 1 51 ALA MB . . 5.500 4.194 3.710 4.541 . 0 0 "[ . 1 . 2]" 1
502 1 47 PRO HB2 1 48 ALA H . . 3.950 3.443 3.246 3.806 . 0 0 "[ . 1 . 2]" 1
503 1 47 PRO HD2 1 48 ALA H . . 4.880 3.001 2.373 3.273 . 0 0 "[ . 1 . 2]" 1
504 1 47 PRO HD3 1 48 ALA H . . 4.470 4.022 3.656 4.169 . 0 0 "[ . 1 . 2]" 1
505 1 47 PRO HD3 1 48 ALA MB . . 5.500 5.433 4.926 5.592 0.092 10 0 "[ . 1 . 2]" 1
506 1 47 PRO HD3 1 50 VAL QG . . 5.500 4.307 4.066 4.888 . 0 0 "[ . 1 . 2]" 1
507 1 47 PRO HG2 1 48 ALA MB . . 3.650 3.541 3.328 3.654 0.004 15 0 "[ . 1 . 2]" 1
508 1 47 PRO HG3 1 48 ALA H . . 4.640 4.088 3.796 4.233 . 0 0 "[ . 1 . 2]" 1
509 1 47 PRO HG3 1 48 ALA MB . . 5.020 5.073 4.858 5.140 0.120 15 0 "[ . 1 . 2]" 1
510 1 47 PRO HG3 1 50 VAL QG . . 5.500 5.199 5.050 5.295 . 0 0 "[ . 1 . 2]" 1
511 1 48 ALA H 1 48 ALA MB . . 3.170 2.224 2.068 2.305 . 0 0 "[ . 1 . 2]" 1
512 1 48 ALA H 1 49 VAL H . . 3.360 2.540 2.330 2.874 . 0 0 "[ . 1 . 2]" 1
513 1 48 ALA H 1 49 VAL HA . . 5.500 5.175 4.992 5.484 . 0 0 "[ . 1 . 2]" 1
514 1 48 ALA H 1 49 VAL HB . . 4.920 4.730 4.460 4.980 0.060 17 0 "[ . 1 . 2]" 1
515 1 48 ALA H 1 49 VAL MG2 . . 4.900 4.014 3.640 4.742 . 0 0 "[ . 1 . 2]" 1
516 1 48 ALA H 1 50 VAL H . . 4.400 4.213 4.067 4.436 0.036 15 0 "[ . 1 . 2]" 1
517 1 48 ALA H 1 50 VAL QG . . 5.220 4.114 3.821 4.893 . 0 0 "[ . 1 . 2]" 1
518 1 48 ALA H 1 76 ALA MB . . 5.500 4.600 4.129 5.260 . 0 0 "[ . 1 . 2]" 1
519 1 48 ALA MB 1 49 VAL H . . 4.080 2.654 2.281 3.079 . 0 0 "[ . 1 . 2]" 1
520 1 48 ALA MB 1 49 VAL MG2 . . 5.290 2.981 2.285 3.693 . 0 0 "[ . 1 . 2]" 1
521 1 48 ALA MB 1 76 ALA MB . . 3.720 2.255 1.772 3.153 . 0 0 "[ . 1 . 2]" 1
522 1 49 VAL H 1 49 VAL HB . . 3.910 2.425 2.242 2.556 . 0 0 "[ . 1 . 2]" 1
523 1 49 VAL H 1 49 VAL MG1 . . 4.610 3.769 3.705 3.846 . 0 0 "[ . 1 . 2]" 1
524 1 49 VAL H 1 49 VAL MG2 . . 3.910 2.292 1.987 2.538 . 0 0 "[ . 1 . 2]" 1
525 1 49 VAL H 1 50 VAL H . . 3.690 2.605 2.440 2.777 . 0 0 "[ . 1 . 2]" 1
526 1 49 VAL H 1 50 VAL HA . . 5.190 5.203 5.072 5.265 0.075 9 0 "[ . 1 . 2]" 1
527 1 49 VAL HA 1 50 VAL HA . . 4.850 4.756 4.627 4.925 0.075 19 0 "[ . 1 . 2]" 1
528 1 49 VAL HA 1 50 VAL QG . . 5.500 4.584 4.399 4.862 . 0 0 "[ . 1 . 2]" 1
529 1 49 VAL HA 1 52 ALA H . . 4.730 3.595 3.327 3.985 . 0 0 "[ . 1 . 2]" 1
530 1 49 VAL HA 1 52 ALA MB . . 3.880 2.769 2.360 3.372 . 0 0 "[ . 1 . 2]" 1
531 1 49 VAL HA 1 53 LYS H . . 4.870 3.754 3.471 4.015 . 0 0 "[ . 1 . 2]" 1
532 1 49 VAL HA 1 73 TYR HA . . 5.060 3.892 3.448 4.287 . 0 0 "[ . 1 . 2]" 1
533 1 49 VAL HA 1 73 TYR QD . . 5.310 3.517 2.888 4.398 . 0 0 "[ . 1 . 2]" 1
534 1 49 VAL HA 1 76 ALA MB . . 3.940 3.075 2.450 3.558 . 0 0 "[ . 1 . 2]" 1
535 1 49 VAL HB 1 50 VAL H . . 4.030 2.590 2.342 2.867 . 0 0 "[ . 1 . 2]" 1
536 1 49 VAL HB 1 50 VAL HA . . 5.380 4.425 4.170 4.854 . 0 0 "[ . 1 . 2]" 1
537 1 49 VAL HB 1 50 VAL QG . . 4.620 3.242 3.016 3.609 . 0 0 "[ . 1 . 2]" 1
538 1 49 VAL HB 1 51 ALA H . . 5.050 5.110 4.927 5.138 0.088 19 0 "[ . 1 . 2]" 1
539 1 49 VAL MG1 1 50 VAL H . . 4.730 3.404 3.020 3.725 . 0 0 "[ . 1 . 2]" 1
540 1 49 VAL MG1 1 51 ALA H . . 5.500 5.164 4.872 5.314 . 0 0 "[ . 1 . 2]" 1
541 1 49 VAL MG1 1 53 LYS H . . 5.500 4.041 3.791 4.309 . 0 0 "[ . 1 . 2]" 1
542 1 49 VAL MG1 1 53 LYS HB2 . . 5.300 3.314 2.849 3.632 . 0 0 "[ . 1 . 2]" 1
543 1 49 VAL MG1 1 73 TYR QD . . 3.530 3.327 2.902 3.653 0.123 16 0 "[ . 1 . 2]" 1
544 1 49 VAL MG1 1 73 TYR QE . . 2.960 2.637 2.223 3.072 0.112 17 0 "[ . 1 . 2]" 1
545 1 49 VAL MG1 1 77 PHE HA . . 4.500 3.330 2.790 3.969 . 0 0 "[ . 1 . 2]" 1
546 1 49 VAL MG1 1 77 PHE HB2 . . 4.760 3.265 2.375 4.429 . 0 0 "[ . 1 . 2]" 1
547 1 49 VAL MG1 1 77 PHE QD . . 3.440 2.687 2.107 3.528 0.088 19 0 "[ . 1 . 2]" 1
548 1 49 VAL MG2 1 50 VAL H . . 5.500 3.923 3.787 4.106 . 0 0 "[ . 1 . 2]" 1
549 1 49 VAL MG2 1 52 ALA MB . . 5.500 4.193 3.898 4.619 . 0 0 "[ . 1 . 2]" 1
550 1 49 VAL MG2 1 73 TYR QE . . 5.500 4.654 3.920 5.255 . 0 0 "[ . 1 . 2]" 1
551 1 49 VAL MG2 1 76 ALA H . . 5.420 4.720 4.314 5.215 . 0 0 "[ . 1 . 2]" 1
552 1 49 VAL MG2 1 76 ALA MB . . 3.490 2.402 2.015 2.778 . 0 0 "[ . 1 . 2]" 1
553 1 49 VAL MG2 1 77 PHE H . . 5.060 3.355 2.907 4.004 . 0 0 "[ . 1 . 2]" 1
554 1 49 VAL MG2 1 77 PHE HA . . 3.970 2.329 2.020 2.849 . 0 0 "[ . 1 . 2]" 1
555 1 49 VAL MG2 1 77 PHE HB2 . . 5.500 3.356 2.456 4.062 . 0 0 "[ . 1 . 2]" 1
556 1 49 VAL MG2 1 77 PHE QD . . 4.160 3.336 2.374 4.162 0.002 6 0 "[ . 1 . 2]" 1
557 1 49 VAL MG2 1 80 ALA H . . 4.390 3.933 3.678 4.448 0.058 17 0 "[ . 1 . 2]" 1
558 1 49 VAL MG2 1 80 ALA MB . . 3.920 2.475 2.160 2.844 . 0 0 "[ . 1 . 2]" 1
559 1 50 VAL H 1 50 VAL HB . . 3.670 3.406 1.974 3.682 0.012 18 0 "[ . 1 . 2]" 1
560 1 50 VAL H 1 50 VAL QG . . 3.450 1.950 1.822 2.155 . 0 0 "[ . 1 . 2]" 1
561 1 50 VAL H 1 51 ALA H . . 3.640 2.774 2.585 2.987 . 0 0 "[ . 1 . 2]" 1
562 1 50 VAL H 1 51 ALA MB . . 4.670 4.449 4.268 4.748 0.078 19 0 "[ . 1 . 2]" 1
563 1 50 VAL H 1 53 LYS H . . 5.400 4.826 4.741 4.931 . 0 0 "[ . 1 . 2]" 1
564 1 50 VAL HA 1 50 VAL QG . . 3.330 2.279 2.168 2.401 . 0 0 "[ . 1 . 2]" 1
565 1 50 VAL HA 1 53 LYS H . . 4.790 3.735 3.435 4.277 . 0 0 "[ . 1 . 2]" 1
566 1 50 VAL HA 1 54 ALA MB . . 5.500 4.404 3.567 4.728 . 0 0 "[ . 1 . 2]" 1
567 1 50 VAL HB 1 51 ALA H . . 3.600 3.506 2.473 3.684 0.084 6 0 "[ . 1 . 2]" 1
568 1 50 VAL QG 1 51 ALA H . . 4.020 2.249 1.963 3.134 . 0 0 "[ . 1 . 2]" 1
569 1 50 VAL QG 1 51 ALA MB . . 4.880 3.104 2.857 3.758 . 0 0 "[ . 1 . 2]" 1
570 1 51 ALA H 1 51 ALA MB . . 2.850 2.267 2.207 2.361 . 0 0 "[ . 1 . 2]" 1
571 1 51 ALA H 1 52 ALA MB . . 5.500 4.489 4.299 4.769 . 0 0 "[ . 1 . 2]" 1
572 1 51 ALA H 1 53 LYS H . . 5.290 4.275 4.102 4.516 . 0 0 "[ . 1 . 2]" 1
573 1 52 ALA H 1 52 ALA MB . . 3.420 2.235 2.164 2.279 . 0 0 "[ . 1 . 2]" 1
574 1 52 ALA H 1 53 LYS H . . 3.570 2.811 2.719 3.017 . 0 0 "[ . 1 . 2]" 1
575 1 52 ALA H 1 73 TYR QD . . 5.290 4.660 4.228 5.300 0.010 9 0 "[ . 1 . 2]" 1
576 1 52 ALA HA 1 55 ALA H . . 3.890 3.580 3.263 3.916 0.026 9 0 "[ . 1 . 2]" 1
577 1 52 ALA MB 1 53 LYS H . . 4.190 2.610 2.298 3.058 . 0 0 "[ . 1 . 2]" 1
578 1 52 ALA MB 1 55 ALA H . . 5.430 4.722 4.523 4.977 . 0 0 "[ . 1 . 2]" 1
579 1 52 ALA MB 1 55 ALA MB . . 4.710 4.029 3.672 4.380 . 0 0 "[ . 1 . 2]" 1
580 1 52 ALA MB 1 56 LEU QD . . 5.500 3.916 2.903 5.025 . 0 0 "[ . 1 . 2]" 1
581 1 52 ALA MB 1 72 ALA MB . . 4.150 2.810 2.298 3.342 . 0 0 "[ . 1 . 2]" 1
582 1 52 ALA MB 1 73 TYR H . . 4.720 3.034 2.626 3.412 . 0 0 "[ . 1 . 2]" 1
583 1 52 ALA MB 1 73 TYR HA . . 3.930 2.227 1.990 2.488 . 0 0 "[ . 1 . 2]" 1
584 1 52 ALA MB 1 73 TYR HB2 . . 4.860 2.343 2.002 2.889 . 0 0 "[ . 1 . 2]" 1
585 1 52 ALA MB 1 73 TYR QD . . 3.430 2.514 2.128 3.516 0.086 16 0 "[ . 1 . 2]" 1
586 1 52 ALA MB 1 73 TYR QE . . 5.170 4.398 3.944 5.257 0.087 16 0 "[ . 1 . 2]" 1
587 1 53 LYS H 1 53 LYS QG . . 4.780 3.955 3.855 4.082 . 0 0 "[ . 1 . 2]" 1
588 1 53 LYS H 1 54 ALA H . . 3.600 2.784 2.666 2.970 . 0 0 "[ . 1 . 2]" 1
589 1 53 LYS H 1 54 ALA MB . . 4.610 4.414 4.260 4.662 0.052 9 0 "[ . 1 . 2]" 1
590 1 53 LYS H 1 55 ALA H . . 4.590 4.216 4.052 4.501 . 0 0 "[ . 1 . 2]" 1
591 1 53 LYS H 1 56 LEU QD . . 5.500 4.785 3.923 5.315 . 0 0 "[ . 1 . 2]" 1
592 1 53 LYS H 1 73 TYR HB2 . . 5.500 4.455 3.823 4.806 . 0 0 "[ . 1 . 2]" 1
593 1 53 LYS H 1 73 TYR QD . . 4.450 2.973 2.690 3.363 . 0 0 "[ . 1 . 2]" 1
594 1 53 LYS H 1 73 TYR QE . . 4.560 4.040 3.610 4.650 0.090 9 0 "[ . 1 . 2]" 1
595 1 53 LYS HA 1 53 LYS HD2 . . 4.680 3.438 2.361 4.253 . 0 0 "[ . 1 . 2]" 1
596 1 53 LYS HA 1 53 LYS HD3 . . 4.080 3.379 2.392 4.197 0.117 6 0 "[ . 1 . 2]" 1
597 1 53 LYS HA 1 55 ALA H . . 4.840 4.446 4.090 4.762 . 0 0 "[ . 1 . 2]" 1
598 1 53 LYS HA 1 55 ALA MB . . 5.460 5.041 4.697 5.256 . 0 0 "[ . 1 . 2]" 1
599 1 53 LYS HA 1 56 LEU H . . 4.210 3.361 3.190 3.637 . 0 0 "[ . 1 . 2]" 1
600 1 53 LYS HA 1 56 LEU HB2 . . 4.140 2.960 2.096 3.737 . 0 0 "[ . 1 . 2]" 1
601 1 53 LYS HA 1 56 LEU HB3 . . 4.780 2.823 2.237 3.711 . 0 0 "[ . 1 . 2]" 1
602 1 53 LYS HA 1 56 LEU QD . . 4.820 2.872 2.541 3.205 . 0 0 "[ . 1 . 2]" 1
603 1 53 LYS HA 1 57 ASP H . . 4.510 3.997 3.833 4.185 . 0 0 "[ . 1 . 2]" 1
604 1 53 LYS HA 1 73 TYR QD . . 4.530 3.195 2.627 3.865 . 0 0 "[ . 1 . 2]" 1
605 1 53 LYS HA 1 73 TYR QE . . 4.280 3.837 3.284 4.274 . 0 0 "[ . 1 . 2]" 1
606 1 53 LYS HB2 1 73 TYR QD . . 4.440 2.881 2.331 3.212 . 0 0 "[ . 1 . 2]" 1
607 1 53 LYS HB2 1 73 TYR QE . . 3.430 2.358 2.133 2.798 . 0 0 "[ . 1 . 2]" 1
608 1 53 LYS HB3 1 54 ALA H . . 3.780 2.528 2.308 2.727 . 0 0 "[ . 1 . 2]" 1
609 1 53 LYS HB3 1 55 ALA H . . 5.500 5.045 4.823 5.286 . 0 0 "[ . 1 . 2]" 1
610 1 53 LYS HD2 1 56 LEU QD . . 5.500 4.737 2.556 5.437 . 0 0 "[ . 1 . 2]" 1
611 1 53 LYS HD2 1 73 TYR QE . . 5.500 4.943 2.736 5.571 0.071 13 0 "[ . 1 . 2]" 1
612 1 53 LYS HD3 1 56 LEU QD . . 5.430 4.233 2.528 5.462 0.032 6 0 "[ . 1 . 2]" 1
613 1 53 LYS HD3 1 57 ASP QB . . 5.440 3.839 2.429 6.315 0.875 6 2 "[ .+ - 1 . 2]" 1
614 1 53 LYS QE 1 56 LEU QD . . 5.500 4.835 3.170 5.465 . 0 0 "[ . 1 . 2]" 1
615 1 53 LYS QG 1 56 LEU QD . . 4.210 3.553 2.913 4.217 0.007 1 0 "[ . 1 . 2]" 1
616 1 54 ALA H 1 54 ALA MB . . 3.280 2.226 2.170 2.276 . 0 0 "[ . 1 . 2]" 1
617 1 54 ALA H 1 55 ALA H . . 3.430 2.801 2.659 2.877 . 0 0 "[ . 1 . 2]" 1
618 1 54 ALA H 1 56 LEU H . . 4.630 4.229 4.051 4.333 . 0 0 "[ . 1 . 2]" 1
619 1 54 ALA H 1 57 ASP QB . . 5.500 5.099 4.700 5.498 . 0 0 "[ . 1 . 2]" 1
620 1 54 ALA HA 1 57 ASP H . . 4.320 3.753 3.330 4.064 . 0 0 "[ . 1 . 2]" 1
621 1 54 ALA HA 1 57 ASP QB . . 3.610 3.142 2.404 3.683 0.073 20 0 "[ . 1 . 2]" 1
622 1 54 ALA MB 1 55 ALA H . . 3.610 2.605 2.403 2.999 . 0 0 "[ . 1 . 2]" 1
623 1 55 ALA H 1 55 ALA MB . . 3.030 2.229 2.136 2.326 . 0 0 "[ . 1 . 2]" 1
624 1 55 ALA H 1 69 VAL QG . . 5.500 4.057 3.717 4.821 . 0 0 "[ . 1 . 2]" 1
625 1 55 ALA HA 1 57 ASP QB . . 5.300 5.149 4.555 5.399 0.099 5 0 "[ . 1 . 2]" 1
626 1 55 ALA HA 1 58 ALA H . . 4.310 3.665 3.376 4.012 . 0 0 "[ . 1 . 2]" 1
627 1 55 ALA HA 1 58 ALA MB . . 3.680 2.836 2.311 3.327 . 0 0 "[ . 1 . 2]" 1
628 1 55 ALA MB 1 56 LEU QD . . 5.500 4.574 3.912 4.812 . 0 0 "[ . 1 . 2]" 1
629 1 55 ALA MB 1 57 ASP H . . 5.500 4.616 4.212 4.839 . 0 0 "[ . 1 . 2]" 1
630 1 55 ALA MB 1 69 VAL HB . . 4.880 3.776 3.159 4.440 . 0 0 "[ . 1 . 2]" 1
631 1 55 ALA MB 1 69 VAL QG . . 4.060 2.099 1.920 2.531 . 0 0 "[ . 1 . 2]" 1
632 1 56 LEU H 1 56 LEU HB2 . . 3.650 2.358 2.059 2.663 . 0 0 "[ . 1 . 2]" 1
633 1 56 LEU H 1 56 LEU HB3 . . 3.670 2.789 2.307 3.484 . 0 0 "[ . 1 . 2]" 1
634 1 56 LEU H 1 56 LEU QD . . 4.300 3.629 3.009 3.765 . 0 0 "[ . 1 . 2]" 1
635 1 56 LEU H 1 57 ASP H . . 3.510 2.818 2.629 2.963 . 0 0 "[ . 1 . 2]" 1
636 1 56 LEU H 1 57 ASP QB . . 5.300 4.547 4.304 4.838 . 0 0 "[ . 1 . 2]" 1
637 1 56 LEU H 1 69 VAL QG . . 4.210 2.848 2.446 3.490 . 0 0 "[ . 1 . 2]" 1
638 1 56 LEU HA 1 56 LEU QD . . 4.010 2.262 2.072 2.559 . 0 0 "[ . 1 . 2]" 1
639 1 56 LEU HA 1 58 ALA MB . . 5.140 5.032 4.728 5.210 0.070 20 0 "[ . 1 . 2]" 1
640 1 56 LEU HA 1 59 VAL H . . 4.650 3.298 2.677 3.602 . 0 0 "[ . 1 . 2]" 1
641 1 56 LEU HA 1 59 VAL HB . . 4.460 3.324 2.373 4.497 0.037 8 0 "[ . 1 . 2]" 1
642 1 56 LEU HA 1 69 VAL QG . . 3.880 2.135 1.915 2.494 . 0 0 "[ . 1 . 2]" 1
643 1 56 LEU HB2 1 57 ASP H . . 4.130 3.611 2.963 4.158 0.028 8 0 "[ . 1 . 2]" 1
644 1 56 LEU HB2 1 69 VAL QG . . 3.530 2.897 2.167 3.440 . 0 0 "[ . 1 . 2]" 1
645 1 56 LEU HB3 1 57 ASP H . . 5.350 2.790 2.442 3.628 . 0 0 "[ . 1 . 2]" 1
646 1 56 LEU HB3 1 58 ALA H . . 4.850 4.819 4.640 4.925 0.075 3 0 "[ . 1 . 2]" 1
647 1 56 LEU HB3 1 73 TYR QD . . 5.500 4.938 4.021 5.595 0.095 1 0 "[ . 1 . 2]" 1
648 1 56 LEU QD 1 57 ASP H . . 4.700 3.889 2.993 4.348 . 0 0 "[ . 1 . 2]" 1
649 1 56 LEU QD 1 57 ASP HA . . 5.500 4.180 2.929 5.146 . 0 0 "[ . 1 . 2]" 1
650 1 56 LEU QD 1 58 ALA H . . 5.500 4.745 4.027 5.059 . 0 0 "[ . 1 . 2]" 1
651 1 56 LEU QD 1 59 VAL H . . 5.150 4.167 3.687 4.410 . 0 0 "[ . 1 . 2]" 1
652 1 56 LEU QD 1 59 VAL HB . . 4.820 4.218 3.559 4.841 0.021 1 0 "[ . 1 . 2]" 1
653 1 56 LEU QD 1 59 VAL QG . . 4.340 3.978 2.617 4.393 0.053 10 0 "[ . 1 . 2]" 1
654 1 56 LEU QD 1 60 GLU H . . 5.500 4.271 3.664 4.695 . 0 0 "[ . 1 . 2]" 1
655 1 56 LEU QD 1 61 GLY H . . 5.500 4.735 3.921 5.350 . 0 0 "[ . 1 . 2]" 1
656 1 56 LEU QD 1 66 TYR HA . . 5.500 3.566 3.163 3.849 . 0 0 "[ . 1 . 2]" 1
657 1 56 LEU QD 1 66 TYR QD . . 4.700 2.666 2.365 3.092 . 0 0 "[ . 1 . 2]" 1
658 1 56 LEU QD 1 66 TYR QE . . 3.200 2.439 2.030 3.197 . 0 0 "[ . 1 . 2]" 1
659 1 56 LEU QD 1 69 VAL H . . 5.480 4.620 4.182 4.939 . 0 0 "[ . 1 . 2]" 1
660 1 56 LEU QD 1 69 VAL QG . . 4.170 2.135 1.777 2.907 . 0 0 "[ . 1 . 2]" 1
661 1 56 LEU QD 1 70 LYS H . . 4.570 3.153 2.870 3.437 . 0 0 "[ . 1 . 2]" 1
662 1 56 LEU QD 1 70 LYS HA . . 3.870 2.282 1.993 2.851 . 0 0 "[ . 1 . 2]" 1
663 1 56 LEU QD 1 70 LYS HB2 . . 4.840 2.544 2.218 2.899 . 0 0 "[ . 1 . 2]" 1
664 1 56 LEU QD 1 70 LYS HB3 . . 5.280 3.828 3.621 4.142 . 0 0 "[ . 1 . 2]" 1
665 1 56 LEU QD 1 70 LYS QG . . 5.500 3.296 2.438 4.172 . 0 0 "[ . 1 . 2]" 1
666 1 56 LEU QD 1 71 ALA H . . 5.500 4.810 4.619 5.218 . 0 0 "[ . 1 . 2]" 1
667 1 56 LEU QD 1 73 TYR H . . 5.130 3.990 3.506 4.658 . 0 0 "[ . 1 . 2]" 1
668 1 56 LEU QD 1 73 TYR HB2 . . 5.180 2.627 2.067 3.632 . 0 0 "[ . 1 . 2]" 1
669 1 56 LEU QD 1 73 TYR HB3 . . 5.030 2.620 2.215 3.568 . 0 0 "[ . 1 . 2]" 1
670 1 56 LEU QD 1 73 TYR QD . . 3.650 2.787 2.414 3.528 . 0 0 "[ . 1 . 2]" 1
671 1 56 LEU QD 1 73 TYR QE . . 3.910 3.594 2.999 4.036 0.126 20 0 "[ . 1 . 2]" 1
672 1 56 LEU QD 1 74 GLU H . . 5.500 4.423 3.982 5.111 . 0 0 "[ . 1 . 2]" 1
673 1 56 LEU QD 1 74 GLU HG3 . . 5.480 5.087 4.374 5.777 0.297 8 0 "[ . 1 . 2]" 1
674 1 56 LEU HG 1 60 GLU HA . . 5.360 5.051 3.963 5.454 0.094 1 0 "[ . 1 . 2]" 1
675 1 56 LEU HG 1 66 TYR QD . . 5.500 4.940 4.486 5.508 0.008 2 0 "[ . 1 . 2]" 1
676 1 56 LEU HG 1 66 TYR QE . . 5.500 4.711 3.814 5.566 0.066 14 0 "[ . 1 . 2]" 1
677 1 57 ASP H 1 57 ASP QB . . 3.350 2.158 2.029 2.294 . 0 0 "[ . 1 . 2]" 1
678 1 57 ASP H 1 58 ALA H . . 3.360 2.729 2.512 2.840 . 0 0 "[ . 1 . 2]" 1
679 1 57 ASP H 1 58 ALA MB . . 4.220 4.274 4.060 4.319 0.099 18 0 "[ . 1 . 2]" 1
680 1 57 ASP H 1 59 VAL H . . 4.480 4.135 3.829 4.357 . 0 0 "[ . 1 . 2]" 1
681 1 57 ASP H 1 69 VAL QG . . 5.500 4.505 4.279 4.799 . 0 0 "[ . 1 . 2]" 1
682 1 57 ASP HA 1 59 VAL H . . 4.410 4.068 3.775 4.479 0.069 17 0 "[ . 1 . 2]" 1
683 1 57 ASP HA 1 60 GLU QB . . 4.750 3.001 2.533 3.444 . 0 0 "[ . 1 . 2]" 1
684 1 57 ASP QB 1 58 ALA H . . 3.650 3.317 2.829 3.685 0.035 1 0 "[ . 1 . 2]" 1
685 1 57 ASP QB 1 58 ALA MB . . 4.790 3.860 3.409 4.508 . 0 0 "[ . 1 . 2]" 1
686 1 57 ASP QB 1 59 VAL H . . 5.030 4.859 4.599 5.042 0.012 10 0 "[ . 1 . 2]" 1
687 1 58 ALA H 1 58 ALA MB . . 2.990 2.365 2.238 2.589 . 0 0 "[ . 1 . 2]" 1
688 1 58 ALA H 1 59 VAL H . . 3.230 2.064 1.850 2.211 . 0 0 "[ . 1 . 2]" 1
689 1 58 ALA H 1 59 VAL HA . . 4.730 4.773 4.654 4.818 0.088 19 0 "[ . 1 . 2]" 1
690 1 58 ALA H 1 59 VAL HB . . 5.080 4.286 3.940 5.421 0.341 8 0 "[ . 1 . 2]" 1
691 1 58 ALA H 1 59 VAL MG2 . . 4.410 3.644 3.043 5.355 0.945 9 2 "[- . +1 . 2]" 1
692 1 58 ALA H 1 60 GLU H . . 5.500 3.859 3.430 4.428 . 0 0 "[ . 1 . 2]" 1
693 1 58 ALA H 1 69 VAL QG . . 5.500 4.438 4.122 4.716 . 0 0 "[ . 1 . 2]" 1
694 1 58 ALA MB 1 59 VAL H . . 3.660 3.187 2.825 3.424 . 0 0 "[ . 1 . 2]" 1
695 1 58 ALA MB 1 59 VAL HA . . 4.920 4.269 4.040 4.435 . 0 0 "[ . 1 . 2]" 1
696 1 58 ALA MB 1 59 VAL HB . . 4.770 4.324 3.361 5.147 0.377 8 0 "[ . 1 . 2]" 1
697 1 58 ALA MB 1 59 VAL QG . . 4.490 2.639 2.192 3.933 . 0 0 "[ . 1 . 2]" 1
698 1 58 ALA MB 1 60 GLU H . . 4.840 4.669 4.301 4.896 0.056 5 0 "[ . 1 . 2]" 1
699 1 59 VAL H 1 59 VAL HB . . 3.460 2.824 2.439 3.621 0.161 8 0 "[ . 1 . 2]" 1
700 1 59 VAL H 1 59 VAL QG . . 4.110 2.699 1.885 2.908 . 0 0 "[ . 1 . 2]" 1
701 1 59 VAL H 1 59 VAL MG2 . . 3.470 2.895 1.898 4.033 0.563 9 1 "[ . +1 . 2]" 1
702 1 59 VAL H 1 60 GLU H . . 3.840 2.269 1.782 2.726 . 0 0 "[ . 1 . 2]" 1
703 1 59 VAL H 1 66 TYR QD . . 5.500 5.347 4.495 5.594 0.094 14 0 "[ . 1 . 2]" 1
704 1 59 VAL H 1 69 VAL QG . . 5.350 3.803 3.526 4.205 . 0 0 "[ . 1 . 2]" 1
705 1 59 VAL HA 1 60 GLU H . . 3.090 2.955 2.635 3.159 0.069 4 0 "[ . 1 . 2]" 1
706 1 59 VAL HA 1 63 SER HB3 . . 4.450 3.480 2.684 4.249 . 0 0 "[ . 1 . 2]" 1
707 1 59 VAL HA 1 69 VAL QG . . 5.500 4.510 4.145 5.072 . 0 0 "[ . 1 . 2]" 1
708 1 59 VAL HB 1 63 SER HB2 . . 5.380 5.048 2.915 5.469 0.089 14 0 "[ . 1 . 2]" 1
709 1 59 VAL HB 1 63 SER HB3 . . 5.420 4.744 2.275 5.494 0.074 16 0 "[ . 1 . 2]" 1
710 1 59 VAL HB 1 65 ASN QB . . 4.490 4.120 2.904 4.419 . 0 0 "[ . 1 . 2]" 1
711 1 59 VAL HB 1 66 TYR HA . . 5.060 4.050 2.959 5.118 0.058 9 0 "[ . 1 . 2]" 1
712 1 59 VAL HB 1 66 TYR QD . . 5.070 4.884 4.431 5.171 0.101 9 0 "[ . 1 . 2]" 1
713 1 59 VAL HB 1 69 VAL QG . . 4.130 2.344 2.023 3.575 . 0 0 "[ . 1 . 2]" 1
714 1 59 VAL QG 1 60 GLU H . . 4.340 3.755 3.143 3.958 . 0 0 "[ . 1 . 2]" 1
715 1 59 VAL QG 1 63 SER H . . 4.740 4.136 3.603 4.668 . 0 0 "[ . 1 . 2]" 1
716 1 59 VAL QG 1 63 SER HB2 . . 4.680 3.071 2.362 3.477 . 0 0 "[ . 1 . 2]" 1
717 1 59 VAL QG 1 63 SER HB3 . . 4.120 2.405 2.062 2.795 . 0 0 "[ . 1 . 2]" 1
718 1 59 VAL QG 1 65 ASN HA . . 4.560 4.113 3.838 4.359 . 0 0 "[ . 1 . 2]" 1
719 1 59 VAL QG 1 65 ASN QB . . 5.440 2.072 1.827 2.263 . 0 0 "[ . 1 . 2]" 1
720 1 59 VAL QG 1 66 TYR H . . 5.500 3.045 2.530 3.488 . 0 0 "[ . 1 . 2]" 1
721 1 59 VAL QG 1 66 TYR HA . . 3.990 2.744 2.051 3.136 . 0 0 "[ . 1 . 2]" 1
722 1 59 VAL QG 1 66 TYR HB2 . . 5.450 3.402 2.738 3.941 . 0 0 "[ . 1 . 2]" 1
723 1 59 VAL QG 1 66 TYR HB3 . . 5.000 4.421 3.818 4.834 . 0 0 "[ . 1 . 2]" 1
724 1 59 VAL QG 1 66 TYR QD . . 4.350 3.951 2.520 4.471 0.121 11 0 "[ . 1 . 2]" 1
725 1 59 VAL QG 1 69 VAL HB . . 4.250 3.791 3.091 4.363 0.113 16 0 "[ . 1 . 2]" 1
726 1 59 VAL QG 1 69 VAL QG . . 4.150 2.338 1.648 2.920 . 0 0 "[ . 1 . 2]" 1
727 1 59 VAL MG1 1 63 SER H . . 4.880 4.272 3.632 4.889 0.009 8 0 "[ . 1 . 2]" 1
728 1 59 VAL MG1 1 65 ASN H . . 5.500 3.269 2.778 4.524 . 0 0 "[ . 1 . 2]" 1
729 1 59 VAL MG1 1 66 TYR H . . 4.710 3.111 2.536 3.858 . 0 0 "[ . 1 . 2]" 1
730 1 60 GLU H 1 60 GLU QB . . 3.180 2.289 2.055 2.965 . 0 0 "[ . 1 . 2]" 1
731 1 60 GLU H 1 60 GLU QG . . 3.940 3.227 2.120 3.931 . 0 0 "[ . 1 . 2]" 1
732 1 60 GLU H 1 61 GLY H . . 4.800 4.513 4.199 4.709 . 0 0 "[ . 1 . 2]" 1
733 1 60 GLU H 1 63 SER HB2 . . 4.650 4.452 3.806 4.737 0.087 17 0 "[ . 1 . 2]" 1
734 1 60 GLU H 1 66 TYR QD . . 5.500 4.541 3.962 4.931 . 0 0 "[ . 1 . 2]" 1
735 1 60 GLU H 1 69 VAL QG . . 4.830 4.688 4.334 4.786 . 0 0 "[ . 1 . 2]" 1
736 1 60 GLU HA 1 60 GLU QG . . 3.650 2.585 1.944 3.523 . 0 0 "[ . 1 . 2]" 1
737 1 60 GLU HA 1 61 GLY H . . 2.950 2.761 2.499 3.021 0.071 3 0 "[ . 1 . 2]" 1
738 1 60 GLU HA 1 61 GLY HA2 . . 5.160 4.838 4.671 5.042 . 0 0 "[ . 1 . 2]" 1
739 1 60 GLU HA 1 61 GLY HA3 . . 5.200 4.678 4.518 4.822 . 0 0 "[ . 1 . 2]" 1
740 1 60 GLU HA 1 62 GLY H . . 5.090 3.555 2.854 4.176 . 0 0 "[ . 1 . 2]" 1
741 1 60 GLU HA 1 63 SER H . . 5.160 4.175 3.834 4.665 . 0 0 "[ . 1 . 2]" 1
742 1 60 GLU HA 1 63 SER HB2 . . 5.120 4.608 4.177 4.946 . 0 0 "[ . 1 . 2]" 1
743 1 60 GLU HA 1 66 TYR QE . . 3.680 3.030 2.046 3.621 . 0 0 "[ . 1 . 2]" 1
744 1 60 GLU QB 1 61 GLY H . . 3.740 2.336 1.909 2.670 . 0 0 "[ . 1 . 2]" 1
745 1 60 GLU QB 1 62 GLY H . . 4.770 4.487 3.984 4.674 . 0 0 "[ . 1 . 2]" 1
746 1 60 GLU QB 1 66 TYR QE . . 5.310 3.948 2.797 4.646 . 0 0 "[ . 1 . 2]" 1
747 1 60 GLU QG 1 61 GLY H . . 4.140 2.513 1.655 3.539 . 0 0 "[ . 1 . 2]" 1
748 1 60 GLU QG 1 61 GLY HA3 . . 4.950 4.140 2.451 5.189 0.239 4 0 "[ . 1 . 2]" 1
749 1 60 GLU QG 1 62 GLY H . . 5.340 4.310 3.543 4.956 . 0 0 "[ . 1 . 2]" 1
750 1 60 GLU QG 1 63 SER H . . 5.500 5.256 4.809 5.387 . 0 0 "[ . 1 . 2]" 1
751 1 61 GLY H 1 62 GLY H . . 3.950 2.731 2.297 3.230 . 0 0 "[ . 1 . 2]" 1
752 1 61 GLY H 1 62 GLY HA2 . . 5.450 5.017 4.517 5.498 0.048 7 0 "[ . 1 . 2]" 1
753 1 61 GLY H 1 62 GLY QA . . 5.500 4.579 4.180 4.987 . 0 0 "[ . 1 . 2]" 1
754 1 61 GLY H 1 63 SER HB2 . . 5.500 5.461 4.986 5.585 0.085 9 0 "[ . 1 . 2]" 1
755 1 61 GLY H 1 66 TYR QD . . 5.340 3.915 3.412 4.352 . 0 0 "[ . 1 . 2]" 1
756 1 61 GLY H 1 66 TYR QE . . 5.450 3.664 2.543 4.431 . 0 0 "[ . 1 . 2]" 1
757 1 61 GLY HA2 1 62 GLY H . . 3.530 3.161 2.630 3.401 . 0 0 "[ . 1 . 2]" 1
758 1 61 GLY HA2 1 62 GLY HA3 . . 5.460 4.522 4.314 4.675 . 0 0 "[ . 1 . 2]" 1
759 1 61 GLY HA3 1 63 SER HB2 . . 5.500 4.732 3.782 5.530 0.030 12 0 "[ . 1 . 2]" 1
760 1 61 GLY HA3 1 66 TYR QD . . 5.500 5.556 5.108 5.931 0.431 10 0 "[ . 1 . 2]" 1
761 1 62 GLY H 1 66 TYR QD . . 5.190 3.045 2.644 3.526 . 0 0 "[ . 1 . 2]" 1
762 1 62 GLY H 1 66 TYR QE . . 5.500 3.795 3.519 4.096 . 0 0 "[ . 1 . 2]" 1
763 1 62 GLY HA2 1 66 TYR H . . 5.190 4.877 4.269 5.253 0.063 12 0 "[ . 1 . 2]" 1
764 1 62 GLY HA2 1 66 TYR QE . . 4.610 3.963 3.557 4.384 . 0 0 "[ . 1 . 2]" 1
765 1 63 SER H 1 63 SER HB2 . . 3.650 2.202 1.952 2.406 . 0 0 "[ . 1 . 2]" 1
766 1 63 SER H 1 63 SER HB3 . . 3.640 3.031 2.328 3.564 . 0 0 "[ . 1 . 2]" 1
767 1 63 SER H 1 66 TYR H . . 4.640 4.106 3.480 4.420 . 0 0 "[ . 1 . 2]" 1
768 1 63 SER H 1 66 TYR HB2 . . 4.180 2.365 1.892 2.710 . 0 0 "[ . 1 . 2]" 1
769 1 63 SER H 1 66 TYR HB3 . . 5.020 3.500 3.100 3.979 . 0 0 "[ . 1 . 2]" 1
770 1 63 SER H 1 66 TYR QD . . 4.900 3.796 3.388 4.245 . 0 0 "[ . 1 . 2]" 1
771 1 63 SER H 1 66 TYR QE . . 5.500 5.400 4.971 5.578 0.078 6 0 "[ . 1 . 2]" 1
772 1 63 SER HA 1 66 TYR H . . 4.780 4.606 4.262 4.846 0.066 14 0 "[ . 1 . 2]" 1
773 1 63 SER HB2 1 65 ASN H . . 5.330 4.919 3.986 5.411 0.081 7 0 "[ . 1 . 2]" 1
774 1 63 SER HB2 1 66 TYR H . . 5.380 4.338 3.662 4.838 . 0 0 "[ . 1 . 2]" 1
775 1 63 SER HB3 1 65 ASN H . . 5.110 3.618 2.242 4.767 . 0 0 "[ . 1 . 2]" 1
776 1 63 SER HB3 1 66 TYR H . . 4.780 3.501 2.579 4.582 . 0 0 "[ . 1 . 2]" 1
777 1 63 SER HB3 1 66 TYR HB2 . . 5.130 3.505 2.194 4.412 . 0 0 "[ . 1 . 2]" 1
778 1 63 SER HB3 1 66 TYR HB3 . . 5.500 4.691 3.587 5.581 0.081 14 0 "[ . 1 . 2]" 1
779 1 64 HIS HA 1 66 TYR H . . 5.240 3.895 3.674 4.079 . 0 0 "[ . 1 . 2]" 1
780 1 64 HIS QB 1 65 ASN H . . 5.060 2.515 2.012 3.516 . 0 0 "[ . 1 . 2]" 1
781 1 64 HIS HB2 1 65 ASN H . . 4.480 2.930 2.035 3.840 . 0 0 "[ . 1 . 2]" 1
782 1 65 ASN H 1 66 TYR H . . 4.070 2.697 2.170 2.975 . 0 0 "[ . 1 . 2]" 1
783 1 65 ASN H 1 66 TYR HA . . 5.500 4.978 4.561 5.311 . 0 0 "[ . 1 . 2]" 1
784 1 65 ASN HA 1 67 GLY H . . 5.500 4.026 3.632 4.421 . 0 0 "[ . 1 . 2]" 1
785 1 65 ASN HA 1 68 GLU H . . 4.380 3.218 3.014 3.430 . 0 0 "[ . 1 . 2]" 1
786 1 65 ASN HA 1 68 GLU HA . . 5.460 5.459 5.190 5.543 0.083 19 0 "[ . 1 . 2]" 1
787 1 65 ASN HA 1 68 GLU HB2 . . 4.570 3.084 2.433 4.131 . 0 0 "[ . 1 . 2]" 1
788 1 65 ASN HA 1 69 VAL QG . . 5.500 4.478 4.067 4.804 . 0 0 "[ . 1 . 2]" 1
789 1 65 ASN QB 1 68 GLU H . . 5.400 4.297 3.972 4.726 . 0 0 "[ . 1 . 2]" 1
790 1 65 ASN QB 1 69 VAL QG . . 4.730 3.155 2.444 3.775 . 0 0 "[ . 1 . 2]" 1
791 1 66 TYR H 1 66 TYR HB2 . . 3.580 2.559 2.377 2.697 . 0 0 "[ . 1 . 2]" 1
792 1 66 TYR H 1 66 TYR HB3 . . 3.570 2.466 2.291 2.641 . 0 0 "[ . 1 . 2]" 1
793 1 66 TYR H 1 66 TYR QD . . 4.450 4.189 4.099 4.245 . 0 0 "[ . 1 . 2]" 1
794 1 66 TYR H 1 67 GLY H . . 3.920 2.965 2.778 3.189 . 0 0 "[ . 1 . 2]" 1
795 1 66 TYR HA 1 66 TYR QD . . 4.290 2.567 2.191 3.012 . 0 0 "[ . 1 . 2]" 1
796 1 66 TYR HA 1 69 VAL H . . 4.530 3.669 3.428 3.885 . 0 0 "[ . 1 . 2]" 1
797 1 66 TYR HA 1 69 VAL HB . . 4.630 4.435 3.669 4.702 0.072 2 0 "[ . 1 . 2]" 1
798 1 66 TYR HA 1 69 VAL QG . . 3.290 2.102 1.909 2.785 . 0 0 "[ . 1 . 2]" 1
799 1 66 TYR HB2 1 67 GLY H . . 4.570 3.953 3.806 4.149 . 0 0 "[ . 1 . 2]" 1
800 1 66 TYR HB3 1 67 GLY H . . 4.130 2.579 2.400 2.866 . 0 0 "[ . 1 . 2]" 1
801 1 66 TYR HB3 1 67 GLY HA2 . . 4.990 4.432 4.254 4.669 . 0 0 "[ . 1 . 2]" 1
802 1 66 TYR QD 1 67 GLY H . . 4.630 3.436 2.827 4.110 . 0 0 "[ . 1 . 2]" 1
803 1 66 TYR QD 1 70 LYS H . . 5.500 4.410 3.875 4.764 . 0 0 "[ . 1 . 2]" 1
804 1 66 TYR QE 1 67 GLY H . . 5.500 5.381 4.997 5.591 0.091 7 0 "[ . 1 . 2]" 1
805 1 66 TYR QE 1 70 LYS H . . 5.500 5.134 4.724 5.528 0.028 14 0 "[ . 1 . 2]" 1
806 1 66 TYR QE 1 70 LYS HB3 . . 4.450 4.268 3.828 4.886 0.436 14 0 "[ . 1 . 2]" 1
807 1 67 GLY H 1 68 GLU H . . 3.620 2.770 2.672 2.946 . 0 0 "[ . 1 . 2]" 1
808 1 67 GLY H 1 68 GLU HB2 . . 5.500 4.900 4.426 5.726 0.226 10 0 "[ . 1 . 2]" 1
809 1 67 GLY H 1 70 LYS HB2 . . 5.500 5.412 5.177 5.582 0.082 19 0 "[ . 1 . 2]" 1
810 1 67 GLY HA2 1 70 LYS H . . 5.500 3.729 3.545 3.948 . 0 0 "[ . 1 . 2]" 1
811 1 67 GLY HA2 1 70 LYS HA . . 5.500 5.519 5.188 5.579 0.079 11 0 "[ . 1 . 2]" 1
812 1 67 GLY HA2 1 71 ALA H . . 4.800 3.701 3.357 3.978 . 0 0 "[ . 1 . 2]" 1
813 1 68 GLU H 1 68 GLU HB2 . . 3.210 2.386 2.005 3.033 . 0 0 "[ . 1 . 2]" 1
814 1 68 GLU H 1 68 GLU HG2 . . 3.750 3.418 1.956 4.473 0.723 8 2 "[ . + 1 . - 2]" 1
815 1 68 GLU H 1 69 VAL QG . . 4.870 3.840 3.454 4.276 . 0 0 "[ . 1 . 2]" 1
816 1 68 GLU HA 1 68 GLU HG2 . . 3.610 2.616 2.268 3.397 . 0 0 "[ . 1 . 2]" 1
817 1 68 GLU HA 1 68 GLU HG3 . . 3.950 3.216 2.098 3.893 . 0 0 "[ . 1 . 2]" 1
818 1 68 GLU HB2 1 69 VAL H . . 3.860 2.714 2.251 4.090 0.230 10 0 "[ . 1 . 2]" 1
819 1 68 GLU HB3 1 69 VAL H . . 4.270 3.212 2.469 3.600 . 0 0 "[ . 1 . 2]" 1
820 1 68 GLU HB3 1 72 ALA H . . 5.500 5.157 4.665 5.829 0.329 10 0 "[ . 1 . 2]" 1
821 1 68 GLU HG2 1 71 ALA MB . . 5.500 4.944 4.093 5.647 0.147 11 0 "[ . 1 . 2]" 1
822 1 69 VAL H 1 69 VAL HB . . 3.610 2.900 2.291 3.658 0.048 16 0 "[ . 1 . 2]" 1
823 1 69 VAL H 1 69 VAL QG . . 3.380 2.119 1.830 2.326 . 0 0 "[ . 1 . 2]" 1
824 1 69 VAL H 1 70 LYS H . . 3.590 2.704 2.563 2.844 . 0 0 "[ . 1 . 2]" 1
825 1 69 VAL HA 1 72 ALA H . . 4.190 3.423 3.090 3.714 . 0 0 "[ . 1 . 2]" 1
826 1 69 VAL HA 1 72 ALA MB . . 3.550 2.425 2.185 2.912 . 0 0 "[ . 1 . 2]" 1
827 1 69 VAL HB 1 70 LYS H . . 3.860 3.725 2.787 3.939 0.079 1 0 "[ . 1 . 2]" 1
828 1 69 VAL HB 1 72 ALA MB . . 5.500 4.455 3.934 4.812 . 0 0 "[ . 1 . 2]" 1
829 1 69 VAL QG 1 70 LYS H . . 4.000 2.364 2.103 3.340 . 0 0 "[ . 1 . 2]" 1
830 1 69 VAL QG 1 72 ALA H . . 5.500 4.496 4.194 4.785 . 0 0 "[ . 1 . 2]" 1
831 1 70 LYS H 1 70 LYS HB2 . . 3.810 2.550 2.352 2.703 . 0 0 "[ . 1 . 2]" 1
832 1 70 LYS H 1 70 LYS HB3 . . 4.070 2.488 2.243 2.686 . 0 0 "[ . 1 . 2]" 1
833 1 70 LYS H 1 70 LYS QG . . 4.520 4.020 3.894 4.108 . 0 0 "[ . 1 . 2]" 1
834 1 70 LYS H 1 71 ALA H . . 3.640 2.814 2.710 2.918 . 0 0 "[ . 1 . 2]" 1
835 1 70 LYS H 1 71 ALA MB . . 5.020 4.455 4.296 4.569 . 0 0 "[ . 1 . 2]" 1
836 1 70 LYS H 1 72 ALA H . . 4.920 4.161 3.961 4.291 . 0 0 "[ . 1 . 2]" 1
837 1 70 LYS HA 1 73 TYR H . . 4.500 3.544 3.090 3.743 . 0 0 "[ . 1 . 2]" 1
838 1 70 LYS HA 1 73 TYR HB2 . . 4.830 3.790 3.183 4.193 . 0 0 "[ . 1 . 2]" 1
839 1 70 LYS HA 1 73 TYR HB3 . . 4.720 2.719 2.372 2.951 . 0 0 "[ . 1 . 2]" 1
840 1 70 LYS HA 1 73 TYR QD . . 5.120 3.892 3.260 4.432 . 0 0 "[ . 1 . 2]" 1
841 1 70 LYS HA 1 74 GLU H . . 5.100 3.931 3.802 4.138 . 0 0 "[ . 1 . 2]" 1
842 1 70 LYS HB2 1 71 ALA H . . 5.380 3.902 3.760 4.016 . 0 0 "[ . 1 . 2]" 1
843 1 70 LYS HB3 1 70 LYS QD . . 3.890 2.716 2.163 3.372 . 0 0 "[ . 1 . 2]" 1
844 1 70 LYS QD 1 71 ALA HA . . 4.170 3.584 2.492 4.264 0.094 15 0 "[ . 1 . 2]" 1
845 1 70 LYS QE 1 73 TYR QD . . 4.930 4.188 3.102 5.011 0.081 18 0 "[ . 1 . 2]" 1
846 1 70 LYS QE 1 74 GLU HB2 . . 4.970 3.710 2.049 5.277 0.307 12 0 "[ . 1 . 2]" 1
847 1 70 LYS QE 1 74 GLU HG2 . . 5.320 3.611 2.209 4.939 . 0 0 "[ . 1 . 2]" 1
848 1 70 LYS QG 1 73 TYR QD . . 5.500 4.418 3.266 5.533 0.033 20 0 "[ . 1 . 2]" 1
849 1 70 LYS QG 1 74 GLU HB2 . . 4.800 4.517 3.538 5.636 0.836 12 2 "[ - . 1 + . 2]" 1
850 1 70 LYS QG 1 74 GLU HG2 . . 5.350 4.733 2.734 5.432 0.082 17 0 "[ . 1 . 2]" 1
851 1 71 ALA H 1 71 ALA MB . . 3.430 2.229 2.146 2.271 . 0 0 "[ . 1 . 2]" 1
852 1 71 ALA H 1 72 ALA H . . 3.280 2.751 2.688 2.887 . 0 0 "[ . 1 . 2]" 1
853 1 71 ALA HA 1 74 GLU H . . 4.400 3.706 3.495 3.938 . 0 0 "[ . 1 . 2]" 1
854 1 71 ALA MB 1 72 ALA H . . 4.540 2.534 2.318 2.701 . 0 0 "[ . 1 . 2]" 1
855 1 71 ALA MB 1 74 GLU H . . 5.450 4.888 4.720 5.025 . 0 0 "[ . 1 . 2]" 1
856 1 71 ALA MB 1 75 ALA H . . 4.750 4.492 4.311 4.715 . 0 0 "[ . 1 . 2]" 1
857 1 72 ALA H 1 72 ALA MB . . 3.120 2.218 2.120 2.266 . 0 0 "[ . 1 . 2]" 1
858 1 72 ALA MB 1 73 TYR H . . 4.020 2.488 2.348 2.658 . 0 0 "[ . 1 . 2]" 1
859 1 72 ALA MB 1 73 TYR QD . . 5.310 5.317 5.063 5.399 0.089 15 0 "[ . 1 . 2]" 1
860 1 72 ALA MB 1 74 GLU H . . 4.870 4.771 4.625 4.947 0.077 4 0 "[ . 1 . 2]" 1
861 1 73 TYR H 1 73 TYR HB2 . . 3.820 2.573 2.416 2.692 . 0 0 "[ . 1 . 2]" 1
862 1 73 TYR H 1 73 TYR HB3 . . 3.750 2.369 2.169 2.540 . 0 0 "[ . 1 . 2]" 1
863 1 73 TYR H 1 73 TYR QD . . 4.470 4.162 4.034 4.265 . 0 0 "[ . 1 . 2]" 1
864 1 73 TYR H 1 74 GLU H . . 3.760 2.907 2.708 3.000 . 0 0 "[ . 1 . 2]" 1
865 1 73 TYR HA 1 73 TYR QD . . 3.420 2.743 2.473 3.044 . 0 0 "[ . 1 . 2]" 1
866 1 73 TYR HA 1 76 ALA H . . 4.980 3.795 3.474 4.012 . 0 0 "[ . 1 . 2]" 1
867 1 73 TYR HA 1 76 ALA MB . . 3.640 2.914 2.474 3.223 . 0 0 "[ . 1 . 2]" 1
868 1 73 TYR HA 1 77 PHE H . . 4.870 3.944 3.742 4.186 . 0 0 "[ . 1 . 2]" 1
869 1 73 TYR HB2 1 74 GLU H . . 4.440 3.884 3.735 3.999 . 0 0 "[ . 1 . 2]" 1
870 1 73 TYR HB3 1 74 GLU H . . 4.190 2.473 2.304 2.663 . 0 0 "[ . 1 . 2]" 1
871 1 73 TYR QD 1 74 GLU H . . 4.540 3.072 2.700 3.539 . 0 0 "[ . 1 . 2]" 1
872 1 73 TYR QD 1 74 GLU HA . . 3.850 3.469 2.762 3.925 0.075 6 0 "[ . 1 . 2]" 1
873 1 73 TYR QD 1 74 GLU HB2 . . 4.500 4.333 3.020 4.587 0.087 20 0 "[ . 1 . 2]" 1
874 1 73 TYR QD 1 74 GLU HG2 . . 4.120 3.305 2.126 4.201 0.081 12 0 "[ . 1 . 2]" 1
875 1 73 TYR QD 1 76 ALA MB . . 4.840 4.462 3.740 4.863 0.023 17 0 "[ . 1 . 2]" 1
876 1 73 TYR QD 1 77 PHE H . . 5.500 4.903 4.357 5.322 . 0 0 "[ . 1 . 2]" 1
877 1 74 GLU H 1 74 GLU HB2 . . 3.640 2.376 2.019 3.653 0.013 12 0 "[ . 1 . 2]" 1
878 1 74 GLU H 1 74 GLU HG2 . . 3.980 3.374 2.410 4.064 0.084 11 0 "[ . 1 . 2]" 1
879 1 74 GLU H 1 74 GLU HG3 . . 4.150 3.149 2.130 4.165 0.015 11 0 "[ . 1 . 2]" 1
880 1 74 GLU H 1 75 ALA H . . 4.050 2.773 2.590 2.935 . 0 0 "[ . 1 . 2]" 1
881 1 74 GLU H 1 75 ALA MB . . 5.500 4.429 4.276 4.643 . 0 0 "[ . 1 . 2]" 1
882 1 74 GLU H 1 76 ALA MB . . 5.500 5.072 4.662 5.514 0.014 4 0 "[ . 1 . 2]" 1
883 1 74 GLU HA 1 74 GLU HG3 . . 4.030 3.345 2.903 3.715 . 0 0 "[ . 1 . 2]" 1
884 1 74 GLU HA 1 75 ALA MB . . 5.500 5.055 4.976 5.124 . 0 0 "[ . 1 . 2]" 1
885 1 74 GLU HA 1 76 ALA H . . 5.400 4.690 4.506 4.968 . 0 0 "[ . 1 . 2]" 1
886 1 74 GLU HA 1 77 PHE H . . 4.460 3.479 3.280 3.683 . 0 0 "[ . 1 . 2]" 1
887 1 74 GLU HA 1 77 PHE HA . . 5.500 5.352 5.044 5.578 0.078 6 0 "[ . 1 . 2]" 1
888 1 74 GLU HA 1 77 PHE HB2 . . 4.940 3.483 2.866 3.937 . 0 0 "[ . 1 . 2]" 1
889 1 74 GLU HA 1 77 PHE HB3 . . 5.000 2.585 2.253 3.006 . 0 0 "[ . 1 . 2]" 1
890 1 74 GLU HA 1 78 ASN H . . 4.610 3.867 3.624 4.206 . 0 0 "[ . 1 . 2]" 1
891 1 74 GLU HB2 1 75 ALA H . . 3.870 2.928 2.450 3.685 . 0 0 "[ . 1 . 2]" 1
892 1 74 GLU HB3 1 78 ASN QD . . 4.960 3.492 2.518 5.200 0.240 12 0 "[ . 1 . 2]" 1
893 1 74 GLU HG2 1 75 ALA H . . 5.490 4.793 3.770 5.083 . 0 0 "[ . 1 . 2]" 1
894 1 74 GLU HG3 1 75 ALA H . . 5.200 4.618 2.089 5.196 . 0 0 "[ . 1 . 2]" 1
895 1 75 ALA H 1 75 ALA MB . . 3.240 2.253 2.187 2.345 . 0 0 "[ . 1 . 2]" 1
896 1 75 ALA H 1 76 ALA H . . 3.380 2.868 2.717 3.072 . 0 0 "[ . 1 . 2]" 1
897 1 75 ALA H 1 77 PHE H . . 4.910 4.135 3.934 4.324 . 0 0 "[ . 1 . 2]" 1
898 1 75 ALA H 1 78 ASN H . . 5.500 4.983 4.837 5.148 . 0 0 "[ . 1 . 2]" 1
899 1 75 ALA H 1 78 ASN QD . . 4.660 4.095 3.857 4.445 . 0 0 "[ . 1 . 2]" 1
900 1 75 ALA HA 1 77 PHE H . . 4.750 4.502 4.122 4.698 . 0 0 "[ . 1 . 2]" 1
901 1 75 ALA HA 1 78 ASN H . . 4.330 3.924 3.495 4.224 . 0 0 "[ . 1 . 2]" 1
902 1 75 ALA HA 1 78 ASN QB . . 4.490 3.958 3.045 4.375 . 0 0 "[ . 1 . 2]" 1
903 1 75 ALA HA 1 78 ASN QD . . 4.700 2.306 1.915 3.178 . 0 0 "[ . 1 . 2]" 1
904 1 75 ALA HA 1 121 LEU QD . . 5.500 3.252 2.050 4.185 . 0 0 "[ . 1 . 2]" 1
905 1 75 ALA MB 1 76 ALA H . . 3.540 2.433 2.219 2.657 . 0 0 "[ . 1 . 2]" 1
906 1 75 ALA MB 1 121 LEU QD . . 4.500 3.419 1.981 4.434 . 0 0 "[ . 1 . 2]" 1
907 1 76 ALA H 1 76 ALA MB . . 3.380 2.218 2.107 2.264 . 0 0 "[ . 1 . 2]" 1
908 1 76 ALA H 1 77 PHE H . . 3.610 2.722 2.567 2.834 . 0 0 "[ . 1 . 2]" 1
909 1 76 ALA H 1 77 PHE HB3 . . 4.870 4.911 4.646 5.341 0.471 17 0 "[ . 1 . 2]" 1
910 1 76 ALA HA 1 77 PHE HA . . 5.170 4.829 4.736 4.923 . 0 0 "[ . 1 . 2]" 1
911 1 76 ALA HA 1 78 ASN H . . 5.070 4.836 4.480 5.098 0.028 10 0 "[ . 1 . 2]" 1
912 1 76 ALA HA 1 79 ASN H . . 5.040 3.524 2.992 3.654 . 0 0 "[ . 1 . 2]" 1
913 1 76 ALA HA 1 79 ASN HA . . 5.070 5.114 4.955 5.159 0.089 15 0 "[ . 1 . 2]" 1
914 1 76 ALA HA 1 79 ASN QB . . 3.600 2.204 2.054 2.783 . 0 0 "[ . 1 . 2]" 1
915 1 76 ALA HA 1 79 ASN QD . . 4.580 3.080 2.120 3.993 . 0 0 "[ . 1 . 2]" 1
916 1 76 ALA HA 1 80 ALA H . . 4.660 3.698 3.501 3.821 . 0 0 "[ . 1 . 2]" 1
917 1 76 ALA MB 1 77 PHE H . . 3.960 2.670 2.442 2.833 . 0 0 "[ . 1 . 2]" 1
918 1 76 ALA MB 1 77 PHE HA . . 4.210 3.880 3.697 3.970 . 0 0 "[ . 1 . 2]" 1
919 1 76 ALA MB 1 77 PHE QD . . 5.450 5.293 4.964 5.514 0.064 3 0 "[ . 1 . 2]" 1
920 1 76 ALA MB 1 79 ASN QB . . 5.390 3.741 3.570 4.226 . 0 0 "[ . 1 . 2]" 1
921 1 77 PHE H 1 77 PHE HB2 . . 3.880 2.552 2.246 2.746 . 0 0 "[ . 1 . 2]" 1
922 1 77 PHE H 1 77 PHE HB3 . . 3.950 2.467 2.204 2.807 . 0 0 "[ . 1 . 2]" 1
923 1 77 PHE H 1 77 PHE QD . . 4.750 4.197 4.071 4.269 . 0 0 "[ . 1 . 2]" 1
924 1 77 PHE H 1 78 ASN H . . 3.760 2.871 2.643 3.056 . 0 0 "[ . 1 . 2]" 1
925 1 77 PHE H 1 78 ASN HA . . 5.440 5.405 5.237 5.499 0.059 19 0 "[ . 1 . 2]" 1
926 1 77 PHE H 1 78 ASN QD . . 5.060 4.529 4.178 4.839 . 0 0 "[ . 1 . 2]" 1
927 1 77 PHE H 1 79 ASN H . . 4.890 3.978 3.771 4.241 . 0 0 "[ . 1 . 2]" 1
928 1 77 PHE HA 1 79 ASN H . . 5.440 4.514 4.315 4.732 . 0 0 "[ . 1 . 2]" 1
929 1 77 PHE HA 1 80 ALA H . . 4.620 3.754 3.296 4.022 . 0 0 "[ . 1 . 2]" 1
930 1 77 PHE HA 1 80 ALA MB . . 3.840 3.086 2.570 3.411 . 0 0 "[ . 1 . 2]" 1
931 1 77 PHE HA 1 81 PHE H . . 4.830 3.931 3.610 4.252 . 0 0 "[ . 1 . 2]" 1
932 1 77 PHE HB2 1 78 ASN H . . 4.310 3.843 3.583 4.107 . 0 0 "[ . 1 . 2]" 1
933 1 77 PHE HB3 1 78 ASN H . . 4.580 2.444 2.171 2.766 . 0 0 "[ . 1 . 2]" 1
934 1 77 PHE QD 1 78 ASN H . . 4.680 3.246 2.667 4.005 . 0 0 "[ . 1 . 2]" 1
935 1 77 PHE QD 1 81 PHE H . . 5.310 4.871 3.992 5.352 0.042 11 0 "[ . 1 . 2]" 1
936 1 78 ASN H 1 78 ASN QB . . 3.430 2.530 2.348 2.818 . 0 0 "[ . 1 . 2]" 1
937 1 78 ASN H 1 78 ASN QD . . 4.540 2.679 2.192 3.139 . 0 0 "[ . 1 . 2]" 1
938 1 78 ASN H 1 79 ASN H . . 3.750 2.647 2.551 2.762 . 0 0 "[ . 1 . 2]" 1
939 1 78 ASN H 1 79 ASN QB . . 5.020 4.366 4.250 4.878 . 0 0 "[ . 1 . 2]" 1
940 1 78 ASN H 1 80 ALA H . . 5.050 4.422 4.197 4.584 . 0 0 "[ . 1 . 2]" 1
941 1 78 ASN H 1 80 ALA MB . . 5.400 5.184 4.813 5.421 0.021 19 0 "[ . 1 . 2]" 1
942 1 78 ASN HA 1 80 ALA H . . 4.570 4.584 4.419 4.649 0.079 9 0 "[ . 1 . 2]" 1
943 1 78 ASN HA 1 81 PHE H . . 4.130 3.615 3.275 3.867 . 0 0 "[ . 1 . 2]" 1
944 1 78 ASN HA 1 81 PHE QB . . 4.070 2.734 2.412 4.021 . 0 0 "[ . 1 . 2]" 1
945 1 78 ASN HA 1 82 ASN H . . 4.430 3.630 3.306 3.979 . 0 0 "[ . 1 . 2]" 1
946 1 78 ASN QB 1 79 ASN H . . 3.870 3.015 2.304 3.565 . 0 0 "[ . 1 . 2]" 1
947 1 78 ASN QB 1 118 ALA MB . . 5.060 4.293 2.722 4.965 . 0 0 "[ . 1 . 2]" 1
948 1 78 ASN QB 1 121 LEU QD . . 5.500 3.327 1.948 4.684 . 0 0 "[ . 1 . 2]" 1
949 1 78 ASN QD 1 79 ASN H . . 4.670 3.505 2.981 4.008 . 0 0 "[ . 1 . 2]" 1
950 1 78 ASN QD 1 79 ASN HA . . 5.500 5.087 4.563 5.417 . 0 0 "[ . 1 . 2]" 1
951 1 78 ASN QD 1 121 LEU QD . . 5.250 2.578 1.641 4.307 . 0 0 "[ . 1 . 2]" 1
952 1 79 ASN H 1 79 ASN QB . . 3.040 2.219 2.135 2.753 . 0 0 "[ . 1 . 2]" 1
953 1 79 ASN H 1 79 ASN QD . . 4.520 4.147 3.668 4.298 . 0 0 "[ . 1 . 2]" 1
954 1 79 ASN H 1 80 ALA H . . 3.700 2.829 2.620 3.032 . 0 0 "[ . 1 . 2]" 1
955 1 79 ASN H 1 80 ALA MB . . 4.810 4.466 4.209 4.686 . 0 0 "[ . 1 . 2]" 1
956 1 79 ASN H 1 81 PHE H . . 4.890 4.346 4.016 4.735 . 0 0 "[ . 1 . 2]" 1
957 1 79 ASN HA 1 81 PHE H . . 5.080 4.899 4.593 5.093 0.013 14 0 "[ . 1 . 2]" 1
958 1 79 ASN HA 1 82 ASN H . . 4.650 4.013 3.399 4.283 . 0 0 "[ . 1 . 2]" 1
959 1 79 ASN HA 1 82 ASN HB2 . . 4.930 4.251 3.699 4.789 . 0 0 "[ . 1 . 2]" 1
960 1 79 ASN HA 1 118 ALA MB . . 4.970 3.709 2.362 4.684 . 0 0 "[ . 1 . 2]" 1
961 1 79 ASN QB 1 80 ALA H . . 3.480 2.531 2.157 3.499 0.019 11 0 "[ . 1 . 2]" 1
962 1 79 ASN QD 1 80 ALA H . . 5.120 2.757 2.347 3.921 . 0 0 "[ . 1 . 2]" 1
963 1 79 ASN QD 1 80 ALA HA . . 5.300 3.088 2.723 5.202 . 0 0 "[ . 1 . 2]" 1
964 1 79 ASN QD 1 80 ALA MB . . 5.500 2.949 2.384 4.198 . 0 0 "[ . 1 . 2]" 1
965 1 80 ALA H 1 80 ALA MB . . 3.540 2.220 2.111 2.292 . 0 0 "[ . 1 . 2]" 1
966 1 80 ALA H 1 81 PHE H . . 3.690 2.736 2.581 3.040 . 0 0 "[ . 1 . 2]" 1
967 1 80 ALA HA 1 81 PHE HA . . 5.030 4.805 4.593 4.894 . 0 0 "[ . 1 . 2]" 1
968 1 80 ALA HA 1 83 ALA H . . 4.200 3.474 3.258 3.808 . 0 0 "[ . 1 . 2]" 1
969 1 80 ALA MB 1 81 PHE H . . 4.250 2.409 2.228 2.628 . 0 0 "[ . 1 . 2]" 1
970 1 80 ALA MB 1 81 PHE HA . . 4.470 3.802 3.669 3.999 . 0 0 "[ . 1 . 2]" 1
971 1 80 ALA MB 1 82 ASN H . . 5.330 4.625 4.525 4.762 . 0 0 "[ . 1 . 2]" 1
972 1 80 ALA MB 1 83 ALA H . . 5.060 4.593 4.431 4.802 . 0 0 "[ . 1 . 2]" 1
973 1 80 ALA MB 1 84 VAL H . . 5.500 4.408 4.210 4.651 . 0 0 "[ . 1 . 2]" 1
974 1 80 ALA MB 1 84 VAL HB . . 5.170 4.810 4.388 5.245 0.075 15 0 "[ . 1 . 2]" 1
975 1 81 PHE H 1 81 PHE QB . . 3.670 2.188 2.062 2.301 . 0 0 "[ . 1 . 2]" 1
976 1 81 PHE H 1 81 PHE QD . . 4.960 4.091 2.902 4.271 . 0 0 "[ . 1 . 2]" 1
977 1 81 PHE H 1 82 ASN H . . 3.790 2.871 2.738 2.951 . 0 0 "[ . 1 . 2]" 1
978 1 81 PHE H 1 83 ALA H . . 5.320 4.179 3.941 4.364 . 0 0 "[ . 1 . 2]" 1
979 1 81 PHE H 1 84 VAL H . . 5.330 4.917 4.655 5.041 . 0 0 "[ . 1 . 2]" 1
980 1 81 PHE HA 1 81 PHE QD . . 3.900 2.810 2.253 3.605 . 0 0 "[ . 1 . 2]" 1
981 1 81 PHE HA 1 83 ALA H . . 5.250 4.513 4.309 4.710 . 0 0 "[ . 1 . 2]" 1
982 1 81 PHE HA 1 84 VAL H . . 5.040 3.816 3.568 4.073 . 0 0 "[ . 1 . 2]" 1
983 1 81 PHE HA 1 84 VAL HB . . 4.580 3.669 2.696 4.661 0.081 13 0 "[ . 1 . 2]" 1
984 1 81 PHE HA 1 84 VAL QG . . 5.500 3.090 2.117 3.863 . 0 0 "[ . 1 . 2]" 1
985 1 81 PHE QB 1 82 ASN H . . 4.270 2.566 2.314 3.594 . 0 0 "[ . 1 . 2]" 1
986 1 81 PHE QD 1 82 ASN H . . 4.060 3.705 3.150 4.152 0.092 19 0 "[ . 1 . 2]" 1
987 1 81 PHE QD 1 82 ASN HA . . 4.280 3.705 2.898 4.372 0.092 2 0 "[ . 1 . 2]" 1
988 1 81 PHE QD 1 85 ARG QB . . 4.180 3.453 2.717 4.141 . 0 0 "[ . 1 . 2]" 1
989 1 82 ASN H 1 82 ASN HB2 . . 3.680 2.469 2.115 2.825 . 0 0 "[ . 1 . 2]" 1
990 1 82 ASN H 1 82 ASN HB3 . . 3.290 2.767 2.316 3.255 . 0 0 "[ . 1 . 2]" 1
991 1 82 ASN H 1 83 ALA H . . 3.880 2.724 2.534 2.888 . 0 0 "[ . 1 . 2]" 1
992 1 82 ASN H 1 83 ALA MB . . 5.390 4.390 4.188 4.492 . 0 0 "[ . 1 . 2]" 1
993 1 82 ASN H 1 84 VAL H . . 5.500 4.546 4.296 4.720 . 0 0 "[ . 1 . 2]" 1
994 1 82 ASN HA 1 82 ASN QD . . 3.870 2.987 2.231 3.564 . 0 0 "[ . 1 . 2]" 1
995 1 82 ASN HA 1 85 ARG H . . 4.620 3.666 3.336 3.943 . 0 0 "[ . 1 . 2]" 1
996 1 82 ASN HA 1 85 ARG QB . . 4.790 2.808 2.201 3.821 . 0 0 "[ . 1 . 2]" 1
997 1 82 ASN HA 1 85 ARG QD . . 5.320 3.540 1.863 5.246 . 0 0 "[ . 1 . 2]" 1
998 1 82 ASN HA 1 85 ARG HE . . 3.810 3.095 2.088 3.903 0.093 11 0 "[ . 1 . 2]" 1
999 1 82 ASN HA 1 85 ARG QG . . 4.990 3.504 1.987 4.568 . 0 0 "[ . 1 . 2]" 1
1000 1 82 ASN HA 1 86 ASN H . . 4.020 3.724 3.448 4.041 0.021 11 0 "[ . 1 . 2]" 1
1001 1 82 ASN HB2 1 83 ALA H . . 4.160 3.866 3.405 4.120 . 0 0 "[ . 1 . 2]" 1
1002 1 82 ASN HB3 1 83 ALA H . . 3.940 2.789 2.569 3.035 . 0 0 "[ . 1 . 2]" 1
1003 1 82 ASN HB3 1 83 ALA MB . . 5.330 4.097 3.851 4.353 . 0 0 "[ . 1 . 2]" 1
1004 1 82 ASN HB3 1 84 VAL H . . 5.500 5.432 5.292 5.572 0.072 6 0 "[ . 1 . 2]" 1
1005 1 82 ASN HB3 1 118 ALA MB . . 5.420 3.129 2.227 4.665 . 0 0 "[ . 1 . 2]" 1
1006 1 82 ASN QD 1 83 ALA HA . . 4.410 3.593 2.865 4.366 . 0 0 "[ . 1 . 2]" 1
1007 1 82 ASN QD 1 86 ASN H . . 5.180 3.599 3.147 4.156 . 0 0 "[ . 1 . 2]" 1
1008 1 82 ASN QD 1 86 ASN HA . . 4.710 4.400 4.071 4.635 . 0 0 "[ . 1 . 2]" 1
1009 1 82 ASN QD 1 86 ASN QB . . 4.910 2.707 1.990 3.652 . 0 0 "[ . 1 . 2]" 1
1010 1 82 ASN QD 1 115 GLN HA . . 4.470 3.128 2.387 4.134 . 0 0 "[ . 1 . 2]" 1
1011 1 83 ALA H 1 83 ALA MB . . 3.220 2.235 2.198 2.266 . 0 0 "[ . 1 . 2]" 1
1012 1 83 ALA H 1 84 VAL H . . 3.760 2.869 2.674 2.991 . 0 0 "[ . 1 . 2]" 1
1013 1 83 ALA H 1 84 VAL HB . . 5.500 5.107 4.656 5.564 0.064 13 0 "[ . 1 . 2]" 1
1014 1 83 ALA H 1 84 VAL QG . . 4.780 4.201 3.913 4.388 . 0 0 "[ . 1 . 2]" 1
1015 1 83 ALA H 1 85 ARG H . . 4.910 4.292 4.170 4.411 . 0 0 "[ . 1 . 2]" 1
1016 1 83 ALA HA 1 86 ASN QB . . 4.240 2.818 2.350 3.493 . 0 0 "[ . 1 . 2]" 1
1017 1 83 ALA MB 1 84 VAL QG . . 4.390 3.218 2.724 3.911 . 0 0 "[ . 1 . 2]" 1
1018 1 83 ALA MB 1 85 ARG H . . 4.520 4.594 4.518 4.618 0.098 15 0 "[ . 1 . 2]" 1
1019 1 83 ALA MB 1 86 ASN H . . 5.500 4.781 4.586 4.967 . 0 0 "[ . 1 . 2]" 1
1020 1 83 ALA MB 1 86 ASN QB . . 4.980 4.232 3.830 4.831 . 0 0 "[ . 1 . 2]" 1
1021 1 84 VAL H 1 84 VAL HB . . 3.860 2.514 2.291 2.778 . 0 0 "[ . 1 . 2]" 1
1022 1 84 VAL H 1 84 VAL QG . . 3.450 2.145 2.034 2.370 . 0 0 "[ . 1 . 2]" 1
1023 1 84 VAL H 1 85 ARG H . . 4.220 2.829 2.712 2.943 . 0 0 "[ . 1 . 2]" 1
1024 1 84 VAL H 1 86 ASN H . . 5.130 4.344 3.930 4.550 . 0 0 "[ . 1 . 2]" 1
1025 1 84 VAL HA 1 87 LYS H . . 4.140 3.632 3.393 4.188 0.048 18 0 "[ . 1 . 2]" 1
1026 1 84 VAL HA 1 87 LYS HB2 . . 5.010 3.726 3.015 4.934 . 0 0 "[ . 1 . 2]" 1
1027 1 84 VAL HA 1 87 LYS HB3 . . 4.850 3.075 2.340 4.279 . 0 0 "[ . 1 . 2]" 1
1028 1 84 VAL HA 1 87 LYS QD . . 5.080 4.087 2.280 5.155 0.075 7 0 "[ . 1 . 2]" 1
1029 1 84 VAL HA 1 88 TYR H . . 5.430 3.898 3.746 4.079 . 0 0 "[ . 1 . 2]" 1
1030 1 84 VAL HB 1 85 ARG H . . 4.250 3.046 2.327 4.147 . 0 0 "[ . 1 . 2]" 1
1031 1 84 VAL QG 1 85 ARG H . . 4.950 2.753 1.956 3.329 . 0 0 "[ . 1 . 2]" 1
1032 1 84 VAL QG 1 88 TYR H . . 5.500 3.961 3.720 4.182 . 0 0 "[ . 1 . 2]" 1
1033 1 85 ARG H 1 85 ARG QB . . 3.680 2.226 2.102 2.370 . 0 0 "[ . 1 . 2]" 1
1034 1 85 ARG H 1 85 ARG QD . . 5.010 4.460 3.375 4.932 . 0 0 "[ . 1 . 2]" 1
1035 1 85 ARG H 1 86 ASN H . . 3.880 2.890 2.617 3.223 . 0 0 "[ . 1 . 2]" 1
1036 1 85 ARG HA 1 85 ARG HE . . 5.500 5.068 4.496 5.568 0.068 11 0 "[ . 1 . 2]" 1
1037 1 85 ARG HA 1 87 LYS H . . 5.500 4.733 4.487 5.065 . 0 0 "[ . 1 . 2]" 1
1038 1 85 ARG HA 1 88 TYR H . . 4.980 3.803 3.478 4.172 . 0 0 "[ . 1 . 2]" 1
1039 1 85 ARG HA 1 88 TYR HB2 . . 4.630 3.003 2.624 4.489 . 0 0 "[ . 1 . 2]" 1
1040 1 85 ARG QB 1 86 ASN H . . 4.070 2.921 2.419 3.567 . 0 0 "[ . 1 . 2]" 1
1041 1 85 ARG QB 1 86 ASN HA . . 5.230 4.541 4.235 4.905 . 0 0 "[ . 1 . 2]" 1
1042 1 85 ARG QD 1 86 ASN H . . 5.230 4.216 2.781 5.161 . 0 0 "[ . 1 . 2]" 1
1043 1 85 ARG QD 1 86 ASN HA . . 5.500 4.742 3.109 5.574 0.074 9 0 "[ . 1 . 2]" 1
1044 1 85 ARG QD 1 89 VAL QG . . 4.960 4.230 3.019 4.906 . 0 0 "[ . 1 . 2]" 1
1045 1 85 ARG QG 1 86 ASN H . . 4.230 3.041 2.115 3.835 . 0 0 "[ . 1 . 2]" 1
1046 1 85 ARG QG 1 89 VAL HB . . 4.560 4.193 3.524 4.660 0.100 20 0 "[ . 1 . 2]" 1
1047 1 85 ARG QG 1 89 VAL QG . . 3.840 3.198 2.308 3.532 . 0 0 "[ . 1 . 2]" 1
1048 1 86 ASN H 1 86 ASN QB . . 3.450 2.266 2.103 2.420 . 0 0 "[ . 1 . 2]" 1
1049 1 86 ASN H 1 87 LYS H . . 4.140 2.807 2.632 3.022 . 0 0 "[ . 1 . 2]" 1
1050 1 86 ASN H 1 89 VAL QG . . 5.500 4.215 3.907 4.887 . 0 0 "[ . 1 . 2]" 1
1051 1 86 ASN HA 1 89 VAL H . . 4.450 3.701 3.499 3.906 . 0 0 "[ . 1 . 2]" 1
1052 1 86 ASN HA 1 89 VAL QG . . 4.150 2.362 1.938 3.578 . 0 0 "[ . 1 . 2]" 1
1053 1 86 ASN HA 1 90 GLN H . . 4.490 3.854 3.659 4.119 . 0 0 "[ . 1 . 2]" 1
1054 1 86 ASN QB 1 87 LYS H . . 4.090 2.557 2.369 2.791 . 0 0 "[ . 1 . 2]" 1
1055 1 86 ASN QB 1 87 LYS HB2 . . 4.850 4.152 3.868 5.506 0.656 20 1 "[ . 1 . +]" 1
1056 1 86 ASN QB 1 90 GLN HG3 . . 5.370 4.396 2.950 5.564 0.194 20 0 "[ . 1 . 2]" 1
1057 1 86 ASN QB 1 115 GLN QB . . 5.170 4.065 2.896 4.762 . 0 0 "[ . 1 . 2]" 1
1058 1 86 ASN QB 1 115 GLN HE21 . . 5.280 3.721 3.099 4.295 . 0 0 "[ . 1 . 2]" 1
1059 1 86 ASN QB 1 115 GLN HE22 . . 5.500 4.198 3.244 5.287 . 0 0 "[ . 1 . 2]" 1
1060 1 87 LYS H 1 87 LYS HB2 . . 3.630 2.377 2.112 3.619 . 0 0 "[ . 1 . 2]" 1
1061 1 87 LYS H 1 87 LYS HB3 . . 3.670 2.630 2.087 3.337 . 0 0 "[ . 1 . 2]" 1
1062 1 87 LYS H 1 87 LYS QD . . 4.350 4.205 3.847 4.438 0.088 19 0 "[ . 1 . 2]" 1
1063 1 87 LYS H 1 88 TYR H . . 3.920 2.797 2.657 2.965 . 0 0 "[ . 1 . 2]" 1
1064 1 87 LYS H 1 89 VAL H . . 5.500 4.499 4.321 4.740 . 0 0 "[ . 1 . 2]" 1
1065 1 87 LYS H 1 90 GLN H . . 5.500 4.820 4.599 4.944 . 0 0 "[ . 1 . 2]" 1
1066 1 87 LYS HA 1 87 LYS QD . . 4.170 3.799 2.587 4.248 0.078 20 0 "[ . 1 . 2]" 1
1067 1 87 LYS HA 1 90 GLN HB2 . . 4.340 3.001 2.326 5.135 0.795 19 2 "[ -. 1 . +2]" 1
1068 1 87 LYS HA 1 90 GLN HG3 . . 4.870 3.798 2.183 5.256 0.386 14 0 "[ . 1 . 2]" 1
1069 1 87 LYS HB2 1 88 TYR H . . 4.630 3.737 3.163 3.938 . 0 0 "[ . 1 . 2]" 1
1070 1 87 LYS HB3 1 88 TYR H . . 4.550 2.635 2.242 3.823 . 0 0 "[ . 1 . 2]" 1
1071 1 87 LYS QD 1 88 TYR H . . 5.500 4.701 3.065 5.406 . 0 0 "[ . 1 . 2]" 1
1072 1 87 LYS QG 1 88 TYR HA . . 5.500 4.098 3.168 5.233 . 0 0 "[ . 1 . 2]" 1
1073 1 87 LYS QG 1 91 ARG QB . . 4.840 4.255 3.462 4.750 . 0 0 "[ . 1 . 2]" 1
1074 1 87 LYS QG 1 91 ARG QD . . 5.500 3.156 2.205 4.005 . 0 0 "[ . 1 . 2]" 1
1075 1 88 TYR H 1 89 VAL H . . 4.240 2.955 2.816 3.074 . 0 0 "[ . 1 . 2]" 1
1076 1 88 TYR H 1 89 VAL QG . . 5.390 4.235 3.883 4.500 . 0 0 "[ . 1 . 2]" 1
1077 1 88 TYR HA 1 91 ARG H . . 4.320 3.677 3.418 3.899 . 0 0 "[ . 1 . 2]" 1
1078 1 88 TYR HA 1 91 ARG QB . . 3.750 3.054 2.575 3.838 0.088 18 0 "[ . 1 . 2]" 1
1079 1 88 TYR HA 1 91 ARG QD . . 5.300 3.810 2.906 4.754 . 0 0 "[ . 1 . 2]" 1
1080 1 88 TYR HB2 1 89 VAL H . . 5.000 2.884 2.506 3.808 . 0 0 "[ . 1 . 2]" 1
1081 1 88 TYR HB3 1 89 VAL H . . 5.460 3.013 2.279 3.501 . 0 0 "[ . 1 . 2]" 1
1082 1 88 TYR HB3 1 89 VAL HA . . 5.040 4.040 3.770 4.341 . 0 0 "[ . 1 . 2]" 1
1083 1 89 VAL H 1 89 VAL HB . . 3.890 2.543 2.272 3.640 . 0 0 "[ . 1 . 2]" 1
1084 1 89 VAL H 1 89 VAL QG . . 3.850 2.215 1.915 2.471 . 0 0 "[ . 1 . 2]" 1
1085 1 89 VAL H 1 90 GLN H . . 3.900 2.845 2.659 2.963 . 0 0 "[ . 1 . 2]" 1
1086 1 89 VAL HA 1 92 PHE H . . 4.730 3.418 3.215 3.633 . 0 0 "[ . 1 . 2]" 1
1087 1 89 VAL HA 1 92 PHE HB2 . . 5.340 3.553 3.151 5.073 . 0 0 "[ . 1 . 2]" 1
1088 1 89 VAL HA 1 92 PHE HB3 . . 4.750 2.484 2.236 3.625 . 0 0 "[ . 1 . 2]" 1
1089 1 89 VAL HA 1 92 PHE QD . . 4.340 3.292 2.050 4.219 . 0 0 "[ . 1 . 2]" 1
1090 1 89 VAL HA 1 93 GLN H . . 5.500 3.690 3.374 4.000 . 0 0 "[ . 1 . 2]" 1
1091 1 89 VAL HA 1 93 GLN QB . . 5.410 4.667 3.842 5.364 . 0 0 "[ . 1 . 2]" 1
1092 1 89 VAL HB 1 90 GLN H . . 3.930 3.660 2.555 4.009 0.079 14 0 "[ . 1 . 2]" 1
1093 1 89 VAL QG 1 90 GLN H . . 4.570 2.483 2.141 3.275 . 0 0 "[ . 1 . 2]" 1
1094 1 89 VAL QG 1 90 GLN HA . . 4.980 3.214 2.949 3.499 . 0 0 "[ . 1 . 2]" 1
1095 1 89 VAL QG 1 90 GLN HB2 . . 5.500 4.134 3.553 4.949 . 0 0 "[ . 1 . 2]" 1
1096 1 89 VAL QG 1 90 GLN HG2 . . 5.500 3.366 2.438 4.412 . 0 0 "[ . 1 . 2]" 1
1097 1 89 VAL QG 1 90 GLN HG3 . . 5.500 3.962 2.615 5.323 . 0 0 "[ . 1 . 2]" 1
1098 1 89 VAL QG 1 92 PHE H . . 5.150 4.372 4.173 4.577 . 0 0 "[ . 1 . 2]" 1
1099 1 89 VAL QG 1 93 GLN H . . 5.500 3.557 3.085 4.425 . 0 0 "[ . 1 . 2]" 1
1100 1 89 VAL QG 1 93 GLN QB . . 4.730 3.211 2.416 4.513 . 0 0 "[ . 1 . 2]" 1
1101 1 89 VAL QG 1 93 GLN HE21 . . 5.170 2.959 1.815 4.295 . 0 0 "[ . 1 . 2]" 1
1102 1 89 VAL QG 1 93 GLN HE22 . . 5.340 3.465 2.159 5.040 . 0 0 "[ . 1 . 2]" 1
1103 1 89 VAL QG 1 93 GLN QG . . 4.600 3.405 2.283 4.270 . 0 0 "[ . 1 . 2]" 1
1104 1 90 GLN H 1 90 GLN HB2 . . 3.450 2.506 2.170 3.784 0.334 4 0 "[ . 1 . 2]" 1
1105 1 90 GLN H 1 90 GLN HG2 . . 4.010 3.028 2.450 3.798 . 0 0 "[ . 1 . 2]" 1
1106 1 90 GLN H 1 90 GLN HG3 . . 4.110 3.273 2.332 4.076 . 0 0 "[ . 1 . 2]" 1
1107 1 90 GLN H 1 92 PHE HB3 . . 5.500 5.099 4.727 5.592 0.092 4 0 "[ . 1 . 2]" 1
1108 1 90 GLN HA 1 90 GLN HG2 . . 3.940 2.848 2.212 4.174 0.234 19 0 "[ . 1 . 2]" 1
1109 1 90 GLN HA 1 90 GLN HG3 . . 4.090 3.490 2.798 3.826 . 0 0 "[ . 1 . 2]" 1
1110 1 90 GLN HA 1 93 GLN H . . 4.560 3.733 3.223 4.187 . 0 0 "[ . 1 . 2]" 1
1111 1 90 GLN HA 1 93 GLN HE21 . . 4.660 4.355 2.768 5.074 0.414 7 0 "[ . 1 . 2]" 1
1112 1 90 GLN HB2 1 91 ARG H . . 4.090 2.800 2.314 4.194 0.104 19 0 "[ . 1 . 2]" 1
1113 1 90 GLN HB2 1 94 ALA MB . . 5.500 5.120 3.619 5.839 0.339 14 0 "[ . 1 . 2]" 1
1114 1 90 GLN HG3 1 91 ARG H . . 5.500 4.648 2.624 5.380 . 0 0 "[ . 1 . 2]" 1
1115 1 90 GLN HG3 1 115 GLN HE22 . . 4.620 4.269 3.000 5.438 0.818 4 1 "[ +. 1 . 2]" 1
1116 1 91 ARG H 1 91 ARG HG3 . . 4.900 3.077 2.425 4.515 . 0 0 "[ . 1 . 2]" 1
1117 1 91 ARG H 1 92 PHE H . . 3.740 2.767 2.582 2.855 . 0 0 "[ . 1 . 2]" 1
1118 1 91 ARG H 1 93 GLN H . . 5.490 4.636 4.358 4.991 . 0 0 "[ . 1 . 2]" 1
1119 1 91 ARG HA 1 91 ARG HG3 . . 4.120 2.921 2.354 3.654 . 0 0 "[ . 1 . 2]" 1
1120 1 91 ARG HA 1 94 ALA H . . 3.980 3.609 3.277 4.039 0.059 4 0 "[ . 1 . 2]" 1
1121 1 91 ARG HA 1 94 ALA MB . . 3.530 2.665 2.124 3.400 . 0 0 "[ . 1 . 2]" 1
1122 1 91 ARG QB 1 92 PHE H . . 3.940 2.776 2.389 3.542 . 0 0 "[ . 1 . 2]" 1
1123 1 91 ARG QB 1 92 PHE HA . . 5.430 4.029 3.732 4.757 . 0 0 "[ . 1 . 2]" 1
1124 1 91 ARG QB 1 95 THR MG . . 4.520 4.527 4.206 4.647 0.127 4 0 "[ . 1 . 2]" 1
1125 1 91 ARG HG2 1 92 PHE H . . 5.500 4.731 2.476 5.316 . 0 0 "[ . 1 . 2]" 1
1126 1 91 ARG HG3 1 92 PHE H . . 5.500 4.554 2.724 5.103 . 0 0 "[ . 1 . 2]" 1
1127 1 92 PHE H 1 92 PHE HB2 . . 3.880 2.584 2.315 3.571 . 0 0 "[ . 1 . 2]" 1
1128 1 92 PHE H 1 92 PHE HB3 . . 3.870 2.410 2.193 2.731 . 0 0 "[ . 1 . 2]" 1
1129 1 92 PHE H 1 92 PHE QD . . 4.640 4.147 3.426 4.261 . 0 0 "[ . 1 . 2]" 1
1130 1 92 PHE H 1 93 GLN H . . 4.240 2.957 2.630 3.169 . 0 0 "[ . 1 . 2]" 1
1131 1 92 PHE HA 1 92 PHE QD . . 3.850 2.437 2.020 3.506 . 0 0 "[ . 1 . 2]" 1
1132 1 92 PHE HA 1 93 GLN HA . . 5.100 4.725 4.546 4.919 . 0 0 "[ . 1 . 2]" 1
1133 1 92 PHE HA 1 95 THR H . . 5.420 3.923 3.573 4.694 . 0 0 "[ . 1 . 2]" 1
1134 1 92 PHE HA 1 95 THR HB . . 5.080 4.421 2.844 5.169 0.089 9 0 "[ . 1 . 2]" 1
1135 1 92 PHE HA 1 95 THR MG . . 5.130 2.999 2.149 4.682 . 0 0 "[ . 1 . 2]" 1
1136 1 92 PHE HA 1 96 TYR QD . . 4.170 3.593 2.992 4.258 0.088 6 0 "[ . 1 . 2]" 1
1137 1 92 PHE HB2 1 93 GLN H . . 5.070 3.862 3.755 4.090 . 0 0 "[ . 1 . 2]" 1
1138 1 92 PHE HB3 1 93 GLN H . . 4.230 2.485 2.325 3.534 . 0 0 "[ . 1 . 2]" 1
1139 1 92 PHE QD 1 93 GLN H . . 4.220 3.580 2.857 4.291 0.071 6 0 "[ . 1 . 2]" 1
1140 1 92 PHE QD 1 93 GLN HA . . 5.110 4.231 2.959 4.939 . 0 0 "[ . 1 . 2]" 1
1141 1 92 PHE QD 1 95 THR H . . 5.500 5.276 4.589 5.595 0.095 16 0 "[ . 1 . 2]" 1
1142 1 93 GLN H 1 93 GLN QB . . 3.720 2.290 1.895 2.739 . 0 0 "[ . 1 . 2]" 1
1143 1 93 GLN H 1 93 GLN QG . . 4.000 2.897 2.016 3.732 . 0 0 "[ . 1 . 2]" 1
1144 1 93 GLN H 1 94 ALA H . . 3.800 2.829 2.510 3.021 . 0 0 "[ . 1 . 2]" 1
1145 1 93 GLN H 1 94 ALA MB . . 5.500 4.501 4.193 4.676 . 0 0 "[ . 1 . 2]" 1
1146 1 93 GLN H 1 95 THR H . . 4.970 4.416 4.098 4.843 . 0 0 "[ . 1 . 2]" 1
1147 1 93 GLN HA 1 96 TYR QB . . 5.250 2.790 2.191 4.938 . 0 0 "[ . 1 . 2]" 1
1148 1 93 GLN HA 1 97 ASN QD . . 4.870 3.683 2.911 4.450 . 0 0 "[ . 1 . 2]" 1
1149 1 93 GLN QB 1 94 ALA H . . 3.990 3.177 2.349 3.906 . 0 0 "[ . 1 . 2]" 1
1150 1 93 GLN QB 1 94 ALA HA . . 4.650 4.249 3.776 4.719 0.069 2 0 "[ . 1 . 2]" 1
1151 1 93 GLN QB 1 94 ALA MB . . 4.680 4.326 3.383 4.811 0.131 17 0 "[ . 1 . 2]" 1
1152 1 93 GLN QB 1 97 ASN QD . . 4.530 2.875 1.991 4.087 . 0 0 "[ . 1 . 2]" 1
1153 1 93 GLN HE21 1 112 THR MG . . 5.380 4.637 3.134 5.474 0.094 10 0 "[ . 1 . 2]" 1
1154 1 93 GLN HE22 1 112 THR MG . . 5.500 4.419 2.366 5.574 0.074 3 0 "[ . 1 . 2]" 1
1155 1 93 GLN QG 1 94 ALA H . . 5.430 3.674 2.218 4.678 . 0 0 "[ . 1 . 2]" 1
1156 1 93 GLN QG 1 97 ASN QD . . 3.820 2.937 2.093 3.472 . 0 0 "[ . 1 . 2]" 1
1157 1 94 ALA H 1 94 ALA MB . . 3.230 2.235 2.176 2.282 . 0 0 "[ . 1 . 2]" 1
1158 1 94 ALA H 1 95 THR H . . 3.740 2.839 2.465 3.162 . 0 0 "[ . 1 . 2]" 1
1159 1 94 ALA H 1 95 THR MG . . 5.500 4.631 3.909 5.620 0.120 16 0 "[ . 1 . 2]" 1
1160 1 94 ALA H 1 97 ASN QD . . 5.400 4.178 3.756 4.682 . 0 0 "[ . 1 . 2]" 1
1161 1 94 ALA HA 1 97 ASN QD . . 5.500 2.955 1.958 3.575 . 0 0 "[ . 1 . 2]" 1
1162 1 94 ALA MB 1 95 THR H . . 3.910 2.917 2.246 3.661 . 0 0 "[ . 1 . 2]" 1
1163 1 94 ALA MB 1 95 THR HA . . 4.680 4.058 3.571 4.502 . 0 0 "[ . 1 . 2]" 1
1164 1 94 ALA MB 1 95 THR MG . . 5.240 4.185 3.286 5.287 0.047 1 0 "[ . 1 . 2]" 1
1165 1 94 ALA MB 1 96 TYR H . . 5.060 4.633 4.202 5.170 0.110 2 0 "[ . 1 . 2]" 1
1166 1 94 ALA MB 1 97 ASN H . . 5.500 5.003 4.465 5.541 0.041 6 0 "[ . 1 . 2]" 1
1167 1 94 ALA MB 1 97 ASN QD . . 4.990 4.199 3.282 4.676 . 0 0 "[ . 1 . 2]" 1
1168 1 95 THR H 1 95 THR HB . . 3.740 2.729 2.204 3.419 . 0 0 "[ . 1 . 2]" 1
1169 1 95 THR H 1 95 THR MG . . 3.980 2.660 2.030 3.851 . 0 0 "[ . 1 . 2]" 1
1170 1 95 THR H 1 96 TYR H . . 3.260 2.361 1.704 2.820 . 0 0 "[ . 1 . 2]" 1
1171 1 95 THR H 1 96 TYR QB . . 5.000 4.124 3.510 4.854 . 0 0 "[ . 1 . 2]" 1
1172 1 95 THR H 1 96 TYR QD . . 4.120 4.091 3.643 4.208 0.088 9 0 "[ . 1 . 2]" 1
1173 1 95 THR H 1 97 ASN H . . 5.500 3.862 2.923 4.393 . 0 0 "[ . 1 . 2]" 1
1174 1 95 THR HA 1 95 THR MG . . 3.520 3.053 2.159 3.309 . 0 0 "[ . 1 . 2]" 1
1175 1 95 THR HA 1 96 TYR QD . . 5.500 5.059 4.317 5.554 0.054 2 0 "[ . 1 . 2]" 1
1176 1 95 THR HA 1 97 ASN H . . 5.290 3.808 3.527 4.474 . 0 0 "[ . 1 . 2]" 1
1177 1 95 THR HA 1 98 ASN H . . 5.440 4.788 3.741 5.520 0.080 10 0 "[ . 1 . 2]" 1
1178 1 95 THR HB 1 96 TYR H . . 4.330 3.902 2.375 4.415 0.085 6 0 "[ . 1 . 2]" 1
1179 1 95 THR HB 1 96 TYR QD . . 5.350 4.377 2.621 5.240 . 0 0 "[ . 1 . 2]" 1
1180 1 95 THR MG 1 96 TYR H . . 4.620 2.989 1.927 4.338 . 0 0 "[ . 1 . 2]" 1
1181 1 95 THR MG 1 96 TYR HA . . 4.100 3.993 3.633 4.221 0.121 18 0 "[ . 1 . 2]" 1
1182 1 95 THR MG 1 96 TYR QB . . 5.500 3.795 3.000 5.199 . 0 0 "[ . 1 . 2]" 1
1183 1 95 THR MG 1 96 TYR QD . . 4.210 2.439 1.966 4.076 . 0 0 "[ . 1 . 2]" 1
1184 1 95 THR MG 1 97 ASN H . . 5.230 4.752 4.347 5.144 . 0 0 "[ . 1 . 2]" 1
1185 1 96 TYR H 1 96 TYR QB . . 3.450 2.336 2.025 2.747 . 0 0 "[ . 1 . 2]" 1
1186 1 96 TYR H 1 96 TYR QD . . 3.810 2.923 2.273 3.833 0.023 6 0 "[ . 1 . 2]" 1
1187 1 96 TYR H 1 97 ASN H . . 3.820 2.572 1.822 3.347 . 0 0 "[ . 1 . 2]" 1
1188 1 96 TYR H 1 97 ASN HA . . 5.460 4.896 4.066 5.401 . 0 0 "[ . 1 . 2]" 1
1189 1 96 TYR HA 1 96 TYR QD . . 3.250 2.929 2.508 3.386 0.136 3 0 "[ . 1 . 2]" 1
1190 1 96 TYR HA 1 97 ASN H . . 3.160 3.157 2.815 3.260 0.100 4 0 "[ . 1 . 2]" 1
1191 1 96 TYR HA 1 98 ASN H . . 4.620 3.333 2.850 4.041 . 0 0 "[ . 1 . 2]" 1
1192 1 96 TYR QB 1 97 ASN H . . 4.110 3.616 2.957 3.843 . 0 0 "[ . 1 . 2]" 1
1193 1 96 TYR QB 1 98 ASN H . . 5.350 4.636 4.344 5.016 . 0 0 "[ . 1 . 2]" 1
1194 1 97 ASN H 1 97 ASN HB2 . . 3.410 2.353 2.127 3.602 0.192 18 0 "[ . 1 . 2]" 1
1195 1 97 ASN H 1 97 ASN HB3 . . 3.510 3.405 2.874 3.590 0.080 4 0 "[ . 1 . 2]" 1
1196 1 97 ASN H 1 97 ASN QD . . 4.220 3.444 2.628 3.975 . 0 0 "[ . 1 . 2]" 1
1197 1 97 ASN H 1 98 ASN H . . 3.560 2.431 1.943 2.755 . 0 0 "[ . 1 . 2]" 1
1198 1 97 ASN H 1 98 ASN QB . . 5.500 4.631 3.919 5.250 . 0 0 "[ . 1 . 2]" 1
1199 1 97 ASN H 1 102 GLN QB . . 5.500 4.938 3.725 5.413 . 0 0 "[ . 1 . 2]" 1
1200 1 97 ASN HA 1 97 ASN QD . . 4.290 3.298 2.351 4.169 . 0 0 "[ . 1 . 2]" 1
1201 1 97 ASN HB2 1 98 ASN H . . 5.420 3.634 3.097 4.298 . 0 0 "[ . 1 . 2]" 1
1202 1 97 ASN HB3 1 100 THR H . . 4.680 4.355 3.327 5.424 0.744 12 1 "[ . 1 + . 2]" 1
1203 1 97 ASN QD 1 98 ASN H . . 5.500 5.069 4.641 5.317 . 0 0 "[ . 1 . 2]" 1
1204 1 98 ASN H 1 98 ASN HA . . 2.900 2.578 2.197 2.898 . 0 0 "[ . 1 . 2]" 1
1205 1 98 ASN H 1 98 ASN QB . . 3.180 2.718 2.034 3.141 . 0 0 "[ . 1 . 2]" 1
1206 1 98 ASN H 1 99 ALA MB . . 5.500 4.738 3.918 5.596 0.096 6 0 "[ . 1 . 2]" 1
1207 1 98 ASN HA 1 99 ALA H . . 3.410 3.051 2.112 3.489 0.079 3 0 "[ . 1 . 2]" 1
1208 1 98 ASN HA 1 100 THR H . . 4.370 3.890 2.942 4.457 0.087 6 0 "[ . 1 . 2]" 1
1209 1 98 ASN QB 1 99 ALA MB . . 5.240 4.119 2.910 4.927 . 0 0 "[ . 1 . 2]" 1
1210 1 99 ALA H 1 99 ALA MB . . 3.030 2.556 2.182 3.086 0.056 5 0 "[ . 1 . 2]" 1
1211 1 99 ALA H 1 100 THR H . . 3.670 2.690 1.785 3.731 0.061 3 0 "[ . 1 . 2]" 1
1212 1 99 ALA MB 1 100 THR H . . 3.680 3.430 2.318 3.783 0.103 3 0 "[ . 1 . 2]" 1
1213 1 100 THR H 1 100 THR HA . . 2.850 2.724 2.149 2.935 0.085 2 0 "[ . 1 . 2]" 1
1214 1 100 THR H 1 100 THR MG . . 3.780 3.418 2.202 3.901 0.121 3 0 "[ . 1 . 2]" 1
1215 1 100 THR H 1 101 GLU H . . 3.430 2.450 1.783 3.423 . 0 0 "[ . 1 . 2]" 1
1216 1 100 THR H 1 101 GLU QB . . 5.500 4.639 3.272 5.253 . 0 0 "[ . 1 . 2]" 1
1217 1 100 THR H 1 101 GLU QG . . 5.500 4.452 3.799 5.324 . 0 0 "[ . 1 . 2]" 1
1218 1 100 THR HA 1 101 GLU QB . . 5.130 4.603 4.177 4.987 . 0 0 "[ . 1 . 2]" 1
1219 1 100 THR MG 1 101 GLU H . . 4.190 3.607 2.149 4.316 0.126 15 0 "[ . 1 . 2]" 1
1220 1 100 THR MG 1 102 GLN H . . 5.010 4.712 2.545 5.125 0.115 17 0 "[ . 1 . 2]" 1
1221 1 101 GLU H 1 101 GLU QB . . 3.150 2.693 1.928 3.109 . 0 0 "[ . 1 . 2]" 1
1222 1 101 GLU H 1 101 GLU QG . . 3.740 2.772 1.902 3.718 . 0 0 "[ . 1 . 2]" 1
1223 1 102 GLN H 1 102 GLN QB . . 3.100 2.416 1.889 3.048 . 0 0 "[ . 1 . 2]" 1
1224 1 102 GLN H 1 102 GLN QG . . 4.110 3.814 2.412 4.184 0.074 17 0 "[ . 1 . 2]" 1
1225 1 102 GLN HA 1 105 LYS QD . . 3.860 3.330 2.109 3.923 0.063 10 0 "[ . 1 . 2]" 1
1226 1 102 GLN HA 1 105 LYS HG3 . . 4.430 3.834 2.655 5.155 0.725 8 1 "[ . + 1 . 2]" 1
1227 1 102 GLN QG 1 105 LYS H . . 5.500 4.468 2.061 5.594 0.094 6 0 "[ . 1 . 2]" 1
1228 1 102 GLN QG 1 105 LYS QD . . 4.280 2.958 2.042 4.402 0.122 3 0 "[ . 1 . 2]" 1
1229 1 102 GLN QG 1 105 LYS HG3 . . 4.610 3.728 2.299 4.704 0.094 7 0 "[ . 1 . 2]" 1
1230 1 103 GLU H 1 103 GLU HB2 . . 2.980 2.617 2.124 3.574 0.594 4 2 "[- +. 1 . 2]" 1
1231 1 103 GLU H 1 103 GLU QG . . 3.670 3.085 1.843 3.772 0.102 10 0 "[ . 1 . 2]" 1
1232 1 103 GLU H 1 105 LYS HG3 . . 5.500 4.825 3.344 5.903 0.403 5 0 "[ . 1 . 2]" 1
1233 1 103 GLU HA 1 104 GLY H . . 2.910 2.528 2.057 3.004 0.094 6 0 "[ . 1 . 2]" 1
1234 1 103 GLU HA 1 105 LYS HG3 . . 5.030 4.817 3.366 5.954 0.924 5 3 "[ + 1- .* 2]" 1
1235 1 103 GLU QG 1 104 GLY H . . 4.400 3.742 1.753 4.488 0.088 10 0 "[ . 1 . 2]" 1
1236 1 104 GLY H 1 104 GLY QA . . 2.790 2.261 2.155 2.442 . 0 0 "[ . 1 . 2]" 1
1237 1 104 GLY H 1 105 LYS H . . 3.650 2.865 2.063 3.510 . 0 0 "[ . 1 . 2]" 1
1238 1 104 GLY H 1 105 LYS QB . . 5.500 5.022 3.948 5.572 0.072 13 0 "[ . 1 . 2]" 1
1239 1 104 GLY H 1 105 LYS HG2 . . 5.500 5.076 3.474 5.598 0.098 9 0 "[ . 1 . 2]" 1
1240 1 105 LYS H 1 105 LYS QB . . 3.800 2.846 2.366 3.396 . 0 0 "[ . 1 . 2]" 1
1241 1 105 LYS H 1 105 LYS QE . . 5.500 4.333 2.166 5.080 . 0 0 "[ . 1 . 2]" 1
1242 1 105 LYS H 1 105 LYS HG2 . . 4.700 3.140 2.028 4.516 . 0 0 "[ . 1 . 2]" 1
1243 1 105 LYS H 1 105 LYS HG3 . . 3.840 2.272 1.681 3.120 . 0 0 "[ . 1 . 2]" 1
1244 1 105 LYS H 1 108 ILE MD . . 5.500 5.072 4.568 5.592 0.092 6 0 "[ . 1 . 2]" 1
1245 1 105 LYS HA 1 105 LYS QE . . 5.240 4.392 3.798 5.349 0.109 10 0 "[ . 1 . 2]" 1
1246 1 105 LYS HA 1 105 LYS HG2 . . 4.130 3.925 2.975 4.207 0.077 1 0 "[ . 1 . 2]" 1
1247 1 105 LYS HA 1 106 THR H . . 2.820 2.336 2.089 2.749 . 0 0 "[ . 1 . 2]" 1
1248 1 105 LYS HA 1 108 ILE HG13 . . 5.500 4.228 2.883 5.437 . 0 0 "[ . 1 . 2]" 1
1249 1 105 LYS QB 1 106 THR HA . . 4.860 4.332 3.371 4.941 0.081 1 0 "[ . 1 . 2]" 1
1250 1 105 LYS QB 1 107 TYR QD . . 4.790 4.541 3.783 4.895 0.105 20 0 "[ . 1 . 2]" 1
1251 1 105 LYS QB 1 108 ILE HA . . 5.500 5.094 4.586 5.600 0.100 5 0 "[ . 1 . 2]" 1
1252 1 105 LYS QB 1 108 ILE HG12 . . 4.750 4.271 3.751 4.816 0.066 2 0 "[ . 1 . 2]" 1
1253 1 105 LYS QB 1 108 ILE HG13 . . 5.160 2.937 2.385 3.321 . 0 0 "[ . 1 . 2]" 1
1254 1 105 LYS QE 1 106 THR HA . . 4.520 4.351 2.549 4.619 0.099 20 0 "[ . 1 . 2]" 1
1255 1 105 LYS QE 1 108 ILE H . . 3.890 3.520 2.151 3.982 0.092 10 0 "[ . 1 . 2]" 1
1256 1 105 LYS QE 1 108 ILE HG13 . . 5.450 4.100 2.965 5.357 . 0 0 "[ . 1 . 2]" 1
1257 1 106 THR H 1 106 THR HB . . 3.570 3.492 3.026 3.642 0.072 3 0 "[ . 1 . 2]" 1
1258 1 106 THR H 1 106 THR MG . . 4.140 2.850 2.387 3.343 . 0 0 "[ . 1 . 2]" 1
1259 1 106 THR H 1 107 TYR H . . 3.160 2.231 1.725 2.895 . 0 0 "[ . 1 . 2]" 1
1260 1 106 THR H 1 107 TYR HB2 . . 5.500 5.477 4.796 6.334 0.834 17 1 "[ . 1 . + 2]" 1
1261 1 106 THR HA 1 106 THR HB . . 2.740 2.583 2.404 2.692 . 0 0 "[ . 1 . 2]" 1
1262 1 106 THR HA 1 106 THR MG . . 3.690 2.565 2.059 3.303 . 0 0 "[ . 1 . 2]" 1
1263 1 106 THR HB 1 107 TYR H . . 4.340 4.058 3.609 4.402 0.062 6 0 "[ . 1 . 2]" 1
1264 1 106 THR MG 1 107 TYR H . . 4.410 3.746 2.032 4.481 0.071 3 0 "[ . 1 . 2]" 1
1265 1 107 TYR H 1 107 TYR HB2 . . 4.130 3.653 3.443 3.888 . 0 0 "[ . 1 . 2]" 1
1266 1 107 TYR H 1 107 TYR QD . . 3.940 2.806 1.929 3.159 . 0 0 "[ . 1 . 2]" 1
1267 1 107 TYR H 1 108 ILE H . . 3.300 2.762 2.257 3.361 0.061 19 0 "[ . 1 . 2]" 1
1268 1 107 TYR H 1 108 ILE MD . . 4.870 4.335 3.761 4.953 0.083 13 0 "[ . 1 . 2]" 1
1269 1 107 TYR HA 1 107 TYR QD . . 3.630 3.720 3.683 3.732 0.102 9 0 "[ . 1 . 2]" 1
1270 1 107 TYR HA 1 108 ILE H . . 2.780 2.850 2.797 2.866 0.086 9 0 "[ . 1 . 2]" 1
1271 1 107 TYR HA 1 108 ILE HB . . 5.500 5.527 5.438 5.575 0.075 1 0 "[ . 1 . 2]" 1
1272 1 107 TYR HB2 1 108 ILE HG12 . . 5.430 4.969 4.439 5.460 0.030 14 0 "[ . 1 . 2]" 1
1273 1 107 TYR HB3 1 108 ILE H . . 4.790 4.630 4.573 4.737 . 0 0 "[ . 1 . 2]" 1
1274 1 107 TYR HB3 1 108 ILE HG13 . . 5.500 5.165 4.895 5.441 . 0 0 "[ . 1 . 2]" 1
1275 1 107 TYR QD 1 108 ILE H . . 4.560 4.128 3.519 4.370 . 0 0 "[ . 1 . 2]" 1
1276 1 107 TYR QD 1 108 ILE HA . . 4.680 4.163 3.690 4.738 0.058 14 0 "[ . 1 . 2]" 1
1277 1 107 TYR QD 1 108 ILE HB . . 5.300 4.809 4.425 5.144 . 0 0 "[ . 1 . 2]" 1
1278 1 107 TYR QD 1 108 ILE MD . . 3.810 3.461 3.156 3.896 0.086 12 0 "[ . 1 . 2]" 1
1279 1 107 TYR QD 1 108 ILE HG12 . . 3.800 2.890 2.368 3.865 0.065 14 0 "[ . 1 . 2]" 1
1280 1 107 TYR QE 1 108 ILE MD . . 3.350 2.841 2.379 3.422 0.072 2 0 "[ . 1 . 2]" 1
1281 1 107 TYR QE 1 108 ILE HG12 . . 5.500 3.749 3.109 4.631 . 0 0 "[ . 1 . 2]" 1
1282 1 108 ILE H 1 108 ILE HB . . 3.190 2.875 2.697 3.037 . 0 0 "[ . 1 . 2]" 1
1283 1 108 ILE H 1 108 ILE MD . . 4.890 4.279 4.080 4.506 . 0 0 "[ . 1 . 2]" 1
1284 1 108 ILE H 1 108 ILE HG12 . . 4.570 4.036 3.550 4.300 . 0 0 "[ . 1 . 2]" 1
1285 1 108 ILE H 1 108 ILE HG13 . . 3.940 3.011 2.725 3.296 . 0 0 "[ . 1 . 2]" 1
1286 1 108 ILE H 1 108 ILE MG . . 4.350 4.002 3.934 4.071 . 0 0 "[ . 1 . 2]" 1
1287 1 108 ILE H 1 109 GLN H . . 4.370 4.308 4.025 4.435 0.065 12 0 "[ . 1 . 2]" 1
1288 1 108 ILE HA 1 109 GLN H . . 2.670 2.245 2.015 2.483 . 0 0 "[ . 1 . 2]" 1
1289 1 108 ILE HA 1 109 GLN HB2 . . 4.720 4.884 4.173 5.684 0.964 1 8 "[+**-. 1* * . * *]" 1
1290 1 108 ILE HB 1 109 GLN H . . 3.790 3.745 3.325 3.869 0.079 9 0 "[ . 1 . 2]" 1
1291 1 108 ILE HG12 1 109 GLN H . . 4.710 4.389 3.964 4.636 . 0 0 "[ . 1 . 2]" 1
1292 1 108 ILE HG13 1 109 GLN H . . 4.940 4.995 4.781 5.026 0.086 17 0 "[ . 1 . 2]" 1
1293 1 108 ILE MG 1 109 GLN H . . 3.840 2.187 1.792 2.434 . 0 0 "[ . 1 . 2]" 1
1294 1 108 ILE MG 1 109 GLN QG . . 4.830 4.166 3.601 4.933 0.103 15 0 "[ . 1 . 2]" 1
1295 1 108 ILE MG 1 110 GLY H . . 5.080 4.553 1.986 5.176 0.096 6 0 "[ . 1 . 2]" 1
1296 1 109 GLN H 1 109 GLN HB2 . . 3.040 3.106 2.319 3.871 0.831 17 8 "[-***. 1* * . + *]" 1
1297 1 109 GLN H 1 109 GLN HB3 . . 3.790 3.259 2.350 3.836 0.046 9 0 "[ . 1 . 2]" 1
1298 1 109 GLN H 1 109 GLN QG . . 3.870 2.940 2.068 3.954 0.084 18 0 "[ . 1 . 2]" 1
1299 1 109 GLN H 1 110 GLY QA . . 5.040 4.645 4.224 5.107 0.067 14 0 "[ . 1 . 2]" 1
1300 1 109 GLN HA 1 110 GLY H . . 2.790 2.551 2.219 2.887 0.097 7 0 "[ . 1 . 2]" 1
1301 1 109 GLN HB2 1 110 GLY QA . . 5.400 4.570 3.954 5.545 0.145 15 0 "[ . 1 . 2]" 1
1302 1 109 GLN QG 1 110 GLY H . . 4.420 3.616 1.719 4.498 0.078 18 0 "[ . 1 . 2]" 1
1303 1 110 GLY H 1 111 GLU H . . 3.580 2.974 1.794 3.665 0.085 2 0 "[ . 1 . 2]" 1
1304 1 110 GLY QA 1 111 GLU H . . 3.150 2.499 2.164 2.929 . 0 0 "[ . 1 . 2]" 1
1305 1 111 GLU H 1 111 GLU HB2 . . 3.460 3.131 2.211 4.055 0.595 19 2 "[ -. 1 . +2]" 1
1306 1 111 GLU H 1 111 GLU HB3 . . 4.170 3.528 2.437 4.001 . 0 0 "[ . 1 . 2]" 1
1307 1 111 GLU H 1 111 GLU QG . . 4.800 3.447 2.144 4.461 . 0 0 "[ . 1 . 2]" 1
1308 1 111 GLU H 1 115 GLN HE22 . . 4.870 4.495 2.493 4.961 0.091 6 0 "[ . 1 . 2]" 1
1309 1 111 GLU HA 1 112 THR H . . 2.730 2.525 2.093 2.818 0.088 4 0 "[ . 1 . 2]" 1
1310 1 111 GLU HA 1 112 THR MG . . 5.120 4.227 3.677 4.678 . 0 0 "[ . 1 . 2]" 1
1311 1 111 GLU HA 1 115 GLN HE21 . . 5.500 2.934 2.113 3.552 . 0 0 "[ . 1 . 2]" 1
1312 1 111 GLU HB3 1 112 THR H . . 3.480 3.121 2.052 3.767 0.287 19 0 "[ . 1 . 2]" 1
1313 1 111 GLU QG 1 112 THR H . . 4.500 3.253 1.724 4.422 . 0 0 "[ . 1 . 2]" 1
1314 1 111 GLU QG 1 115 GLN HE21 . . 5.500 4.391 2.132 5.593 0.093 7 0 "[ . 1 . 2]" 1
1315 1 112 THR H 1 112 THR MG . . 3.500 3.562 3.399 3.621 0.121 10 0 "[ . 1 . 2]" 1
1316 1 112 THR H 1 113 PRO QD . . 4.790 4.357 4.237 4.470 . 0 0 "[ . 1 . 2]" 1
1317 1 112 THR H 1 115 GLN HA . . 5.500 5.220 4.440 5.573 0.073 4 0 "[ . 1 . 2]" 1
1318 1 112 THR H 1 115 GLN QG . . 4.150 3.918 2.998 4.241 0.091 7 0 "[ . 1 . 2]" 1
1319 1 112 THR H 1 116 ALA MB . . 5.500 5.148 4.366 5.618 0.118 6 0 "[ . 1 . 2]" 1
1320 1 112 THR HA 1 112 THR MG . . 3.660 2.179 2.042 2.239 . 0 0 "[ . 1 . 2]" 1
1321 1 112 THR HA 1 113 PRO HA . . 4.880 4.358 4.237 4.436 . 0 0 "[ . 1 . 2]" 1
1322 1 112 THR HA 1 113 PRO QD . . 3.000 2.199 2.137 2.306 . 0 0 "[ . 1 . 2]" 1
1323 1 112 THR HA 1 113 PRO HG2 . . 4.680 4.694 4.592 4.755 0.075 1 0 "[ . 1 . 2]" 1
1324 1 112 THR HA 1 114 GLU H . . 4.580 4.435 3.949 4.659 0.079 7 0 "[ . 1 . 2]" 1
1325 1 112 THR HA 1 115 GLN HE21 . . 4.610 4.435 3.766 4.637 0.027 14 0 "[ . 1 . 2]" 1
1326 1 112 THR HB 1 113 PRO HA . . 4.560 4.636 4.617 4.646 0.086 8 0 "[ . 1 . 2]" 1
1327 1 112 THR HB 1 113 PRO QD . . 3.830 2.310 2.161 2.543 . 0 0 "[ . 1 . 2]" 1
1328 1 112 THR HB 1 114 GLU H . . 3.490 2.722 2.054 3.096 . 0 0 "[ . 1 . 2]" 1
1329 1 112 THR HB 1 115 GLN H . . 4.660 2.805 2.550 3.230 . 0 0 "[ . 1 . 2]" 1
1330 1 112 THR HB 1 115 GLN HA . . 4.970 4.981 4.742 5.057 0.087 3 0 "[ . 1 . 2]" 1
1331 1 112 THR HB 1 115 GLN HE21 . . 5.170 3.987 3.614 4.837 . 0 0 "[ . 1 . 2]" 1
1332 1 112 THR MG 1 113 PRO QD . . 4.350 2.318 1.996 2.782 . 0 0 "[ . 1 . 2]" 1
1333 1 112 THR MG 1 114 GLU H . . 5.080 4.062 3.667 4.347 . 0 0 "[ . 1 . 2]" 1
1334 1 112 THR MG 1 115 GLN H . . 4.870 4.367 4.166 4.670 . 0 0 "[ . 1 . 2]" 1
1335 1 112 THR MG 1 115 GLN QB . . 5.500 4.062 3.818 4.381 . 0 0 "[ . 1 . 2]" 1
1336 1 113 PRO HA 1 115 GLN QB . . 5.170 4.692 4.302 5.038 . 0 0 "[ . 1 . 2]" 1
1337 1 113 PRO HA 1 116 ALA H . . 4.870 3.589 3.019 4.295 . 0 0 "[ . 1 . 2]" 1
1338 1 113 PRO QB 1 114 GLU H . . 3.550 3.179 2.858 3.659 0.109 13 0 "[ . 1 . 2]" 1
1339 1 113 PRO QB 1 116 ALA MB . . 5.500 4.412 3.793 5.537 0.037 13 0 "[ . 1 . 2]" 1
1340 1 113 PRO QD 1 114 GLU H . . 3.630 2.637 2.429 2.815 . 0 0 "[ . 1 . 2]" 1
1341 1 113 PRO QD 1 114 GLU QB . . 4.240 3.972 3.520 4.214 . 0 0 "[ . 1 . 2]" 1
1342 1 113 PRO QD 1 115 GLN HE21 . . 5.500 5.473 4.473 5.605 0.105 10 0 "[ . 1 . 2]" 1
1343 1 114 GLU H 1 114 GLU QB . . 2.930 2.274 2.025 2.544 . 0 0 "[ . 1 . 2]" 1
1344 1 114 GLU H 1 115 GLN H . . 3.460 2.698 2.285 2.947 . 0 0 "[ . 1 . 2]" 1
1345 1 114 GLU H 1 116 ALA H . . 4.660 4.487 4.264 4.734 0.074 15 0 "[ . 1 . 2]" 1
1346 1 114 GLU H 1 116 ALA MB . . 5.500 5.197 4.660 5.585 0.085 13 0 "[ . 1 . 2]" 1
1347 1 114 GLU H 1 117 ASN QB . . 5.500 4.795 4.146 5.597 0.097 4 0 "[ . 1 . 2]" 1
1348 1 114 GLU HA 1 117 ASN QB . . 3.710 2.425 2.024 3.299 . 0 0 "[ . 1 . 2]" 1
1349 1 114 GLU QB 1 117 ASN QB . . 4.680 3.805 3.073 4.359 . 0 0 "[ . 1 . 2]" 1
1350 1 115 GLN H 1 115 GLN QB . . 3.410 2.188 2.046 2.311 . 0 0 "[ . 1 . 2]" 1
1351 1 115 GLN H 1 115 GLN HE21 . . 4.540 4.165 3.473 4.581 0.041 13 0 "[ . 1 . 2]" 1
1352 1 115 GLN H 1 115 GLN QG . . 3.930 3.603 2.526 4.011 0.081 15 0 "[ . 1 . 2]" 1
1353 1 115 GLN H 1 116 ALA H . . 3.390 2.549 2.329 2.870 . 0 0 "[ . 1 . 2]" 1
1354 1 115 GLN H 1 116 ALA MB . . 4.710 4.182 3.866 4.451 . 0 0 "[ . 1 . 2]" 1
1355 1 115 GLN HA 1 115 GLN HE21 . . 5.250 4.521 4.113 5.265 0.015 6 0 "[ . 1 . 2]" 1
1356 1 115 GLN HA 1 115 GLN QG . . 3.570 2.326 2.043 3.358 . 0 0 "[ . 1 . 2]" 1
1357 1 115 GLN QB 1 116 ALA H . . 3.880 2.733 2.277 3.494 . 0 0 "[ . 1 . 2]" 1
1358 1 115 GLN QB 1 117 ASN H . . 5.250 4.640 4.410 4.822 . 0 0 "[ . 1 . 2]" 1
1359 1 115 GLN QG 1 116 ALA H . . 5.090 4.025 2.172 4.449 . 0 0 "[ . 1 . 2]" 1
1360 1 115 GLN QG 1 119 ARG QD . . 5.180 4.512 2.228 5.276 0.096 20 0 "[ . 1 . 2]" 1
1361 1 115 GLN QG 1 119 ARG QG . . 5.500 3.895 2.254 5.347 . 0 0 "[ . 1 . 2]" 1
1362 1 116 ALA H 1 116 ALA MB . . 3.190 2.202 1.952 2.273 . 0 0 "[ . 1 . 2]" 1
1363 1 116 ALA H 1 117 ASN HA . . 5.500 5.256 4.883 5.562 0.062 15 0 "[ . 1 . 2]" 1
1364 1 116 ALA H 1 117 ASN QB . . 4.600 4.423 4.040 4.666 0.066 19 0 "[ . 1 . 2]" 1
1365 1 116 ALA H 1 119 ARG QB . . 5.500 4.934 4.145 5.409 . 0 0 "[ . 1 . 2]" 1
1366 1 116 ALA HA 1 119 ARG QB . . 4.120 2.579 2.089 3.061 . 0 0 "[ . 1 . 2]" 1
1367 1 116 ALA MB 1 117 ASN H . . 3.530 2.684 2.344 2.995 . 0 0 "[ . 1 . 2]" 1
1368 1 117 ASN H 1 117 ASN QB . . 2.880 2.263 2.122 2.573 . 0 0 "[ . 1 . 2]" 1
1369 1 117 ASN H 1 118 ALA H . . 3.610 2.804 2.478 3.208 . 0 0 "[ . 1 . 2]" 1
1370 1 117 ASN HA 1 118 ALA H . . 3.530 3.574 3.470 3.605 0.075 17 0 "[ . 1 . 2]" 1
1371 1 117 ASN HA 1 119 ARG H . . 5.210 4.289 3.874 4.818 . 0 0 "[ . 1 . 2]" 1
1372 1 117 ASN HA 1 120 TYR HB2 . . 4.340 3.783 2.919 4.405 0.065 3 0 "[ . 1 . 2]" 1
1373 1 117 ASN HA 1 120 TYR HB3 . . 5.010 4.341 3.503 5.027 0.017 3 0 "[ . 1 . 2]" 1
1374 1 117 ASN QB 1 118 ALA H . . 3.390 2.495 2.194 3.231 . 0 0 "[ . 1 . 2]" 1
1375 1 118 ALA H 1 118 ALA MB . . 3.140 2.233 2.054 2.326 . 0 0 "[ . 1 . 2]" 1
1376 1 118 ALA HA 1 120 TYR HB3 . . 4.850 4.341 3.797 4.710 . 0 0 "[ . 1 . 2]" 1
1377 1 118 ALA HA 1 121 LEU QD . . 4.580 2.666 1.946 3.807 . 0 0 "[ . 1 . 2]" 1
1378 1 118 ALA HA 1 121 LEU HG . . 4.910 3.737 2.318 4.963 0.053 12 0 "[ . 1 . 2]" 1
1379 1 118 ALA MB 1 119 ARG H . . 3.520 2.929 2.348 3.397 . 0 0 "[ . 1 . 2]" 1
1380 1 119 ARG H 1 119 ARG QB . . 2.890 2.264 2.053 2.489 . 0 0 "[ . 1 . 2]" 1
1381 1 119 ARG H 1 119 ARG QG . . 3.950 2.899 2.296 3.755 . 0 0 "[ . 1 . 2]" 1
1382 1 119 ARG H 1 120 TYR HB3 . . 5.110 4.979 4.463 5.182 0.072 10 0 "[ . 1 . 2]" 1
1383 1 119 ARG HA 1 120 TYR H . . 3.510 3.493 3.375 3.567 0.057 1 0 "[ . 1 . 2]" 1
1384 1 119 ARG QB 1 120 TYR H . . 3.430 2.986 2.579 3.297 . 0 0 "[ . 1 . 2]" 1
1385 1 119 ARG QB 1 120 TYR HA . . 5.160 4.042 3.602 4.516 . 0 0 "[ . 1 . 2]" 1
1386 1 120 TYR H 1 120 TYR HB2 . . 3.170 2.333 2.140 2.514 . 0 0 "[ . 1 . 2]" 1
1387 1 120 TYR H 1 120 TYR HB3 . . 3.160 2.553 2.417 2.682 . 0 0 "[ . 1 . 2]" 1
1388 1 120 TYR H 1 120 TYR QD . . 4.150 4.118 3.963 4.217 0.067 15 0 "[ . 1 . 2]" 1
1389 1 120 TYR H 1 121 LEU QD . . 5.500 4.064 3.082 4.739 . 0 0 "[ . 1 . 2]" 1
1390 1 120 TYR HA 1 120 TYR QD . . 3.600 2.749 2.200 3.103 . 0 0 "[ . 1 . 2]" 1
1391 1 120 TYR HA 1 121 LEU H . . 3.490 3.525 3.413 3.558 0.068 9 0 "[ . 1 . 2]" 1
1392 1 120 TYR HA 1 122 LYS H . . 5.500 4.442 3.579 5.463 . 0 0 "[ . 1 . 2]" 1
1393 1 120 TYR HB2 1 121 LEU QD . . 5.500 4.652 3.784 5.299 . 0 0 "[ . 1 . 2]" 1
1394 1 120 TYR HB3 1 121 LEU H . . 3.550 2.911 2.269 3.377 . 0 0 "[ . 1 . 2]" 1
1395 1 120 TYR HB3 1 121 LEU QD . . 5.500 3.387 2.214 4.363 . 0 0 "[ . 1 . 2]" 1
1396 1 120 TYR HB3 1 121 LEU HG . . 4.240 3.444 2.621 4.287 0.047 6 0 "[ . 1 . 2]" 1
1397 1 120 TYR QD 1 121 LEU H . . 4.330 4.007 2.419 4.415 0.085 5 0 "[ . 1 . 2]" 1
1398 1 120 TYR QD 1 121 LEU QD . . 4.880 3.341 2.346 4.511 . 0 0 "[ . 1 . 2]" 1
1399 1 120 TYR QD 1 121 LEU HG . . 4.760 3.683 2.156 4.714 . 0 0 "[ . 1 . 2]" 1
1400 1 121 LEU H 1 121 LEU HB3 . . 4.060 3.492 3.059 3.918 . 0 0 "[ . 1 . 2]" 1
1401 1 121 LEU H 1 121 LEU QD . . 4.390 2.596 1.861 3.242 . 0 0 "[ . 1 . 2]" 1
1402 1 121 LEU H 1 121 LEU HG . . 2.950 2.559 1.963 3.040 0.090 15 0 "[ . 1 . 2]" 1
1403 1 121 LEU HA 1 121 LEU QD . . 3.580 2.967 2.079 3.422 . 0 0 "[ . 1 . 2]" 1
1404 1 121 LEU HA 1 122 LYS H . . 3.080 2.702 2.162 3.145 0.065 13 0 "[ . 1 . 2]" 1
1405 1 121 LEU HB3 1 122 LYS H . . 4.460 4.399 3.860 4.702 0.242 7 0 "[ . 1 . 2]" 1
1406 1 122 LYS H 1 122 LYS HB2 . . 4.110 2.797 2.130 3.843 . 0 0 "[ . 1 . 2]" 1
1407 1 122 LYS H 1 122 LYS HB3 . . 3.070 3.074 2.266 4.050 0.980 15 4 "[ .* -1 + * 2]" 1
1408 1 122 LYS HA 1 123 ARG H . . 3.100 2.503 2.145 3.185 0.085 12 0 "[ . 1 . 2]" 1
1409 1 123 ARG H 1 123 ARG HB3 . . 3.460 3.177 2.502 3.921 0.461 4 0 "[ . 1 . 2]" 1
1410 1 123 ARG HA 1 123 ARG QD . . 4.600 3.581 2.109 4.378 . 0 0 "[ . 1 . 2]" 1
1411 1 123 ARG HA 1 124 VAL H . . 2.990 2.511 2.140 3.067 0.077 6 0 "[ . 1 . 2]" 1
1412 1 123 ARG QD 1 124 VAL QG . . 5.500 5.067 4.253 5.637 0.137 1 0 "[ . 1 . 2]" 1
1413 1 123 ARG QG 1 124 VAL HA . . 5.500 4.311 3.542 5.570 0.070 4 0 "[ . 1 . 2]" 1
1414 1 123 ARG QG 1 124 VAL QG . . 4.260 3.992 2.454 4.408 0.148 5 0 "[ . 1 . 2]" 1
1415 1 124 VAL H 1 124 VAL HB . . 3.390 2.895 2.635 3.173 . 0 0 "[ . 1 . 2]" 1
1416 1 124 VAL H 1 124 VAL MG2 . . 3.400 2.674 2.041 3.032 . 0 0 "[ . 1 . 2]" 1
1417 1 124 VAL H 1 125 GLY H . . 3.690 2.272 1.805 3.094 . 0 0 "[ . 1 . 2]" 1
1418 1 124 VAL HA 1 125 GLY H . . 3.100 2.926 2.378 3.184 0.084 15 0 "[ . 1 . 2]" 1
1419 1 124 VAL HB 1 125 GLY H . . 4.030 4.021 3.732 4.128 0.098 11 0 "[ . 1 . 2]" 1
1420 1 124 VAL QG 1 125 GLY QA . . 5.500 4.195 3.978 4.325 . 0 0 "[ . 1 . 2]" 1
1421 1 124 VAL QG 1 127 ALA H . . 4.820 4.589 3.134 4.946 0.126 14 0 "[ . 1 . 2]" 1
1422 1 124 VAL MG1 1 127 ALA H . . 5.500 4.681 3.189 5.079 . 0 0 "[ . 1 . 2]" 1
1423 1 124 VAL MG2 1 125 GLY H . . 4.170 4.220 4.099 4.271 0.101 10 0 "[ . 1 . 2]" 1
1424 1 125 GLY H 1 126 ALA MB . . 5.500 4.941 4.143 5.607 0.107 13 0 "[ . 1 . 2]" 1
1425 1 125 GLY QA 1 126 ALA H . . 3.060 2.372 2.119 2.945 . 0 0 "[ . 1 . 2]" 1
1426 1 125 GLY QA 1 127 ALA H . . 5.500 4.077 3.165 5.611 0.111 11 0 "[ . 1 . 2]" 1
1427 1 126 ALA H 1 126 ALA MB . . 3.380 2.725 2.218 2.969 . 0 0 "[ . 1 . 2]" 1
1428 1 127 ALA H 1 127 ALA MB . . 3.360 2.563 2.162 3.077 . 0 0 "[ . 1 . 2]" 1
1429 1 127 ALA HA 1 128 ASN H . . 3.390 2.619 2.188 3.475 0.085 14 0 "[ . 1 . 2]" 1
1430 1 127 ALA MB 1 128 ASN H . . 4.320 2.903 1.963 3.761 . 0 0 "[ . 1 . 2]" 1
1431 1 128 ASN H 1 128 ASN HB3 . . 3.760 3.290 2.402 3.970 0.210 2 0 "[ . 1 . 2]" 1
1432 1 129 ASN HA 1 129 ASN HB3 . . 2.860 2.733 2.289 3.064 0.204 6 0 "[ . 1 . 2]" 1
1433 1 129 ASN HA 1 130 GLN H . . 3.430 2.516 2.206 3.505 0.075 3 0 "[ . 1 . 2]" 1
1434 1 129 ASN HB2 1 130 GLN H . . 5.330 4.065 2.442 4.756 . 0 0 "[ . 1 . 2]" 1
1435 1 130 GLN H 1 130 GLN QG . . 3.890 3.446 2.579 3.990 0.100 11 0 "[ . 1 . 2]" 1
1436 1 130 GLN H 1 131 ASN H . . 4.320 4.193 2.209 4.409 0.089 2 0 "[ . 1 . 2]" 1
1437 1 130 GLN H 1 131 ASN HD21 . . 4.900 4.344 3.614 5.195 0.295 10 0 "[ . 1 . 2]" 1
1438 1 130 GLN H 1 131 ASN HD22 . . 5.130 4.909 4.462 5.199 0.069 6 0 "[ . 1 . 2]" 1
1439 1 130 GLN HA 1 130 GLN QG . . 3.420 2.493 1.970 3.416 . 0 0 "[ . 1 . 2]" 1
1440 1 130 GLN HA 1 131 ASN H . . 3.150 2.410 2.187 3.226 0.076 17 0 "[ . 1 . 2]" 1
1441 1 130 GLN QB 1 131 ASN H . . 4.400 2.857 2.087 3.931 . 0 0 "[ . 1 . 2]" 1
1442 1 130 GLN QB 1 131 ASN HA . . 4.690 4.025 3.505 4.573 . 0 0 "[ . 1 . 2]" 1
1443 1 130 GLN QG 1 131 ASN HA . . 5.400 5.042 3.566 5.505 0.105 9 0 "[ . 1 . 2]" 1
1444 1 131 ASN H 1 132 PRO HD2 . . 4.920 4.424 2.865 4.959 0.039 1 0 "[ . 1 . 2]" 1
1445 1 131 ASN HA 1 131 ASN HD21 . . 4.390 3.731 2.320 4.310 . 0 0 "[ . 1 . 2]" 1
1446 1 131 ASN HA 1 131 ASN HD22 . . 5.030 4.379 3.485 5.105 0.075 3 0 "[ . 1 . 2]" 1
1447 1 131 ASN HA 1 132 PRO HD2 . . 3.160 2.451 2.124 2.877 . 0 0 "[ . 1 . 2]" 1
1448 1 131 ASN HA 1 132 PRO HD3 . . 3.850 2.675 2.280 3.240 . 0 0 "[ . 1 . 2]" 1
1449 1 131 ASN QB 1 131 ASN HD22 . . 3.600 3.347 3.247 3.481 . 0 0 "[ . 1 . 2]" 1
1450 1 131 ASN QB 1 132 PRO HD2 . . 4.860 2.990 2.175 4.254 . 0 0 "[ . 1 . 2]" 1
1451 1 131 ASN QB 1 132 PRO HD3 . . 5.480 3.924 3.393 4.573 . 0 0 "[ . 1 . 2]" 1
1452 1 132 PRO HA 1 133 ALA H . . 2.910 2.401 2.154 2.891 . 0 0 "[ . 1 . 2]" 1
1453 1 132 PRO QB 1 134 ALA H . . 4.860 4.016 3.306 4.933 0.073 10 0 "[ . 1 . 2]" 1
1454 1 133 ALA H 1 133 ALA MB . . 3.420 2.668 2.184 3.119 . 0 0 "[ . 1 . 2]" 1
1455 1 133 ALA H 1 134 ALA H . . 3.120 2.963 2.097 3.206 0.086 8 0 "[ . 1 . 2]" 1
1456 1 133 ALA MB 1 134 ALA H . . 3.350 2.951 1.949 3.604 0.254 8 0 "[ . 1 . 2]" 1
1457 1 134 ALA H 1 134 ALA HA . . 2.850 2.746 2.149 2.934 0.084 19 0 "[ . 1 . 2]" 1
1458 1 134 ALA HA 1 135 GLU H . . 2.870 2.540 2.211 2.941 0.071 5 0 "[ . 1 . 2]" 1
1459 1 134 ALA MB 1 135 GLU H . . 4.110 3.096 1.945 3.797 . 0 0 "[ . 1 . 2]" 1
1460 1 134 ALA MB 1 136 ASP H . . 5.440 4.573 2.662 5.545 0.105 20 0 "[ . 1 . 2]" 1
1461 1 135 GLU H 1 136 ASP QB . . 5.140 3.877 3.235 5.020 . 0 0 "[ . 1 . 2]" 1
1462 1 135 GLU HA 1 136 ASP H . . 3.030 2.573 2.126 3.110 0.080 15 0 "[ . 1 . 2]" 1
1463 1 135 GLU QB 1 136 ASP HA . . 4.710 4.465 4.161 4.758 0.048 4 0 "[ . 1 . 2]" 1
1464 1 135 GLU QB 1 136 ASP QB . . 5.500 4.752 3.153 5.287 . 0 0 "[ . 1 . 2]" 1
1465 1 135 GLU QG 1 136 ASP H . . 4.990 3.783 2.466 4.874 . 0 0 "[ . 1 . 2]" 1
1466 1 136 ASP H 1 136 ASP QB . . 3.650 2.738 2.323 3.064 . 0 0 "[ . 1 . 2]" 1
1467 1 136 ASP H 1 138 GLY H . . 3.840 3.738 3.025 3.926 0.086 2 0 "[ . 1 . 2]" 1
1468 1 136 ASP HA 1 137 LYS H . . 3.070 2.718 2.113 3.159 0.089 9 0 "[ . 1 . 2]" 1
1469 1 136 ASP HA 1 138 GLY H . . 5.330 4.186 2.780 5.075 . 0 0 "[ . 1 . 2]" 1
1470 1 136 ASP QB 1 138 GLY H . . 4.650 3.294 2.353 4.390 . 0 0 "[ . 1 . 2]" 1
1471 1 136 ASP QB 1 139 ALA H . . 5.500 4.610 2.569 5.413 . 0 0 "[ . 1 . 2]" 1
1472 1 137 LYS H 1 137 LYS HB2 . . 4.150 2.799 1.991 3.908 . 0 0 "[ . 1 . 2]" 1
1473 1 137 LYS H 1 138 GLY QA . . 5.500 4.652 4.154 5.089 . 0 0 "[ . 1 . 2]" 1
1474 1 137 LYS HA 1 138 GLY H . . 3.450 3.136 2.389 3.522 0.072 18 0 "[ . 1 . 2]" 1
1475 1 137 LYS HB2 1 138 GLY H . . 4.630 4.225 3.384 4.596 . 0 0 "[ . 1 . 2]" 1
1476 1 137 LYS HB3 1 138 GLY H . . 4.600 3.978 2.262 4.622 0.022 15 0 "[ . 1 . 2]" 1
1477 1 138 GLY H 1 139 ALA H . . 4.000 3.031 2.541 4.084 0.084 10 0 "[ . 1 . 2]" 1
1478 1 138 GLY H 1 139 ALA MB . . 5.500 4.542 3.618 5.558 0.058 10 0 "[ . 1 . 2]" 1
1479 1 138 GLY QA 1 139 ALA H . . 3.080 2.603 2.036 3.014 . 0 0 "[ . 1 . 2]" 1
1480 1 138 GLY QA 1 139 ALA HA . . 4.390 4.159 3.778 4.388 . 0 0 "[ . 1 . 2]" 1
1481 1 139 ALA H 1 139 ALA MB . . 3.460 2.688 2.225 2.933 . 0 0 "[ . 1 . 2]" 1
1482 1 139 ALA H 1 140 THR HB . . 5.150 4.910 4.357 5.243 0.093 2 0 "[ . 1 . 2]" 1
1483 1 139 ALA HA 1 140 THR H . . 3.000 2.664 2.214 3.097 0.097 5 0 "[ . 1 . 2]" 1
1484 1 139 ALA HA 1 140 THR MG . . 5.500 4.456 3.391 5.626 0.126 19 0 "[ . 1 . 2]" 1
1485 1 139 ALA HA 1 142 PRO HB3 . . 5.130 4.419 3.641 5.189 0.059 15 0 "[ . 1 . 2]" 1
1486 1 139 ALA HA 1 142 PRO HD3 . . 5.150 3.173 2.174 4.341 . 0 0 "[ . 1 . 2]" 1
1487 1 139 ALA HA 1 142 PRO QG . . 4.560 4.175 2.503 4.528 . 0 0 "[ . 1 . 2]" 1
1488 1 139 ALA MB 1 140 THR H . . 4.350 3.510 1.903 3.784 . 0 0 "[ . 1 . 2]" 1
1489 1 139 ALA MB 1 141 THR H . . 5.020 4.175 2.952 5.100 0.080 11 0 "[ . 1 . 2]" 1
1490 1 139 ALA MB 1 142 PRO HB3 . . 5.100 4.394 2.142 5.185 0.085 16 0 "[ . 1 . 2]" 1
1491 1 139 ALA MB 1 142 PRO HD2 . . 3.710 3.943 2.693 4.564 0.854 6 9 "[* **.+-* 1 * . **2]" 1
1492 1 139 ALA MB 1 142 PRO HD3 . . 4.460 3.058 2.334 3.776 . 0 0 "[ . 1 . 2]" 1
1493 1 139 ALA MB 1 142 PRO QG . . 4.310 3.401 2.148 4.184 . 0 0 "[ . 1 . 2]" 1
1494 1 140 THR H 1 140 THR HB . . 3.960 2.689 2.232 3.777 . 0 0 "[ . 1 . 2]" 1
1495 1 140 THR H 1 140 THR MG . . 4.290 2.647 1.866 3.920 . 0 0 "[ . 1 . 2]" 1
1496 1 140 THR HA 1 140 THR HB . . 2.930 2.592 2.251 3.011 0.081 19 0 "[ . 1 . 2]" 1
1497 1 141 THR H 1 141 THR HB . . 3.880 3.294 2.757 3.721 . 0 0 "[ . 1 . 2]" 1
1498 1 141 THR H 1 141 THR MG . . 4.250 3.746 2.165 4.083 . 0 0 "[ . 1 . 2]" 1
1499 1 141 THR HA 1 142 PRO HD2 . . 3.390 2.142 1.928 2.285 . 0 0 "[ . 1 . 2]" 1
1500 1 141 THR HA 1 142 PRO HD3 . . 3.520 2.966 2.638 3.316 . 0 0 "[ . 1 . 2]" 1
1501 1 141 THR HA 1 142 PRO QG . . 5.450 3.957 3.748 4.083 . 0 0 "[ . 1 . 2]" 1
1502 1 141 THR HB 1 142 PRO HD3 . . 5.230 5.148 4.931 5.305 0.075 14 0 "[ . 1 . 2]" 1
1503 1 141 THR HB 1 143 ALA MB . . 5.120 4.784 3.811 5.473 0.353 8 0 "[ . 1 . 2]" 1
1504 1 141 THR MG 1 142 PRO HA . . 4.650 4.549 4.237 4.714 0.064 13 0 "[ . 1 . 2]" 1
1505 1 141 THR MG 1 142 PRO HD2 . . 4.330 3.817 3.301 4.571 0.241 8 0 "[ . 1 . 2]" 1
1506 1 141 THR MG 1 142 PRO HD3 . . 5.500 4.608 4.346 4.948 . 0 0 "[ . 1 . 2]" 1
1507 1 141 THR MG 1 143 ALA H . . 5.150 3.279 2.638 4.160 . 0 0 "[ . 1 . 2]" 1
1508 1 141 THR MG 1 143 ALA MB . . 3.660 2.890 2.075 3.835 0.175 8 0 "[ . 1 . 2]" 1
1509 1 141 THR MG 1 144 SER H . . 5.500 5.481 5.121 6.141 0.641 8 1 "[ . + 1 . 2]" 1
1510 1 142 PRO HA 1 143 ALA MB . . 4.220 4.158 3.999 4.309 0.089 14 0 "[ . 1 . 2]" 1
1511 1 142 PRO HB2 1 143 ALA H . . 4.600 3.707 2.838 4.261 . 0 0 "[ . 1 . 2]" 1
1512 1 142 PRO HB2 1 144 SER HA . . 4.940 4.679 3.638 5.017 0.077 14 0 "[ . 1 . 2]" 1
1513 1 142 PRO HB2 1 144 SER QB . . 5.470 3.794 2.553 5.346 . 0 0 "[ . 1 . 2]" 1
1514 1 142 PRO HB3 1 143 ALA H . . 4.380 4.315 3.947 4.481 0.101 8 0 "[ . 1 . 2]" 1
1515 1 142 PRO HD2 1 143 ALA H . . 5.220 3.498 2.497 5.208 . 0 0 "[ . 1 . 2]" 1
1516 1 142 PRO HD3 1 143 ALA H . . 5.500 4.325 3.758 5.463 . 0 0 "[ . 1 . 2]" 1
1517 1 142 PRO QG 1 143 ALA H . . 4.780 3.191 2.049 4.605 . 0 0 "[ . 1 . 2]" 1
1518 1 142 PRO QG 1 144 SER H . . 4.590 3.171 2.424 4.536 . 0 0 "[ . 1 . 2]" 1
1519 1 143 ALA H 1 143 ALA MB . . 3.250 2.678 2.237 3.054 . 0 0 "[ . 1 . 2]" 1
1520 1 143 ALA H 1 144 SER H . . 3.640 2.954 2.190 3.685 0.045 11 0 "[ . 1 . 2]" 1
1521 1 143 ALA HA 1 144 SER H . . 2.970 2.861 2.164 3.062 0.092 10 0 "[ . 1 . 2]" 1
1522 1 143 ALA MB 1 144 SER H . . 4.150 3.685 3.374 3.842 . 0 0 "[ . 1 . 2]" 1
1523 1 144 SER H 1 144 SER HB3 . . 3.580 3.397 2.488 4.178 0.598 15 1 "[ . 1 + 2]" 1
1524 1 144 SER H 1 146 GLU QG . . 5.500 5.423 4.541 5.607 0.107 20 0 "[ . 1 . 2]" 1
1525 1 144 SER HA 1 145 LYS H . . 3.090 2.363 2.047 3.101 0.011 15 0 "[ . 1 . 2]" 1
1526 1 144 SER HA 1 145 LYS QB . . 4.400 4.336 3.938 4.499 0.099 19 0 "[ . 1 . 2]" 1
1527 1 144 SER HA 1 146 GLU H . . 4.930 4.347 3.533 5.004 0.074 9 0 "[ . 1 . 2]" 1
1528 1 144 SER QB 1 146 GLU QG . . 5.500 4.057 2.140 5.590 0.090 1 0 "[ . 1 . 2]" 1
1529 1 145 LYS H 1 145 LYS HB3 . . 3.450 3.556 2.470 3.881 0.431 19 0 "[ . 1 . 2]" 1
1530 1 145 LYS H 1 145 LYS QG . . 4.140 3.657 2.421 4.058 . 0 0 "[ . 1 . 2]" 1
1531 1 145 LYS H 1 146 GLU QG . . 5.500 3.283 1.992 5.432 . 0 0 "[ . 1 . 2]" 1
1532 1 145 LYS HA 1 145 LYS QG . . 3.210 2.493 2.032 3.315 0.105 20 0 "[ . 1 . 2]" 1
1533 1 145 LYS HA 1 146 GLU H . . 3.130 2.512 2.172 3.141 0.011 17 0 "[ . 1 . 2]" 1
1534 1 145 LYS HA 1 146 GLU QG . . 4.430 4.273 3.646 4.535 0.105 17 0 "[ . 1 . 2]" 1
1535 1 145 LYS HB2 1 146 GLU H . . 4.820 4.453 3.799 4.670 . 0 0 "[ . 1 . 2]" 1
1536 1 145 LYS QG 1 146 GLU H . . 4.820 4.438 3.921 4.673 . 0 0 "[ . 1 . 2]" 1
1537 1 146 GLU H 1 146 GLU HB2 . . 3.350 3.047 2.305 3.934 0.584 15 3 "[* - 1 + 2]" 1
1538 1 146 GLU H 1 146 GLU QG . . 4.590 2.578 1.721 3.388 . 0 0 "[ . 1 . 2]" 1
1539 1 147 GLU H 1 147 GLU HA . . 2.880 2.710 2.120 2.954 0.074 6 0 "[ . 1 . 2]" 1
1540 1 147 GLU H 1 148 ALA MB . . 5.500 4.594 3.649 5.440 . 0 0 "[ . 1 . 2]" 1
1541 1 147 GLU HA 1 148 ALA H . . 2.960 2.482 2.093 3.046 0.086 17 0 "[ . 1 . 2]" 1
1542 1 148 ALA H 1 148 ALA MB . . 3.260 2.605 2.213 3.067 . 0 0 "[ . 1 . 2]" 1
1543 1 148 ALA H 1 149 LYS H . . 3.260 2.813 1.716 3.338 0.078 14 0 "[ . 1 . 2]" 1
1544 1 149 LYS H 1 149 LYS QG . . 4.720 3.933 2.121 4.321 . 0 0 "[ . 1 . 2]" 1
1545 1 149 LYS HA 1 150 LYS H . . 2.880 2.434 2.143 2.829 . 0 0 "[ . 1 . 2]" 1
1546 1 149 LYS QG 1 150 LYS H . . 3.940 2.850 1.718 3.909 . 0 0 "[ . 1 . 2]" 1
1547 1 149 LYS QG 1 150 LYS HA . . 4.370 3.753 3.035 4.326 . 0 0 "[ . 1 . 2]" 1
1548 1 150 LYS H 1 151 SER HB2 . . 4.890 4.579 3.644 5.581 0.691 11 3 "[ . -+ * 2]" 1
1549 1 150 LYS H 1 151 SER HB3 . . 5.500 5.335 4.088 5.586 0.086 12 0 "[ . 1 . 2]" 1
1550 1 150 LYS HA 1 151 SER H . . 3.130 2.434 2.203 2.747 . 0 0 "[ . 1 . 2]" 1
1551 1 150 LYS QB 1 152 GLU H . . 5.500 4.814 3.509 5.415 . 0 0 "[ . 1 . 2]" 1
1552 1 151 SER H 1 151 SER HB3 . . 3.480 3.371 2.841 3.998 0.518 10 2 "[ . +- . 2]" 1
1553 1 151 SER HA 1 152 GLU H . . 3.310 2.457 1.929 3.397 0.087 17 0 "[ . 1 . 2]" 1
1554 1 151 SER HB3 1 152 GLU H . . 4.080 3.798 2.412 4.632 0.552 15 1 "[ . 1 + 2]" 1
1555 1 152 GLU H 1 152 GLU HB3 . . 3.500 3.431 2.672 4.115 0.615 17 2 "[ . 1 -. + 2]" 1
1556 1 152 GLU H 1 152 GLU HG3 . . 5.130 4.077 3.020 5.070 . 0 0 "[ . 1 . 2]" 1
1557 1 152 GLU H 1 153 ALA MB . . 5.500 4.500 3.437 5.314 . 0 0 "[ . 1 . 2]" 1
1558 1 153 ALA MB 1 154 ALA H . . 3.180 2.475 1.921 3.188 0.008 20 0 "[ . 1 . 2]" 1
1559 1 154 ALA HA 1 155 ALA H . . 2.970 2.393 2.121 3.039 0.069 16 0 "[ . 1 . 2]" 1
1560 1 155 ALA H 1 155 ALA MB . . 3.250 2.516 2.202 2.806 . 0 0 "[ . 1 . 2]" 1
1561 1 155 ALA MB 1 156 LYS H . . 3.870 2.824 2.032 3.731 . 0 0 "[ . 1 . 2]" 1
1562 1 156 LYS H 1 157 ASN H . . 3.800 3.250 1.972 3.886 0.086 17 0 "[ . 1 . 2]" 1
1563 1 156 LYS H 1 157 ASN QB . . 5.050 4.598 3.631 5.110 0.060 14 0 "[ . 1 . 2]" 1
1564 1 156 LYS HA 1 156 LYS QD . . 4.780 3.618 2.150 4.629 . 0 0 "[ . 1 . 2]" 1
1565 1 156 LYS QB 1 156 LYS QD . . 2.500 2.270 2.118 2.507 0.007 6 0 "[ . 1 . 2]" 1
1566 1 156 LYS HB3 1 157 ASN H . . 4.470 4.041 2.426 4.675 0.205 3 0 "[ . 1 . 2]" 1
1567 1 156 LYS QD 1 156 LYS HG3 . . 2.400 2.354 2.156 2.548 0.148 10 0 "[ . 1 . 2]" 1
1568 1 156 LYS QD 1 157 ASN H . . 5.500 4.949 4.138 5.571 0.071 1 0 "[ . 1 . 2]" 1
1569 1 157 ASN H 1 158 ALA MB . . 4.990 4.573 3.638 5.108 0.118 9 0 "[ . 1 . 2]" 1
1570 1 158 ALA MB 1 159 GLY H . . 4.640 2.574 1.932 3.755 . 0 0 "[ . 1 . 2]" 1
1571 1 162 ALA H 1 163 GLY QA . . 5.110 4.387 3.585 5.140 0.030 14 0 "[ . 1 . 2]" 1
1572 1 162 ALA HA 1 163 GLY H . . 3.410 2.861 2.419 3.494 0.084 16 0 "[ . 1 . 2]" 1
1573 1 162 ALA MB 1 163 GLY H . . 4.690 2.240 1.935 3.086 . 0 0 "[ . 1 . 2]" 1
1574 1 162 ALA MB 1 163 GLY QA . . 3.850 3.656 3.404 3.892 0.042 16 0 "[ . 1 . 2]" 1
1575 1 163 GLY H 1 164 LYS H . . 5.350 4.168 3.098 4.662 . 0 0 "[ . 1 . 2]" 1
1576 1 163 GLY QA 1 164 LYS H . . 2.960 2.270 2.128 2.460 . 0 0 "[ . 1 . 2]" 1
1577 1 164 LYS HA 1 165 ALA H . . 2.880 2.452 2.128 2.961 0.081 6 0 "[ . 1 . 2]" 1
1578 1 164 LYS HB2 1 165 ALA H . . 4.740 3.807 2.384 4.714 . 0 0 "[ . 1 . 2]" 1
1579 1 165 ALA H 1 166 LEU QD . . 5.500 5.032 4.016 5.616 0.116 12 0 "[ . 1 . 2]" 1
1580 1 165 ALA HA 1 166 LEU H . . 2.700 2.518 2.143 2.754 0.054 10 0 "[ . 1 . 2]" 1
1581 1 166 LEU H 1 166 LEU HB3 . . 3.160 3.212 2.715 4.058 0.898 10 1 "[ . + . 2]" 1
1582 1 166 LEU H 1 166 LEU QD . . 4.720 3.614 1.902 4.158 . 0 0 "[ . 1 . 2]" 1
1583 1 166 LEU H 1 167 PRO HA . . 5.030 4.633 4.168 5.121 0.091 10 0 "[ . 1 . 2]" 1
1584 1 166 LEU HA 1 166 LEU QD . . 4.160 2.576 2.000 3.495 . 0 0 "[ . 1 . 2]" 1
1585 1 166 LEU HA 1 167 PRO HB3 . . 5.100 5.049 4.850 5.159 0.059 10 0 "[ . 1 . 2]" 1
1586 1 166 LEU HA 1 167 PRO HD2 . . 3.420 2.309 2.048 2.674 . 0 0 "[ . 1 . 2]" 1
1587 1 166 LEU HA 1 167 PRO HD3 . . 3.390 2.620 2.262 2.819 . 0 0 "[ . 1 . 2]" 1
1588 1 166 LEU HB2 1 167 PRO HD2 . . 4.480 3.855 1.943 4.627 0.147 17 0 "[ . 1 . 2]" 1
1589 1 166 LEU HB2 1 167 PRO HD3 . . 4.950 4.690 3.358 5.410 0.460 3 0 "[ . 1 . 2]" 1
1590 1 166 LEU QD 1 167 PRO HA . . 4.460 4.252 3.418 4.595 0.135 3 0 "[ . 1 . 2]" 1
1591 1 166 LEU QD 1 167 PRO HB2 . . 5.070 4.689 4.024 5.175 0.105 12 0 "[ . 1 . 2]" 1
1592 1 166 LEU QD 1 167 PRO HB3 . . 5.390 4.918 4.419 5.313 . 0 0 "[ . 1 . 2]" 1
1593 1 166 LEU QD 1 167 PRO HD2 . . 4.820 2.432 1.860 2.977 . 0 0 "[ . 1 . 2]" 1
1594 1 166 LEU QD 1 167 PRO HD3 . . 5.240 3.674 3.003 4.284 . 0 0 "[ . 1 . 2]" 1
1595 1 166 LEU QD 1 167 PRO QG . . 4.980 3.239 2.647 3.868 . 0 0 "[ . 1 . 2]" 1
1596 1 167 PRO HA 1 168 LYS H . . 2.900 2.441 2.196 2.856 . 0 0 "[ . 1 . 2]" 1
1597 1 168 LYS H 1 168 LYS QB . . 3.670 2.738 2.105 3.443 . 0 0 "[ . 1 . 2]" 1
1598 1 168 LYS HA 1 169 THR H . . 3.060 2.424 2.081 3.110 0.050 12 0 "[ . 1 . 2]" 1
1599 1 169 THR H 1 169 THR MG . . 4.790 2.953 2.096 3.975 . 0 0 "[ . 1 . 2]" 1
1600 1 169 THR HA 1 170 SER H . . 3.450 2.454 2.143 3.532 0.082 9 0 "[ . 1 . 2]" 1
1601 1 169 THR HA 1 170 SER HA . . 4.410 4.443 4.232 4.494 0.084 18 0 "[ . 1 . 2]" 1
1602 1 169 THR MG 1 170 SER H . . 4.050 3.315 2.271 4.103 0.053 13 0 "[ . 1 . 2]" 1
1603 1 170 SER H 1 170 SER HB3 . . 4.160 3.555 2.641 3.889 . 0 0 "[ . 1 . 2]" 1
1604 1 170 SER HA 1 171 ALA H . . 2.920 2.553 2.153 2.964 0.044 13 0 "[ . 1 . 2]" 1
1605 1 170 SER HA 1 171 ALA MB . . 5.290 4.327 4.018 4.634 . 0 0 "[ . 1 . 2]" 1
1606 1 170 SER HA 1 172 VAL H . . 3.620 3.495 3.137 3.701 0.081 1 0 "[ . 1 . 2]" 1
1607 1 170 SER HB3 1 171 ALA H . . 4.660 4.386 3.200 4.672 0.012 9 0 "[ . 1 . 2]" 1
1608 1 170 SER HB3 1 172 VAL H . . 5.500 4.393 3.057 5.547 0.047 20 0 "[ . 1 . 2]" 1
1609 1 170 SER HB3 1 172 VAL QG . . 5.500 4.164 2.898 5.503 0.003 9 0 "[ . 1 . 2]" 1
1610 1 171 ALA H 1 172 VAL H . . 4.030 2.851 2.084 3.481 . 0 0 "[ . 1 . 2]" 1
1611 1 171 ALA HA 1 172 VAL H . . 3.100 3.050 2.653 3.186 0.086 3 0 "[ . 1 . 2]" 1
1612 1 171 ALA HA 1 172 VAL QG . . 4.640 4.231 3.446 4.567 . 0 0 "[ . 1 . 2]" 1
1613 1 171 ALA MB 1 172 VAL H . . 4.710 3.548 3.126 3.790 . 0 0 "[ . 1 . 2]" 1
1614 1 171 ALA MB 1 172 VAL HA . . 4.390 4.279 4.067 4.489 0.099 16 0 "[ . 1 . 2]" 1
1615 1 172 VAL H 1 172 VAL HB . . 3.610 3.044 2.398 3.669 0.059 13 0 "[ . 1 . 2]" 1
1616 1 172 VAL H 1 172 VAL QG . . 4.000 2.143 1.856 2.540 . 0 0 "[ . 1 . 2]" 1
1617 1 172 VAL HA 1 173 LYS H . . 2.980 2.343 2.165 3.043 0.063 7 0 "[ . 1 . 2]" 1
1618 1 172 VAL HB 1 173 LYS H . . 4.370 3.844 2.459 4.432 0.062 16 0 "[ . 1 . 2]" 1
1619 1 172 VAL QG 1 173 LYS H . . 4.900 2.773 1.884 3.865 . 0 0 "[ . 1 . 2]" 1
stop_
save_