NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
563222 |
2lxn   |
17935 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lxn
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 1504
_Distance_constraint_stats_list.Viol_count 6248
_Distance_constraint_stats_list.Viol_total 5988.618
_Distance_constraint_stats_list.Viol_max 0.568
_Distance_constraint_stats_list.Viol_rms 0.0270
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0100
_Distance_constraint_stats_list.Viol_average_violations_only 0.0479
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ILE 8.338 0.126 6 0 "[ . 1 . 2]"
1 3 VAL 3.696 0.144 9 0 "[ . 1 . 2]"
1 4 ILE 6.203 0.168 12 0 "[ . 1 . 2]"
1 5 LEU 3.027 0.103 20 0 "[ . 1 . 2]"
1 6 ASP 2.943 0.096 20 0 "[ . 1 . 2]"
1 7 ASN 2.827 0.084 15 0 "[ . 1 . 2]"
1 8 GLY 2.724 0.128 8 0 "[ . 1 . 2]"
1 9 GLY 1.172 0.093 20 0 "[ . 1 . 2]"
1 12 VAL 4.281 0.185 15 0 "[ . 1 . 2]"
1 13 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 ARG 0.222 0.043 3 0 "[ . 1 . 2]"
1 15 ILE 5.285 0.185 15 0 "[ . 1 . 2]"
1 16 HIS 0.400 0.044 19 0 "[ . 1 . 2]"
1 17 ARG 0.668 0.071 2 0 "[ . 1 . 2]"
1 18 SER 3.876 0.284 7 0 "[ . 1 . 2]"
1 19 LEU 4.106 0.166 14 0 "[ . 1 . 2]"
1 20 LYS 11.582 0.512 7 2 "[ . + - . 2]"
1 21 TYR 4.519 0.212 14 0 "[ . 1 . 2]"
1 22 ILE 7.877 0.212 14 0 "[ . 1 . 2]"
1 23 GLY 0.532 0.154 19 0 "[ . 1 . 2]"
1 24 VAL 0.963 0.116 7 0 "[ . 1 . 2]"
1 25 SER 0.067 0.026 16 0 "[ . 1 . 2]"
1 26 SER 4.072 0.161 5 0 "[ . 1 . 2]"
1 27 LYS 8.395 0.260 18 0 "[ . 1 . 2]"
1 28 ILE 4.294 0.260 18 0 "[ . 1 . 2]"
1 29 VAL 6.667 0.181 12 0 "[ . 1 . 2]"
1 30 PRO 1.538 0.074 12 0 "[ . 1 . 2]"
1 31 ASN 3.765 0.152 15 0 "[ . 1 . 2]"
1 32 THR 2.975 0.152 15 0 "[ . 1 . 2]"
1 33 THR 1.159 0.080 18 0 "[ . 1 . 2]"
1 34 PRO 0.017 0.010 3 0 "[ . 1 . 2]"
1 35 LEU 6.227 0.375 19 0 "[ . 1 . 2]"
1 36 GLU 5.556 0.375 19 0 "[ . 1 . 2]"
1 37 GLU 5.512 0.145 12 0 "[ . 1 . 2]"
1 38 ILE 4.375 0.185 16 0 "[ . 1 . 2]"
1 39 GLU 4.983 0.219 16 0 "[ . 1 . 2]"
1 40 SER 4.324 0.169 7 0 "[ . 1 . 2]"
1 41 ASN 6.990 0.232 16 0 "[ . 1 . 2]"
1 42 LYS 5.049 0.180 13 0 "[ . 1 . 2]"
1 43 GLU 7.563 0.223 16 0 "[ . 1 . 2]"
1 44 VAL 5.169 0.261 16 0 "[ . 1 . 2]"
1 45 LYS 3.068 0.148 17 0 "[ . 1 . 2]"
1 46 GLY 9.783 0.267 5 0 "[ . 1 . 2]"
1 47 ILE 5.569 0.267 5 0 "[ . 1 . 2]"
1 48 ILE 5.382 0.112 12 0 "[ . 1 . 2]"
1 49 LEU 2.543 0.103 16 0 "[ . 1 . 2]"
1 50 SER 0.635 0.053 20 0 "[ . 1 . 2]"
1 51 GLY 0.373 0.079 19 0 "[ . 1 . 2]"
1 52 GLY 1.416 0.124 20 0 "[ . 1 . 2]"
1 53 PRO 1.293 0.093 20 0 "[ . 1 . 2]"
1 54 ASP 2.507 0.261 11 0 "[ . 1 . 2]"
1 55 ILE 2.241 0.147 3 0 "[ . 1 . 2]"
1 56 GLU 1.963 0.261 11 0 "[ . 1 . 2]"
1 57 LYS 0.605 0.075 15 0 "[ . 1 . 2]"
1 58 ALA 1.397 0.096 18 0 "[ . 1 . 2]"
1 59 LYS 0.568 0.078 11 0 "[ . 1 . 2]"
1 60 ASN 0.725 0.058 11 0 "[ . 1 . 2]"
1 61 CYS 7.935 0.133 10 0 "[ . 1 . 2]"
1 62 ILE 4.415 0.133 10 0 "[ . 1 . 2]"
1 63 ASP 2.917 0.088 13 0 "[ . 1 . 2]"
1 64 ILE 2.189 0.111 15 0 "[ . 1 . 2]"
1 65 ALA 1.406 0.128 17 0 "[ . 1 . 2]"
1 66 LEU 0.810 0.051 17 0 "[ . 1 . 2]"
1 67 ASN 2.039 0.088 13 0 "[ . 1 . 2]"
1 68 ALA 1.345 0.097 17 0 "[ . 1 . 2]"
1 69 LYS 0.819 0.098 17 0 "[ . 1 . 2]"
1 70 LEU 2.867 0.159 16 0 "[ . 1 . 2]"
1 71 PRO 2.405 0.144 13 0 "[ . 1 . 2]"
1 72 ILE 2.850 0.128 17 0 "[ . 1 . 2]"
1 73 LEU 2.277 0.082 6 0 "[ . 1 . 2]"
1 74 GLY 2.473 0.112 12 0 "[ . 1 . 2]"
1 75 ILE 4.329 0.103 16 0 "[ . 1 . 2]"
1 76 CYS 0.043 0.025 5 0 "[ . 1 . 2]"
1 77 LEU 0.668 0.129 11 0 "[ . 1 . 2]"
1 78 GLY 2.474 0.125 15 0 "[ . 1 . 2]"
1 79 HIS 3.787 0.253 12 0 "[ . 1 . 2]"
1 80 GLN 4.157 0.167 14 0 "[ . 1 . 2]"
1 81 LEU 8.541 0.253 12 0 "[ . 1 . 2]"
1 82 ILE 2.909 0.227 9 0 "[ . 1 . 2]"
1 83 ALA 10.087 0.185 15 0 "[ . 1 . 2]"
1 84 LEU 6.023 0.227 9 0 "[ . 1 . 2]"
1 85 ALA 1.533 0.170 12 0 "[ . 1 . 2]"
1 86 TYR 1.605 0.145 12 0 "[ . 1 . 2]"
1 87 GLY 0.850 0.103 12 0 "[ . 1 . 2]"
1 88 GLY 4.052 0.185 15 0 "[ . 1 . 2]"
1 89 GLU 6.085 0.165 17 0 "[ . 1 . 2]"
1 90 VAL 7.080 0.139 5 0 "[ . 1 . 2]"
1 91 GLY 4.148 0.149 8 0 "[ . 1 . 2]"
1 92 ARG 5.664 0.121 11 0 "[ . 1 . 2]"
1 93 ALA 3.046 0.117 11 0 "[ . 1 . 2]"
1 94 GLU 7.043 0.173 15 0 "[ . 1 . 2]"
1 95 ALA 6.926 0.173 15 0 "[ . 1 . 2]"
1 96 GLU 0.812 0.048 1 0 "[ . 1 . 2]"
1 97 GLU 2.225 0.148 1 0 "[ . 1 . 2]"
1 98 TYR 2.684 0.148 1 0 "[ . 1 . 2]"
1 99 ALA 1.032 0.084 1 0 "[ . 1 . 2]"
1 100 LEU 0.227 0.109 20 0 "[ . 1 . 2]"
1 101 THR 1.211 0.094 6 0 "[ . 1 . 2]"
1 102 LYS 10.082 0.157 4 0 "[ . 1 . 2]"
1 103 VAL 4.233 0.161 17 0 "[ . 1 . 2]"
1 104 TYR 2.768 0.568 8 1 "[ . + 1 . 2]"
1 105 VAL 2.551 0.171 9 0 "[ . 1 . 2]"
1 106 ASP 0.996 0.076 9 0 "[ . 1 . 2]"
1 107 LYS 1.974 0.095 20 0 "[ . 1 . 2]"
1 108 GLU 1.409 0.093 17 0 "[ . 1 . 2]"
1 109 ASN 2.092 0.095 20 0 "[ . 1 . 2]"
1 110 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 111 LEU 4.180 0.117 7 0 "[ . 1 . 2]"
1 112 PHE 4.452 0.081 5 0 "[ . 1 . 2]"
1 113 LYS 5.153 0.101 5 0 "[ . 1 . 2]"
1 114 ASN 6.991 0.125 19 0 "[ . 1 . 2]"
1 115 VAL 5.293 0.125 19 0 "[ . 1 . 2]"
1 116 PRO 2.163 0.183 20 0 "[ . 1 . 2]"
1 117 ARG 3.189 0.159 20 0 "[ . 1 . 2]"
1 118 GLU 2.648 0.171 9 0 "[ . 1 . 2]"
1 119 PHE 9.637 0.288 17 0 "[ . 1 . 2]"
1 120 ASN 1.314 0.079 20 0 "[ . 1 . 2]"
1 121 ALA 1.696 0.094 6 0 "[ . 1 . 2]"
1 122 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 ALA 2.824 0.140 11 0 "[ . 1 . 2]"
1 124 SER 0.011 0.011 1 0 "[ . 1 . 2]"
1 125 HIS 2.980 0.119 1 0 "[ . 1 . 2]"
1 126 LYS 0.402 0.056 1 0 "[ . 1 . 2]"
1 127 ASP 4.052 0.149 8 0 "[ . 1 . 2]"
1 128 GLU 2.683 0.086 9 0 "[ . 1 . 2]"
1 129 VAL 4.783 0.093 9 0 "[ . 1 . 2]"
1 130 LYS 4.221 0.165 17 0 "[ . 1 . 2]"
1 131 LYS 2.875 0.203 1 0 "[ . 1 . 2]"
1 132 VAL 5.425 0.203 1 0 "[ . 1 . 2]"
1 133 PRO 4.469 0.139 5 0 "[ . 1 . 2]"
1 134 GLU 0.236 0.039 13 0 "[ . 1 . 2]"
1 135 GLY 0.496 0.064 14 0 "[ . 1 . 2]"
1 136 PHE 5.808 0.141 16 0 "[ . 1 . 2]"
1 137 GLU 3.786 0.143 18 0 "[ . 1 . 2]"
1 138 ILE 2.456 0.124 20 0 "[ . 1 . 2]"
1 139 LEU 0.656 0.044 11 0 "[ . 1 . 2]"
1 140 ALA 1.935 0.270 9 0 "[ . 1 . 2]"
1 141 HIS 3.438 0.144 6 0 "[ . 1 . 2]"
1 142 SER 9.013 0.157 4 0 "[ . 1 . 2]"
1 143 ASP 1.292 0.061 10 0 "[ . 1 . 2]"
1 144 ILE 0.084 0.051 16 0 "[ . 1 . 2]"
1 145 CYS 1.504 0.117 20 0 "[ . 1 . 2]"
1 146 GLN 1.646 0.141 16 0 "[ . 1 . 2]"
1 147 VAL 3.027 0.100 20 0 "[ . 1 . 2]"
1 148 GLU 1.192 0.270 9 0 "[ . 1 . 2]"
1 149 ALA 3.070 0.124 20 0 "[ . 1 . 2]"
1 150 MET 2.782 0.129 13 0 "[ . 1 . 2]"
1 151 LYS 5.883 0.263 18 0 "[ . 1 . 2]"
1 152 HIS 4.439 0.263 18 0 "[ . 1 . 2]"
1 153 LYS 2.437 0.140 18 0 "[ . 1 . 2]"
1 154 THR 0.320 0.238 4 0 "[ . 1 . 2]"
1 155 LYS 0.961 0.238 4 0 "[ . 1 . 2]"
1 156 PRO 1.765 0.135 2 0 "[ . 1 . 2]"
1 157 ILE 3.370 0.140 18 0 "[ . 1 . 2]"
1 158 TYR 3.468 0.171 11 0 "[ . 1 . 2]"
1 159 GLY 1.454 0.094 14 0 "[ . 1 . 2]"
1 160 VAL 2.932 0.088 20 0 "[ . 1 . 2]"
1 161 GLN 0.763 0.079 16 0 "[ . 1 . 2]"
1 162 PHE 1.631 0.140 11 0 "[ . 1 . 2]"
1 164 PRO 0.335 0.086 14 0 "[ . 1 . 2]"
1 165 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 166 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 169 THR 0.960 0.141 20 0 "[ . 1 . 2]"
1 172 GLY 2.873 0.141 20 0 "[ . 1 . 2]"
1 173 ASN 1.937 0.221 13 0 "[ . 1 . 2]"
1 174 GLU 0.410 0.144 6 0 "[ . 1 . 2]"
1 175 ILE 2.977 0.117 7 0 "[ . 1 . 2]"
1 176 LEU 0.956 0.086 13 0 "[ . 1 . 2]"
1 177 LYS 3.782 0.149 7 0 "[ . 1 . 2]"
1 178 ASN 9.219 0.149 7 0 "[ . 1 . 2]"
1 179 PHE 3.173 0.112 12 0 "[ . 1 . 2]"
1 180 CYS 0.311 0.040 17 0 "[ . 1 . 2]"
1 181 LYS 4.512 0.218 7 0 "[ . 1 . 2]"
1 182 VAL 1.804 0.049 20 0 "[ . 1 . 2]"
1 183 CYS 4.391 0.109 5 0 "[ . 1 . 2]"
1 184 GLY 0.064 0.023 20 0 "[ . 1 . 2]"
1 185 TYR 4.607 0.131 4 0 "[ . 1 . 2]"
1 186 LYS 5.912 0.168 20 0 "[ . 1 . 2]"
1 187 PHE 1.735 0.076 20 0 "[ . 1 . 2]"
1 188 GLU 0.525 0.025 4 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ILE H 1 2 ILE HB . . 4.000 2.442 2.381 2.486 . 0 0 "[ . 1 . 2]" 1
2 1 2 ILE H 1 2 ILE HG12 . . 3.900 3.679 3.599 3.892 . 0 0 "[ . 1 . 2]" 1
3 1 2 ILE H 1 2 ILE MD . . 4.200 3.861 3.760 3.904 . 0 0 "[ . 1 . 2]" 1
4 1 2 ILE HG12 1 3 VAL H . . 4.350 4.083 4.005 4.148 . 0 0 "[ . 1 . 2]" 1
5 1 2 ILE HG12 1 3 VAL MG2 . . 5.550 5.237 4.927 5.295 . 0 0 "[ . 1 . 2]" 1
6 1 2 ILE MD 1 4 ILE HG13 . . 5.500 5.293 5.235 5.364 . 0 0 "[ . 1 . 2]" 1
7 1 2 ILE MD 1 24 VAL MG1 . . 3.500 2.071 1.909 2.230 . 0 0 "[ . 1 . 2]" 1
8 1 2 ILE H 1 26 SER HA . . 3.000 2.980 2.920 3.017 0.017 7 0 "[ . 1 . 2]" 1
9 1 2 ILE H 1 26 SER HB2 . . 3.800 3.829 3.799 3.852 0.052 12 0 "[ . 1 . 2]" 1
10 1 2 ILE HB 1 26 SER HA . . 4.830 3.312 3.152 3.492 . 0 0 "[ . 1 . 2]" 1
11 1 2 ILE MD 1 26 SER HA . . 5.830 5.126 4.976 5.300 . 0 0 "[ . 1 . 2]" 1
12 1 2 ILE MD 1 26 SER HB2 . . 5.660 4.091 3.489 4.319 . 0 0 "[ . 1 . 2]" 1
13 1 2 ILE H 1 45 LYS H . . 5.000 4.975 4.788 5.082 0.082 16 0 "[ . 1 . 2]" 1
14 1 2 ILE MD 1 46 GLY H . . 5.510 4.061 3.968 4.115 . 0 0 "[ . 1 . 2]" 1
15 1 2 ILE MD 1 46 GLY HA2 . . 4.800 4.893 4.877 4.911 0.111 9 0 "[ . 1 . 2]" 1
16 1 2 ILE MD 1 46 GLY HA3 . . 4.800 3.400 3.378 3.433 . 0 0 "[ . 1 . 2]" 1
17 1 2 ILE MD 1 47 ILE H . . 5.660 4.963 4.752 5.043 . 0 0 "[ . 1 . 2]" 1
18 1 2 ILE QG 1 47 ILE HA . . 5.100 4.886 4.647 5.056 . 0 0 "[ . 1 . 2]" 1
19 1 2 ILE MD 1 179 PHE QD . . 3.760 3.840 3.815 3.872 0.112 12 0 "[ . 1 . 2]" 1
20 1 2 ILE MD 1 179 PHE QE . . 3.810 3.319 3.255 3.366 . 0 0 "[ . 1 . 2]" 1
21 1 2 ILE MD 1 183 CYS HB2 . . 3.820 3.313 3.239 3.346 . 0 0 "[ . 1 . 2]" 1
22 1 2 ILE MD 1 183 CYS HB3 . . 4.730 4.199 4.161 4.219 . 0 0 "[ . 1 . 2]" 1
23 1 2 ILE MD 1 185 TYR H . . 5.000 4.593 4.507 4.705 . 0 0 "[ . 1 . 2]" 1
24 1 2 ILE MD 1 185 TYR QE . . 5.750 5.837 5.803 5.872 0.122 6 0 "[ . 1 . 2]" 1
25 1 2 ILE H 1 186 LYS HB2 . . 5.700 5.809 5.793 5.826 0.126 6 0 "[ . 1 . 2]" 1
26 1 3 VAL H 1 3 VAL HB . . 4.000 2.912 2.754 3.633 . 0 0 "[ . 1 . 2]" 1
27 1 3 VAL H 1 3 VAL MG2 . . 3.800 2.260 1.958 2.428 . 0 0 "[ . 1 . 2]" 1
28 1 3 VAL MG1 1 3 VAL MG2 . . 3.020 2.067 2.050 2.090 . 0 0 "[ . 1 . 2]" 1
29 1 3 VAL HA 1 4 ILE H . . 2.200 2.171 2.155 2.184 . 0 0 "[ . 1 . 2]" 1
30 1 3 VAL MG2 1 4 ILE H . . 4.200 4.190 4.133 4.344 0.144 9 0 "[ . 1 . 2]" 1
31 1 3 VAL HA 1 26 SER HA . . 4.300 4.230 4.182 4.284 . 0 0 "[ . 1 . 2]" 1
32 1 3 VAL HA 1 27 LYS H . . 3.000 2.809 2.601 2.945 . 0 0 "[ . 1 . 2]" 1
33 1 3 VAL MG2 1 27 LYS H . . 5.000 4.348 4.053 5.128 0.128 13 0 "[ . 1 . 2]" 1
34 1 3 VAL HA 1 28 ILE HA . . 4.800 4.758 4.556 4.894 0.094 19 0 "[ . 1 . 2]" 1
35 1 3 VAL H 1 44 VAL HB . . 4.000 3.714 3.291 4.068 0.068 16 0 "[ . 1 . 2]" 1
36 1 3 VAL H 1 46 GLY H . . 4.000 4.077 4.025 4.120 0.120 3 0 "[ . 1 . 2]" 1
37 1 3 VAL MG2 1 46 GLY H . . 5.000 4.574 4.208 4.719 . 0 0 "[ . 1 . 2]" 1
38 1 3 VAL H 1 47 ILE HA . . 3.000 2.789 2.670 2.891 . 0 0 "[ . 1 . 2]" 1
39 1 3 VAL HA 1 47 ILE HG12 . . 5.500 5.343 5.155 5.505 0.005 13 0 "[ . 1 . 2]" 1
40 1 3 VAL HA 1 47 ILE QG . . 5.500 5.078 4.929 5.337 . 0 0 "[ . 1 . 2]" 1
41 1 3 VAL HB 1 47 ILE MD . . 4.150 4.066 3.867 4.241 0.091 5 0 "[ . 1 . 2]" 1
42 1 3 VAL MG2 1 47 ILE HG12 . . 4.600 3.172 1.919 3.535 . 0 0 "[ . 1 . 2]" 1
43 1 3 VAL H 1 48 ILE H . . 4.300 4.284 4.136 4.373 0.073 16 0 "[ . 1 . 2]" 1
44 1 3 VAL MG2 1 48 ILE H . . 5.380 5.244 3.959 5.469 0.089 7 0 "[ . 1 . 2]" 1
45 1 4 ILE H 1 4 ILE HB . . 4.000 2.586 2.516 2.649 . 0 0 "[ . 1 . 2]" 1
46 1 4 ILE HA 1 5 LEU MD2 . . 5.340 3.387 3.369 3.407 . 0 0 "[ . 1 . 2]" 1
47 1 4 ILE HB 1 5 LEU H . . 4.500 4.426 4.290 4.489 . 0 0 "[ . 1 . 2]" 1
48 1 4 ILE HB 1 5 LEU MD2 . . 5.500 5.576 5.488 5.603 0.103 20 0 "[ . 1 . 2]" 1
49 1 4 ILE HB 1 12 VAL MG1 . . 4.670 3.446 3.347 3.571 . 0 0 "[ . 1 . 2]" 1
50 1 4 ILE HA 1 15 ILE MG . . 5.500 4.251 4.033 4.811 . 0 0 "[ . 1 . 2]" 1
51 1 4 ILE HB 1 15 ILE HB . . 4.500 4.324 4.181 4.551 0.051 12 0 "[ . 1 . 2]" 1
52 1 4 ILE HG13 1 15 ILE QG . . 5.500 5.579 5.532 5.668 0.168 12 0 "[ . 1 . 2]" 1
53 1 4 ILE H 1 26 SER HA . . 5.350 5.414 5.382 5.452 0.102 9 0 "[ . 1 . 2]" 1
54 1 4 ILE H 1 27 LYS H . . 4.000 3.555 3.450 3.675 . 0 0 "[ . 1 . 2]" 1
55 1 4 ILE H 1 28 ILE HA . . 3.000 2.873 2.645 2.989 . 0 0 "[ . 1 . 2]" 1
56 1 4 ILE HA 1 29 VAL MG1 . . 5.700 5.725 5.700 5.747 0.047 13 0 "[ . 1 . 2]" 1
57 1 4 ILE HB 1 29 VAL H . . 4.000 3.881 3.788 4.017 0.017 5 0 "[ . 1 . 2]" 1
58 1 4 ILE HB 1 29 VAL MG2 . . 4.870 4.732 4.594 4.900 0.030 18 0 "[ . 1 . 2]" 1
59 1 4 ILE HA 1 47 ILE HA . . 4.800 4.161 4.037 4.242 . 0 0 "[ . 1 . 2]" 1
60 1 4 ILE HA 1 47 ILE MG . . 5.000 3.327 3.136 3.427 . 0 0 "[ . 1 . 2]" 1
61 1 4 ILE HA 1 48 ILE MG . . 4.400 4.026 3.848 4.383 . 0 0 "[ . 1 . 2]" 1
62 1 4 ILE HB 1 48 ILE HB . . 4.600 4.247 4.077 4.398 . 0 0 "[ . 1 . 2]" 1
63 1 4 ILE HB 1 48 ILE MG . . 5.850 5.082 4.875 5.333 . 0 0 "[ . 1 . 2]" 1
64 1 4 ILE HG13 1 48 ILE HA . . 5.000 4.688 4.554 4.898 . 0 0 "[ . 1 . 2]" 1
65 1 4 ILE HG13 1 48 ILE MG . . 4.580 3.519 3.457 3.671 . 0 0 "[ . 1 . 2]" 1
66 1 4 ILE HA 1 49 LEU HA . . 4.800 4.837 4.595 4.891 0.091 14 0 "[ . 1 . 2]" 1
67 1 5 LEU H 1 5 LEU MD2 . . 4.000 1.853 1.838 1.896 . 0 0 "[ . 1 . 2]" 1
68 1 5 LEU HA 1 6 ASP H . . 2.200 2.171 2.162 2.182 . 0 0 "[ . 1 . 2]" 1
69 1 5 LEU HG 1 6 ASP HA . . 4.160 3.921 3.772 4.087 . 0 0 "[ . 1 . 2]" 1
70 1 5 LEU MD2 1 6 ASP H . . 4.500 4.530 4.444 4.594 0.094 18 0 "[ . 1 . 2]" 1
71 1 5 LEU HB2 1 7 ASN HD21 . . 6.000 5.890 5.286 6.065 0.065 20 0 "[ . 1 . 2]" 1
72 1 5 LEU HA 1 28 ILE HA . . 4.800 4.401 4.303 4.475 . 0 0 "[ . 1 . 2]" 1
73 1 5 LEU HA 1 29 VAL H . . 3.000 2.741 2.665 2.813 . 0 0 "[ . 1 . 2]" 1
74 1 5 LEU HA 1 29 VAL MG2 . . 5.000 1.962 1.884 2.116 . 0 0 "[ . 1 . 2]" 1
75 1 5 LEU HB3 1 29 VAL MG2 . . 5.000 2.618 2.455 2.741 . 0 0 "[ . 1 . 2]" 1
76 1 5 LEU MD1 1 31 ASN HA . . 6.000 4.884 4.481 5.251 . 0 0 "[ . 1 . 2]" 1
77 1 5 LEU H 1 49 LEU HA . . 3.750 3.708 3.517 3.795 0.045 18 0 "[ . 1 . 2]" 1
78 1 6 ASP H 1 6 ASP HA . . 3.000 2.936 2.912 2.947 . 0 0 "[ . 1 . 2]" 1
79 1 6 ASP H 1 6 ASP HB3 . . 4.170 2.527 2.281 2.701 . 0 0 "[ . 1 . 2]" 1
80 1 6 ASP H 1 29 VAL H . . 4.000 3.814 3.699 3.894 . 0 0 "[ . 1 . 2]" 1
81 1 6 ASP H 1 29 VAL HB . . 5.340 5.386 5.326 5.432 0.092 13 0 "[ . 1 . 2]" 1
82 1 6 ASP HB3 1 29 VAL MG2 . . 5.000 5.061 5.011 5.096 0.096 20 0 "[ . 1 . 2]" 1
83 1 6 ASP HA 1 49 LEU HA . . 5.800 4.250 3.873 4.822 . 0 0 "[ . 1 . 2]" 1
84 1 7 ASN H 1 7 ASN HA . . 3.000 2.946 2.934 2.948 . 0 0 "[ . 1 . 2]" 1
85 1 7 ASN H 1 12 VAL MG2 . . 5.000 4.332 3.951 4.666 . 0 0 "[ . 1 . 2]" 1
86 1 7 ASN HD21 1 31 ASN HB2 . . 4.060 3.845 3.337 4.084 0.024 18 0 "[ . 1 . 2]" 1
87 1 7 ASN HD22 1 31 ASN HB3 . . 4.650 4.706 4.672 4.731 0.081 18 0 "[ . 1 . 2]" 1
88 1 7 ASN HD22 1 60 ASN HB2 . . 5.000 3.781 3.087 4.744 . 0 0 "[ . 1 . 2]" 1
89 1 7 ASN HD21 1 61 CYS HB2 . . 5.750 5.587 4.293 5.824 0.074 16 0 "[ . 1 . 2]" 1
90 1 7 ASN HD21 1 61 CYS HB3 . . 5.320 4.560 4.217 5.404 0.084 15 0 "[ . 1 . 2]" 1
91 1 8 GLY H 1 9 GLY H . . 4.000 2.441 2.097 2.481 . 0 0 "[ . 1 . 2]" 1
92 1 8 GLY HA2 1 9 GLY H . . 4.300 3.462 3.326 3.476 . 0 0 "[ . 1 . 2]" 1
93 1 8 GLY H 1 12 VAL MG2 . . 4.500 4.574 4.528 4.628 0.128 8 0 "[ . 1 . 2]" 1
94 1 8 GLY HA3 1 52 GLY H . . 6.000 6.060 6.008 6.124 0.124 20 0 "[ . 1 . 2]" 1
95 1 8 GLY HA3 1 52 GLY HA2 . . 4.110 3.465 3.237 3.751 . 0 0 "[ . 1 . 2]" 1
96 1 8 GLY HA3 1 52 GLY HA3 . . 4.040 3.597 3.295 4.045 0.005 12 0 "[ . 1 . 2]" 1
97 1 8 GLY H 1 58 ALA MB . . 6.000 5.613 4.915 6.013 0.013 12 0 "[ . 1 . 2]" 1
98 1 9 GLY HA2 1 53 PRO HD2 . . 4.540 4.305 3.814 4.566 0.026 12 0 "[ . 1 . 2]" 1
99 1 9 GLY HA3 1 53 PRO HD3 . . 4.500 4.556 4.517 4.593 0.093 20 0 "[ . 1 . 2]" 1
100 1 12 VAL H 1 12 VAL HA . . 3.000 2.906 2.859 2.913 . 0 0 "[ . 1 . 2]" 1
101 1 12 VAL HB 1 14 ARG H . . 5.000 4.994 4.914 5.043 0.043 3 0 "[ . 1 . 2]" 1
102 1 12 VAL H 1 15 ILE HG13 . . 4.970 4.743 4.516 4.958 . 0 0 "[ . 1 . 2]" 1
103 1 12 VAL HA 1 15 ILE HG12 . . 4.670 3.585 3.492 3.737 . 0 0 "[ . 1 . 2]" 1
104 1 12 VAL HA 1 15 ILE HG13 . . 4.250 2.063 1.985 2.251 . 0 0 "[ . 1 . 2]" 1
105 1 12 VAL HA 1 15 ILE MD . . 5.130 2.287 1.967 2.442 . 0 0 "[ . 1 . 2]" 1
106 1 12 VAL HA 1 15 ILE MG . . 5.510 4.535 4.352 4.754 . 0 0 "[ . 1 . 2]" 1
107 1 12 VAL HB 1 15 ILE HB . . 5.000 4.995 4.822 5.070 0.070 12 0 "[ . 1 . 2]" 1
108 1 12 VAL HB 1 15 ILE HG13 . . 4.450 4.563 4.532 4.635 0.185 15 0 "[ . 1 . 2]" 1
109 1 12 VAL HB 1 15 ILE MD . . 4.770 4.140 3.966 4.300 . 0 0 "[ . 1 . 2]" 1
110 1 12 VAL MG1 1 15 ILE HG13 . . 4.950 2.908 2.505 3.208 . 0 0 "[ . 1 . 2]" 1
111 1 12 VAL HB 1 16 HIS H . . 6.000 5.311 5.178 5.445 . 0 0 "[ . 1 . 2]" 1
112 1 12 VAL HA 1 28 ILE HG12 . . 5.500 5.353 4.927 5.508 0.008 3 0 "[ . 1 . 2]" 1
113 1 12 VAL MG1 1 48 ILE MG . . 5.650 4.051 3.724 4.256 . 0 0 "[ . 1 . 2]" 1
114 1 12 VAL HB 1 50 SER HB2 . . 4.820 4.453 4.124 4.845 0.025 15 0 "[ . 1 . 2]" 1
115 1 12 VAL MG2 1 50 SER HB2 . . 2.980 2.268 1.951 2.820 . 0 0 "[ . 1 . 2]" 1
116 1 12 VAL MG2 1 50 SER HB3 . . 3.960 2.459 2.217 2.792 . 0 0 "[ . 1 . 2]" 1
117 1 13 HIS HA 1 15 ILE MD . . 6.000 5.748 5.548 5.920 . 0 0 "[ . 1 . 2]" 1
118 1 14 ARG H 1 14 ARG HD2 . . 4.000 2.941 1.945 4.006 0.006 7 0 "[ . 1 . 2]" 1
119 1 14 ARG H 1 14 ARG HE . . 4.700 3.999 2.380 4.719 0.019 12 0 "[ . 1 . 2]" 1
120 1 15 ILE H 1 15 ILE HB . . 3.000 2.716 2.689 2.745 . 0 0 "[ . 1 . 2]" 1
121 1 15 ILE H 1 15 ILE HG13 . . 5.000 1.927 1.907 1.943 . 0 0 "[ . 1 . 2]" 1
122 1 15 ILE HA 1 15 ILE HG13 . . 3.600 3.308 3.254 3.368 . 0 0 "[ . 1 . 2]" 1
123 1 15 ILE HB 1 16 HIS H . . 4.500 2.338 1.975 2.568 . 0 0 "[ . 1 . 2]" 1
124 1 15 ILE QG 1 16 HIS H . . 4.500 3.609 3.544 3.715 . 0 0 "[ . 1 . 2]" 1
125 1 15 ILE HA 1 18 SER HB2 . . 4.000 3.339 2.313 4.005 0.005 19 0 "[ . 1 . 2]" 1
126 1 15 ILE HA 1 19 LEU MD1 . . 4.500 3.584 2.883 4.530 0.030 3 0 "[ . 1 . 2]" 1
127 1 15 ILE HG12 1 48 ILE QG . . 5.200 5.250 5.148 5.303 0.103 7 0 "[ . 1 . 2]" 1
128 1 15 ILE HA 1 165 GLU HA . . 5.000 4.404 3.601 4.933 . 0 0 "[ . 1 . 2]" 1
129 1 15 ILE MD 1 176 LEU MD2 . . 5.700 4.301 3.903 4.630 . 0 0 "[ . 1 . 2]" 1
130 1 16 HIS H 1 17 ARG H . . 2.800 2.576 2.403 2.828 0.028 15 0 "[ . 1 . 2]" 1
131 1 16 HIS HB2 1 17 ARG H . . 3.900 3.908 3.836 3.944 0.044 19 0 "[ . 1 . 2]" 1
132 1 17 ARG H 1 18 SER H . . 2.800 2.749 2.523 2.848 0.048 11 0 "[ . 1 . 2]" 1
133 1 17 ARG HD2 1 18 SER H . . 4.300 3.408 2.583 4.371 0.071 2 0 "[ . 1 . 2]" 1
134 1 18 SER H 1 18 SER HB2 . . 3.500 2.347 2.153 2.612 . 0 0 "[ . 1 . 2]" 1
135 1 18 SER H 1 18 SER HA . . 3.000 2.815 2.787 2.884 . 0 0 "[ . 1 . 2]" 1
136 1 18 SER H 1 19 LEU H . . 2.800 2.773 2.456 2.825 0.025 14 0 "[ . 1 . 2]" 1
137 1 18 SER HA 1 19 LEU H . . 3.500 3.562 3.545 3.570 0.070 15 0 "[ . 1 . 2]" 1
138 1 18 SER HA 1 20 LYS H . . 4.400 4.339 4.211 4.429 0.029 7 0 "[ . 1 . 2]" 1
139 1 18 SER HA 1 20 LYS HE3 . . 5.400 5.504 5.470 5.684 0.284 7 0 "[ . 1 . 2]" 1
140 1 19 LEU H 1 19 LEU HA . . 3.000 2.738 2.724 2.745 . 0 0 "[ . 1 . 2]" 1
141 1 19 LEU H 1 19 LEU HB2 . . 4.000 2.242 2.109 2.681 . 0 0 "[ . 1 . 2]" 1
142 1 19 LEU H 1 19 LEU HB3 . . 4.000 3.499 3.424 3.588 . 0 0 "[ . 1 . 2]" 1
143 1 19 LEU H 1 19 LEU MD2 . . 4.040 3.644 2.648 4.130 0.090 10 0 "[ . 1 . 2]" 1
144 1 19 LEU HB2 1 20 LYS H . . 4.000 2.791 2.541 2.927 . 0 0 "[ . 1 . 2]" 1
145 1 19 LEU HB3 1 20 LYS HA . . 4.500 4.027 3.866 4.514 0.014 14 0 "[ . 1 . 2]" 1
146 1 19 LEU MD2 1 20 LYS H . . 4.510 4.546 4.469 4.580 0.070 11 0 "[ . 1 . 2]" 1
147 1 19 LEU H 1 22 ILE HG13 . . 5.000 5.084 5.057 5.166 0.166 14 0 "[ . 1 . 2]" 1
148 1 19 LEU H 1 22 ILE MD . . 4.500 3.550 3.269 4.181 . 0 0 "[ . 1 . 2]" 1
149 1 19 LEU HA 1 22 ILE MD . . 5.200 2.095 1.945 2.616 . 0 0 "[ . 1 . 2]" 1
150 1 19 LEU H 1 176 LEU MD1 . . 4.400 4.024 3.894 4.156 . 0 0 "[ . 1 . 2]" 1
151 1 19 LEU HB2 1 176 LEU MD1 . . 5.800 4.873 4.538 5.428 . 0 0 "[ . 1 . 2]" 1
152 1 20 LYS H 1 20 LYS HA . . 3.000 2.806 2.789 2.865 . 0 0 "[ . 1 . 2]" 1
153 1 20 LYS H 1 20 LYS HB3 . . 3.320 2.351 2.254 2.864 . 0 0 "[ . 1 . 2]" 1
154 1 20 LYS H 1 20 LYS QZ . . 5.300 5.384 5.246 5.412 0.112 20 0 "[ . 1 . 2]" 1
155 1 20 LYS HA 1 20 LYS HB2 . . 2.500 2.365 2.322 2.577 0.077 7 0 "[ . 1 . 2]" 1
156 1 20 LYS HB3 1 20 LYS HE3 . . 3.000 2.718 2.588 3.512 0.512 7 2 "[ . + - . 2]" 1
157 1 20 LYS H 1 20 LYS HE2 . . 4.400 4.099 4.028 4.426 0.026 7 0 "[ . 1 . 2]" 1
158 1 20 LYS HA 1 20 LYS HE2 . . 4.800 4.868 4.831 5.002 0.202 7 0 "[ . 1 . 2]" 1
159 1 20 LYS HA 1 20 LYS HE3 . . 5.060 4.788 3.742 5.062 0.002 9 0 "[ . 1 . 2]" 1
160 1 20 LYS H 1 20 LYS HG3 . . 4.500 4.316 1.885 4.641 0.141 19 0 "[ . 1 . 2]" 1
161 1 20 LYS H 1 21 TYR H . . 2.800 2.755 2.498 2.830 0.030 4 0 "[ . 1 . 2]" 1
162 1 20 LYS HA 1 21 TYR H . . 3.500 3.554 3.525 3.565 0.065 5 0 "[ . 1 . 2]" 1
163 1 20 LYS HB3 1 21 TYR H . . 4.000 2.704 2.492 4.039 0.039 7 0 "[ . 1 . 2]" 1
164 1 20 LYS HE3 1 21 TYR HA . . 4.020 3.652 2.318 4.054 0.034 3 0 "[ . 1 . 2]" 1
165 1 20 LYS HA 1 22 ILE H . . 4.000 3.963 3.783 4.085 0.085 14 0 "[ . 1 . 2]" 1
166 1 20 LYS HA 1 22 ILE MD . . 5.750 5.737 5.609 5.823 0.073 14 0 "[ . 1 . 2]" 1
167 1 20 LYS HG3 1 23 GLY H . . 5.300 5.255 5.071 5.454 0.154 19 0 "[ . 1 . 2]" 1
168 1 21 TYR H 1 21 TYR HA . . 3.000 2.800 2.763 2.815 . 0 0 "[ . 1 . 2]" 1
169 1 21 TYR H 1 21 TYR HB3 . . 3.200 2.525 2.499 2.615 . 0 0 "[ . 1 . 2]" 1
170 1 21 TYR HA 1 21 TYR QD . . 3.750 2.567 2.020 2.703 . 0 0 "[ . 1 . 2]" 1
171 1 21 TYR H 1 21 TYR QD . . 4.300 4.193 4.174 4.199 . 0 0 "[ . 1 . 2]" 1
172 1 21 TYR H 1 22 ILE H . . 2.800 2.651 2.609 2.782 . 0 0 "[ . 1 . 2]" 1
173 1 21 TYR HA 1 22 ILE H . . 3.500 3.457 3.439 3.521 0.021 19 0 "[ . 1 . 2]" 1
174 1 21 TYR HA 1 22 ILE HB . . 6.000 5.906 5.865 6.046 0.046 14 0 "[ . 1 . 2]" 1
175 1 21 TYR HB2 1 22 ILE MD . . 5.420 5.518 5.477 5.632 0.212 14 0 "[ . 1 . 2]" 1
176 1 21 TYR HB3 1 22 ILE H . . 4.000 2.992 2.707 3.065 . 0 0 "[ . 1 . 2]" 1
177 1 21 TYR HB3 1 22 ILE HG13 . . 3.500 3.073 2.871 3.158 . 0 0 "[ . 1 . 2]" 1
178 1 21 TYR HB3 1 22 ILE MD . . 4.950 4.100 4.060 4.198 . 0 0 "[ . 1 . 2]" 1
179 1 21 TYR QD 1 22 ILE MD . . 5.420 4.334 4.262 4.781 . 0 0 "[ . 1 . 2]" 1
180 1 21 TYR QE 1 22 ILE MD . . 5.870 5.890 5.874 5.952 0.082 14 0 "[ . 1 . 2]" 1
181 1 21 TYR HA 1 23 GLY H . . 4.000 3.999 3.928 4.034 0.034 10 0 "[ . 1 . 2]" 1
182 1 21 TYR HB3 1 23 GLY H . . 5.100 4.993 4.768 5.050 . 0 0 "[ . 1 . 2]" 1
183 1 21 TYR QD 1 23 GLY H . . 6.000 5.534 5.027 5.604 . 0 0 "[ . 1 . 2]" 1
184 1 22 ILE H 1 22 ILE HA . . 3.000 2.904 2.890 2.921 . 0 0 "[ . 1 . 2]" 1
185 1 22 ILE H 1 22 ILE HB . . 3.200 2.559 2.517 2.685 . 0 0 "[ . 1 . 2]" 1
186 1 22 ILE H 1 22 ILE MG . . 3.750 3.794 3.785 3.821 0.071 2 0 "[ . 1 . 2]" 1
187 1 22 ILE HA 1 22 ILE HG13 . . 3.000 2.768 2.679 3.002 0.002 14 0 "[ . 1 . 2]" 1
188 1 22 ILE HA 1 22 ILE MG . . 3.000 2.294 2.160 2.353 . 0 0 "[ . 1 . 2]" 1
189 1 22 ILE HB 1 22 ILE HG12 . . 3.000 2.987 2.976 3.011 0.011 2 0 "[ . 1 . 2]" 1
190 1 22 ILE HB 1 22 ILE MD . . 3.500 2.137 2.078 2.361 . 0 0 "[ . 1 . 2]" 1
191 1 22 ILE H 1 23 GLY H . . 3.750 2.304 2.226 2.395 . 0 0 "[ . 1 . 2]" 1
192 1 22 ILE HB 1 23 GLY H . . 4.210 3.175 3.131 3.355 . 0 0 "[ . 1 . 2]" 1
193 1 22 ILE HG12 1 23 GLY H . . 5.500 5.293 5.173 5.332 . 0 0 "[ . 1 . 2]" 1
194 1 22 ILE HG13 1 23 GLY H . . 5.500 4.311 4.123 4.373 . 0 0 "[ . 1 . 2]" 1
195 1 22 ILE MG 1 23 GLY H . . 4.580 3.905 3.823 4.098 . 0 0 "[ . 1 . 2]" 1
196 1 22 ILE H 1 24 VAL H . . 3.800 3.789 3.356 3.848 0.048 6 0 "[ . 1 . 2]" 1
197 1 22 ILE MD 1 177 LYS H . . 4.000 4.056 4.019 4.086 0.086 2 0 "[ . 1 . 2]" 1
198 1 22 ILE MD 1 178 ASN H . . 5.780 5.015 4.779 5.111 . 0 0 "[ . 1 . 2]" 1
199 1 22 ILE MD 1 180 CYS H . . 5.750 4.832 4.735 4.929 . 0 0 "[ . 1 . 2]" 1
200 1 22 ILE MD 1 181 LYS H . . 5.000 4.979 4.651 5.066 0.066 20 0 "[ . 1 . 2]" 1
201 1 23 GLY H 1 24 VAL H . . 3.530 2.332 2.144 2.421 . 0 0 "[ . 1 . 2]" 1
202 1 23 GLY HA3 1 24 VAL H . . 3.810 3.510 3.226 3.545 . 0 0 "[ . 1 . 2]" 1
203 1 24 VAL H 1 24 VAL HB . . 4.250 2.671 2.582 2.741 . 0 0 "[ . 1 . 2]" 1
204 1 24 VAL H 1 24 VAL MG2 . . 4.070 2.764 2.152 2.935 . 0 0 "[ . 1 . 2]" 1
205 1 24 VAL HA 1 25 SER HA . . 4.400 4.390 4.363 4.426 0.026 16 0 "[ . 1 . 2]" 1
206 1 24 VAL HB 1 25 SER H . . 4.480 4.251 3.887 4.380 . 0 0 "[ . 1 . 2]" 1
207 1 24 VAL MG2 1 25 SER H . . 5.520 4.098 4.015 4.178 . 0 0 "[ . 1 . 2]" 1
208 1 24 VAL MG1 1 179 PHE QD . . 5.820 5.771 5.636 5.843 0.023 10 0 "[ . 1 . 2]" 1
209 1 24 VAL H 1 181 LYS QZ . . 6.000 5.806 4.868 6.116 0.116 7 0 "[ . 1 . 2]" 1
210 1 24 VAL MG2 1 185 TYR H . . 6.000 4.690 4.328 5.380 . 0 0 "[ . 1 . 2]" 1
211 1 25 SER H 1 25 SER HA . . 3.000 2.839 2.782 2.913 . 0 0 "[ . 1 . 2]" 1
212 1 25 SER H 1 25 SER HB3 . . 4.000 3.340 2.568 3.659 . 0 0 "[ . 1 . 2]" 1
213 1 25 SER HA 1 26 SER H . . 3.350 2.165 2.142 2.189 . 0 0 "[ . 1 . 2]" 1
214 1 26 SER H 1 26 SER HA . . 3.000 2.863 2.847 2.886 . 0 0 "[ . 1 . 2]" 1
215 1 26 SER HA 1 27 LYS H . . 2.200 2.307 2.256 2.361 0.161 5 0 "[ . 1 . 2]" 1
216 1 27 LYS H 1 27 LYS HA . . 3.000 2.940 2.933 2.946 . 0 0 "[ . 1 . 2]" 1
217 1 27 LYS H 1 27 LYS HD3 . . 6.000 5.344 4.580 6.037 0.037 10 0 "[ . 1 . 2]" 1
218 1 27 LYS H 1 27 LYS HE2 . . 5.000 4.976 4.356 5.052 0.052 12 0 "[ . 1 . 2]" 1
219 1 27 LYS H 1 27 LYS HB2 . . 3.200 2.718 2.547 2.980 . 0 0 "[ . 1 . 2]" 1
220 1 27 LYS H 1 28 ILE H . . 4.300 4.351 4.250 4.453 0.153 18 0 "[ . 1 . 2]" 1
221 1 27 LYS HA 1 28 ILE H . . 2.200 2.204 2.150 2.310 0.110 18 0 "[ . 1 . 2]" 1
222 1 27 LYS HA 1 28 ILE HB . . 4.750 4.626 4.597 4.691 . 0 0 "[ . 1 . 2]" 1
223 1 27 LYS HA 1 28 ILE HG13 . . 4.000 3.684 3.475 3.798 . 0 0 "[ . 1 . 2]" 1
224 1 27 LYS HE2 1 28 ILE H . . 2.500 2.293 1.931 2.760 0.260 18 0 "[ . 1 . 2]" 1
225 1 27 LYS HB3 1 29 VAL MG1 . . 4.500 3.417 3.285 3.763 . 0 0 "[ . 1 . 2]" 1
226 1 27 LYS HD2 1 29 VAL H . . 6.000 6.138 6.086 6.181 0.181 12 0 "[ . 1 . 2]" 1
227 1 27 LYS HE2 1 29 VAL MG1 . . 6.000 3.867 2.362 5.253 . 0 0 "[ . 1 . 2]" 1
228 1 28 ILE H 1 28 ILE HG13 . . 4.000 2.462 2.271 2.631 . 0 0 "[ . 1 . 2]" 1
229 1 28 ILE H 1 28 ILE MD . . 4.000 3.675 3.336 3.885 . 0 0 "[ . 1 . 2]" 1
230 1 28 ILE HA 1 29 VAL H . . 2.200 2.213 2.189 2.225 0.025 4 0 "[ . 1 . 2]" 1
231 1 28 ILE HA 1 29 VAL MG1 . . 4.730 3.623 3.459 3.691 . 0 0 "[ . 1 . 2]" 1
232 1 28 ILE HA 1 29 VAL MG2 . . 5.000 3.675 3.625 3.733 . 0 0 "[ . 1 . 2]" 1
233 1 28 ILE MG 1 29 VAL H . . 3.500 2.217 1.992 2.338 . 0 0 "[ . 1 . 2]" 1
234 1 28 ILE MG 1 29 VAL HB . . 5.000 5.046 5.021 5.078 0.078 2 0 "[ . 1 . 2]" 1
235 1 29 VAL H 1 29 VAL HB . . 4.360 3.847 3.814 3.884 . 0 0 "[ . 1 . 2]" 1
236 1 29 VAL HA 1 30 PRO HG3 . . 5.250 4.346 4.325 4.371 . 0 0 "[ . 1 . 2]" 1
237 1 29 VAL MG1 1 30 PRO HG3 . . 5.780 5.596 5.493 5.695 . 0 0 "[ . 1 . 2]" 1
238 1 30 PRO HA 1 31 ASN H . . 4.760 2.424 2.389 2.434 . 0 0 "[ . 1 . 2]" 1
239 1 30 PRO HA 1 31 ASN HA . . 4.300 4.342 4.338 4.350 0.050 12 0 "[ . 1 . 2]" 1
240 1 30 PRO HA 1 31 ASN HB3 . . 4.610 4.505 4.444 4.621 0.011 15 0 "[ . 1 . 2]" 1
241 1 30 PRO HB3 1 32 THR HG1 . . 3.700 3.559 3.423 3.682 . 0 0 "[ . 1 . 2]" 1
242 1 30 PRO HB3 1 32 THR MG . . 5.000 4.572 4.475 4.633 . 0 0 "[ . 1 . 2]" 1
243 1 30 PRO HG2 1 32 THR HB . . 5.340 5.373 5.356 5.414 0.074 12 0 "[ . 1 . 2]" 1
244 1 30 PRO HB2 1 33 THR HG1 . . 4.000 3.969 3.893 4.010 0.010 12 0 "[ . 1 . 2]" 1
245 1 31 ASN H 1 31 ASN HA . . 3.000 2.900 2.893 2.910 . 0 0 "[ . 1 . 2]" 1
246 1 31 ASN H 1 31 ASN HB3 . . 4.200 2.725 2.649 2.838 . 0 0 "[ . 1 . 2]" 1
247 1 31 ASN H 1 32 THR H . . 4.700 2.296 2.247 2.327 . 0 0 "[ . 1 . 2]" 1
248 1 31 ASN H 1 32 THR HG1 . . 4.000 3.715 3.633 3.826 . 0 0 "[ . 1 . 2]" 1
249 1 31 ASN H 1 32 THR MG . . 5.000 3.749 3.646 3.879 . 0 0 "[ . 1 . 2]" 1
250 1 31 ASN HA 1 32 THR HG1 . . 5.730 5.127 4.857 5.463 . 0 0 "[ . 1 . 2]" 1
251 1 31 ASN HA 1 32 THR MG . . 5.180 5.088 5.004 5.137 . 0 0 "[ . 1 . 2]" 1
252 1 31 ASN HB2 1 32 THR H . . 4.000 3.979 3.866 4.026 0.026 8 0 "[ . 1 . 2]" 1
253 1 31 ASN HB3 1 32 THR H . . 4.000 4.081 4.021 4.152 0.152 15 0 "[ . 1 . 2]" 1
254 1 31 ASN H 1 33 THR H . . 4.960 4.092 4.044 4.130 . 0 0 "[ . 1 . 2]" 1
255 1 31 ASN HB2 1 60 ASN HD21 . . 5.800 5.414 4.983 5.772 . 0 0 "[ . 1 . 2]" 1
256 1 32 THR H 1 32 THR HA . . 3.000 2.796 2.793 2.808 . 0 0 "[ . 1 . 2]" 1
257 1 32 THR H 1 32 THR HG1 . . 2.200 2.032 1.939 2.196 . 0 0 "[ . 1 . 2]" 1
258 1 32 THR H 1 32 THR MG . . 4.360 2.238 2.090 2.358 . 0 0 "[ . 1 . 2]" 1
259 1 32 THR H 1 33 THR H . . 3.740 2.670 2.641 2.680 . 0 0 "[ . 1 . 2]" 1
260 1 32 THR HA 1 33 THR HA . . 5.000 4.788 4.717 4.838 . 0 0 "[ . 1 . 2]" 1
261 1 32 THR MG 1 33 THR H . . 4.000 4.031 4.016 4.055 0.055 3 0 "[ . 1 . 2]" 1
262 1 33 THR H 1 33 THR HB . . 3.370 3.392 3.337 3.450 0.080 18 0 "[ . 1 . 2]" 1
263 1 33 THR H 1 33 THR HG1 . . 4.000 2.462 1.952 2.956 . 0 0 "[ . 1 . 2]" 1
264 1 33 THR H 1 33 THR HA . . 3.000 2.831 2.796 2.877 . 0 0 "[ . 1 . 2]" 1
265 1 33 THR HA 1 33 THR HB . . 3.000 2.780 2.735 2.829 . 0 0 "[ . 1 . 2]" 1
266 1 33 THR HA 1 33 THR MG . . 3.500 1.998 1.958 2.052 . 0 0 "[ . 1 . 2]" 1
267 1 33 THR HA 1 34 PRO HB2 . . 5.600 5.580 5.542 5.610 0.010 3 0 "[ . 1 . 2]" 1
268 1 33 THR HA 1 34 PRO HB3 . . 5.000 4.845 4.834 4.857 . 0 0 "[ . 1 . 2]" 1
269 1 33 THR MG 1 34 PRO HB3 . . 6.000 5.314 5.250 5.456 . 0 0 "[ . 1 . 2]" 1
270 1 34 PRO HA 1 35 LEU H . . 3.910 2.242 2.233 2.248 . 0 0 "[ . 1 . 2]" 1
271 1 34 PRO HA 1 35 LEU HA . . 4.400 4.323 4.320 4.329 . 0 0 "[ . 1 . 2]" 1
272 1 34 PRO HB2 1 35 LEU H . . 3.620 3.076 3.056 3.107 . 0 0 "[ . 1 . 2]" 1
273 1 34 PRO HB3 1 35 LEU H . . 3.750 3.710 3.698 3.729 . 0 0 "[ . 1 . 2]" 1
274 1 34 PRO HB2 1 36 GLU H . . 3.500 2.469 2.359 2.640 . 0 0 "[ . 1 . 2]" 1
275 1 35 LEU H 1 35 LEU HA . . 3.000 2.775 2.758 2.800 . 0 0 "[ . 1 . 2]" 1
276 1 35 LEU H 1 35 LEU HB2 . . 3.500 3.529 3.072 3.558 0.058 1 0 "[ . 1 . 2]" 1
277 1 35 LEU H 1 35 LEU HB3 . . 3.400 2.370 2.263 3.440 0.040 19 0 "[ . 1 . 2]" 1
278 1 35 LEU H 1 35 LEU MD2 . . 3.500 1.922 1.875 2.101 . 0 0 "[ . 1 . 2]" 1
279 1 35 LEU HA 1 36 GLU H . . 3.500 3.495 3.469 3.533 0.033 19 0 "[ . 1 . 2]" 1
280 1 35 LEU HB3 1 36 GLU H . . 4.000 3.881 3.840 4.034 0.034 19 0 "[ . 1 . 2]" 1
281 1 35 LEU HG 1 36 GLU H . . 3.200 2.626 2.499 3.371 0.171 19 0 "[ . 1 . 2]" 1
282 1 35 LEU MD2 1 36 GLU H . . 3.800 2.037 1.906 4.175 0.375 19 0 "[ . 1 . 2]" 1
283 1 35 LEU H 1 37 GLU H . . 4.200 4.229 4.167 4.275 0.075 13 0 "[ . 1 . 2]" 1
284 1 35 LEU HA 1 37 GLU HA . . 6.000 6.116 6.085 6.145 0.145 12 0 "[ . 1 . 2]" 1
285 1 35 LEU H 1 38 ILE H . . 5.500 5.554 5.478 5.685 0.185 16 0 "[ . 1 . 2]" 1
286 1 35 LEU MD2 1 38 ILE H . . 5.600 5.555 5.486 5.663 0.063 3 0 "[ . 1 . 2]" 1
287 1 35 LEU H 1 60 ASN HD21 . . 3.900 3.843 3.479 3.953 0.053 20 0 "[ . 1 . 2]" 1
288 1 35 LEU H 1 60 ASN HD22 . . 4.120 2.949 2.315 3.983 . 0 0 "[ . 1 . 2]" 1
289 1 36 GLU H 1 36 GLU HA . . 3.000 2.774 2.754 2.795 . 0 0 "[ . 1 . 2]" 1
290 1 36 GLU H 1 36 GLU HB2 . . 3.000 2.229 2.063 2.618 . 0 0 "[ . 1 . 2]" 1
291 1 36 GLU H 1 37 GLU H . . 2.800 2.715 2.668 2.761 . 0 0 "[ . 1 . 2]" 1
292 1 36 GLU HA 1 37 GLU HB3 . . 5.520 5.603 5.570 5.620 0.100 12 0 "[ . 1 . 2]" 1
293 1 36 GLU H 1 39 GLU H . . 4.500 4.663 4.625 4.719 0.219 16 0 "[ . 1 . 2]" 1
294 1 36 GLU H 1 40 SER H . . 6.000 5.961 5.895 6.008 0.008 19 0 "[ . 1 . 2]" 1
295 1 37 GLU H 1 37 GLU HA . . 3.000 2.813 2.778 2.834 . 0 0 "[ . 1 . 2]" 1
296 1 37 GLU HA 1 38 ILE H . . 3.500 3.535 3.521 3.556 0.056 20 0 "[ . 1 . 2]" 1
297 1 37 GLU HA 1 38 ILE HA . . 5.320 4.630 4.620 4.635 . 0 0 "[ . 1 . 2]" 1
298 1 37 GLU H 1 39 GLU H . . 3.740 3.728 3.549 3.781 0.041 5 0 "[ . 1 . 2]" 1
299 1 38 ILE H 1 38 ILE HA . . 3.000 2.913 2.911 2.915 . 0 0 "[ . 1 . 2]" 1
300 1 38 ILE H 1 38 ILE HB . . 4.000 2.958 2.650 3.668 . 0 0 "[ . 1 . 2]" 1
301 1 38 ILE H 1 38 ILE HG12 . . 4.000 3.450 2.401 3.867 . 0 0 "[ . 1 . 2]" 1
302 1 38 ILE H 1 38 ILE MD . . 4.000 1.972 1.866 3.632 . 0 0 "[ . 1 . 2]" 1
303 1 38 ILE HA 1 38 ILE MD . . 4.670 3.582 3.483 3.907 . 0 0 "[ . 1 . 2]" 1
304 1 38 ILE H 1 39 GLU H . . 2.800 2.240 2.228 2.272 . 0 0 "[ . 1 . 2]" 1
305 1 38 ILE HA 1 39 GLU H . . 3.500 3.437 3.390 3.468 . 0 0 "[ . 1 . 2]" 1
306 1 38 ILE HB 1 39 GLU H . . 4.000 3.357 2.960 4.082 0.082 20 0 "[ . 1 . 2]" 1
307 1 38 ILE HB 1 39 GLU HA . . 4.540 4.351 4.215 4.580 0.040 3 0 "[ . 1 . 2]" 1
308 1 38 ILE MD 1 39 GLU H . . 3.500 3.406 3.304 3.535 0.035 5 0 "[ . 1 . 2]" 1
309 1 38 ILE HA 1 40 SER H . . 4.400 3.812 3.735 3.872 . 0 0 "[ . 1 . 2]" 1
310 1 38 ILE MD 1 40 SER H . . 5.000 5.089 5.012 5.125 0.125 18 0 "[ . 1 . 2]" 1
311 1 38 ILE HA 1 41 ASN H . . 4.000 3.844 3.723 4.146 0.146 16 0 "[ . 1 . 2]" 1
312 1 38 ILE MD 1 60 ASN HD21 . . 5.500 4.702 3.419 5.364 . 0 0 "[ . 1 . 2]" 1
313 1 39 GLU H 1 39 GLU HA . . 3.000 2.898 2.882 2.910 . 0 0 "[ . 1 . 2]" 1
314 1 39 GLU H 1 39 GLU HB2 . . 2.900 2.274 2.182 2.450 . 0 0 "[ . 1 . 2]" 1
315 1 39 GLU H 1 39 GLU HB3 . . 3.520 2.974 2.774 3.143 . 0 0 "[ . 1 . 2]" 1
316 1 39 GLU H 1 40 SER H . . 2.800 2.339 2.289 2.408 . 0 0 "[ . 1 . 2]" 1
317 1 39 GLU HB3 1 40 SER H . . 4.000 3.378 3.281 3.457 . 0 0 "[ . 1 . 2]" 1
318 1 39 GLU HA 1 41 ASN H . . 4.000 3.619 3.579 3.671 . 0 0 "[ . 1 . 2]" 1
319 1 39 GLU HB3 1 41 ASN H . . 5.000 5.032 5.012 5.053 0.053 16 0 "[ . 1 . 2]" 1
320 1 39 GLU HA 1 42 LYS HA . . 4.900 4.890 4.656 4.983 0.083 16 0 "[ . 1 . 2]" 1
321 1 40 SER H 1 40 SER HA . . 3.000 2.875 2.798 2.888 . 0 0 "[ . 1 . 2]" 1
322 1 40 SER H 1 41 ASN H . . 3.370 2.434 2.387 2.656 . 0 0 "[ . 1 . 2]" 1
323 1 40 SER H 1 41 ASN HB3 . . 5.000 5.115 4.774 5.169 0.169 7 0 "[ . 1 . 2]" 1
324 1 40 SER HA 1 41 ASN HA . . 5.270 4.539 4.529 4.555 . 0 0 "[ . 1 . 2]" 1
325 1 41 ASN H 1 41 ASN HA . . 3.000 2.946 2.943 2.948 . 0 0 "[ . 1 . 2]" 1
326 1 41 ASN H 1 41 ASN HB2 . . 4.000 3.660 3.624 3.732 . 0 0 "[ . 1 . 2]" 1
327 1 41 ASN H 1 41 ASN HB3 . . 4.000 3.205 2.560 3.275 . 0 0 "[ . 1 . 2]" 1
328 1 41 ASN H 1 42 LYS H . . 4.740 3.635 3.334 4.345 . 0 0 "[ . 1 . 2]" 1
329 1 41 ASN HA 1 42 LYS H . . 5.810 2.381 2.147 2.535 . 0 0 "[ . 1 . 2]" 1
330 1 41 ASN HB2 1 42 LYS H . . 4.900 4.173 3.550 4.329 . 0 0 "[ . 1 . 2]" 1
331 1 41 ASN HB3 1 42 LYS H . . 4.880 4.563 4.475 4.640 . 0 0 "[ . 1 . 2]" 1
332 1 41 ASN H 1 43 GLU H . . 5.000 5.080 5.029 5.223 0.223 16 0 "[ . 1 . 2]" 1
333 1 41 ASN HB2 1 43 GLU H . . 4.500 3.483 3.261 3.825 . 0 0 "[ . 1 . 2]" 1
334 1 41 ASN H 1 44 VAL MG1 . . 6.000 4.367 4.235 4.668 . 0 0 "[ . 1 . 2]" 1
335 1 41 ASN HB2 1 44 VAL H . . 4.300 3.234 3.076 4.343 0.043 16 0 "[ . 1 . 2]" 1
336 1 41 ASN HB3 1 44 VAL H . . 4.750 4.852 4.787 4.982 0.232 16 0 "[ . 1 . 2]" 1
337 1 42 LYS H 1 42 LYS HA . . 3.000 2.876 2.847 2.932 . 0 0 "[ . 1 . 2]" 1
338 1 42 LYS H 1 42 LYS HB3 . . 4.000 2.638 2.350 3.589 . 0 0 "[ . 1 . 2]" 1
339 1 42 LYS H 1 42 LYS HD2 . . 3.700 2.842 1.907 3.735 0.035 5 0 "[ . 1 . 2]" 1
340 1 42 LYS H 1 43 GLU H . . 4.520 2.550 2.364 2.570 . 0 0 "[ . 1 . 2]" 1
341 1 42 LYS HA 1 43 GLU H . . 3.160 3.265 3.191 3.340 0.180 13 0 "[ . 1 . 2]" 1
342 1 42 LYS HA 1 43 GLU HB3 . . 6.000 5.848 5.378 6.165 0.165 4 0 "[ . 1 . 2]" 1
343 1 42 LYS HD2 1 43 GLU H . . 3.700 3.313 2.263 3.790 0.090 20 0 "[ . 1 . 2]" 1
344 1 42 LYS H 1 44 VAL H . . 4.760 4.362 4.312 4.416 . 0 0 "[ . 1 . 2]" 1
345 1 42 LYS HA 1 47 ILE MD . . 6.000 5.699 4.994 6.057 0.057 16 0 "[ . 1 . 2]" 1
346 1 43 GLU H 1 43 GLU HA . . 3.000 2.892 2.873 2.919 . 0 0 "[ . 1 . 2]" 1
347 1 43 GLU H 1 43 GLU HB3 . . 4.000 2.766 2.139 3.180 . 0 0 "[ . 1 . 2]" 1
348 1 43 GLU H 1 43 GLU HG2 . . 3.800 3.877 3.839 3.896 0.096 5 0 "[ . 1 . 2]" 1
349 1 43 GLU H 1 44 VAL H . . 3.240 2.337 2.202 2.420 . 0 0 "[ . 1 . 2]" 1
350 1 43 GLU H 1 44 VAL HB . . 6.000 5.866 4.817 6.015 0.015 17 0 "[ . 1 . 2]" 1
351 1 43 GLU H 1 44 VAL MG1 . . 4.000 3.509 3.314 3.729 . 0 0 "[ . 1 . 2]" 1
352 1 43 GLU HB3 1 44 VAL H . . 3.390 3.340 3.237 3.440 0.050 1 0 "[ . 1 . 2]" 1
353 1 44 VAL H 1 44 VAL HA . . 3.000 2.732 2.715 2.744 . 0 0 "[ . 1 . 2]" 1
354 1 44 VAL H 1 44 VAL HB . . 4.000 3.572 2.688 3.623 . 0 0 "[ . 1 . 2]" 1
355 1 44 VAL H 1 44 VAL MG2 . . 3.500 2.379 2.082 3.761 0.261 16 0 "[ . 1 . 2]" 1
356 1 44 VAL H 1 45 LYS H . . 4.500 4.629 4.523 4.648 0.148 17 0 "[ . 1 . 2]" 1
357 1 44 VAL HB 1 45 LYS H . . 4.220 2.687 2.308 4.112 . 0 0 "[ . 1 . 2]" 1
358 1 44 VAL MG2 1 46 GLY H . . 4.500 3.823 2.326 4.186 . 0 0 "[ . 1 . 2]" 1
359 1 45 LYS H 1 45 LYS HA . . 3.000 2.934 2.908 2.947 . 0 0 "[ . 1 . 2]" 1
360 1 45 LYS H 1 46 GLY H . . 2.200 2.138 1.979 2.282 0.082 16 0 "[ . 1 . 2]" 1
361 1 46 GLY H 1 47 ILE H . . 4.400 4.432 4.426 4.438 0.038 2 0 "[ . 1 . 2]" 1
362 1 46 GLY HA2 1 47 ILE H . . 4.000 2.382 2.357 2.463 . 0 0 "[ . 1 . 2]" 1
363 1 46 GLY HA2 1 47 ILE MD . . 5.000 4.283 3.626 4.691 . 0 0 "[ . 1 . 2]" 1
364 1 46 GLY HA3 1 47 ILE H . . 3.750 2.762 2.666 2.793 . 0 0 "[ . 1 . 2]" 1
365 1 46 GLY HA3 1 47 ILE MD . . 5.400 5.426 4.852 5.667 0.267 5 0 "[ . 1 . 2]" 1
366 1 46 GLY HA2 1 70 LEU HA . . 5.100 5.202 5.128 5.259 0.159 16 0 "[ . 1 . 2]" 1
367 1 46 GLY H 1 71 PRO HD2 . . 5.000 4.934 4.811 4.984 . 0 0 "[ . 1 . 2]" 1
368 1 46 GLY HA2 1 71 PRO HB2 . . 4.000 3.879 3.839 3.903 . 0 0 "[ . 1 . 2]" 1
369 1 46 GLY HA2 1 71 PRO HD2 . . 4.100 2.963 2.864 3.009 . 0 0 "[ . 1 . 2]" 1
370 1 46 GLY HA2 1 71 PRO HG2 . . 4.840 2.079 1.998 2.112 . 0 0 "[ . 1 . 2]" 1
371 1 46 GLY HA2 1 72 ILE HA . . 4.900 4.472 4.402 4.561 . 0 0 "[ . 1 . 2]" 1
372 1 46 GLY HA2 1 179 PHE QE . . 4.500 4.466 4.433 4.502 0.002 14 0 "[ . 1 . 2]" 1
373 1 46 GLY H 1 183 CYS HB3 . . 4.400 4.448 4.425 4.484 0.084 7 0 "[ . 1 . 2]" 1
374 1 46 GLY H 1 183 CYS HG . . 4.300 4.332 4.294 4.361 0.061 5 0 "[ . 1 . 2]" 1
375 1 46 GLY HA2 1 183 CYS HG . . 3.500 3.403 3.340 3.464 . 0 0 "[ . 1 . 2]" 1
376 1 46 GLY HA3 1 183 CYS HA . . 4.910 4.951 4.928 4.974 0.064 20 0 "[ . 1 . 2]" 1
377 1 47 ILE H 1 47 ILE HG13 . . 5.000 3.042 2.907 3.309 . 0 0 "[ . 1 . 2]" 1
378 1 47 ILE H 1 47 ILE MD . . 5.000 3.928 3.362 4.352 . 0 0 "[ . 1 . 2]" 1
379 1 47 ILE HA 1 48 ILE H . . 2.200 2.245 2.226 2.258 0.058 12 0 "[ . 1 . 2]" 1
380 1 47 ILE HA 1 48 ILE QG . . 4.500 3.439 3.322 3.524 . 0 0 "[ . 1 . 2]" 1
381 1 47 ILE QG 1 48 ILE HA . . 6.000 5.802 5.790 5.810 . 0 0 "[ . 1 . 2]" 1
382 1 47 ILE MG 1 48 ILE H . . 4.500 2.157 2.014 2.207 . 0 0 "[ . 1 . 2]" 1
383 1 47 ILE MG 1 49 LEU HA . . 5.000 4.034 3.961 4.275 . 0 0 "[ . 1 . 2]" 1
384 1 47 ILE MD 1 67 ASN HD21 . . 4.500 3.386 2.986 4.331 . 0 0 "[ . 1 . 2]" 1
385 1 47 ILE MD 1 67 ASN HD22 . . 6.000 4.681 4.365 5.319 . 0 0 "[ . 1 . 2]" 1
386 1 47 ILE H 1 71 PRO HB2 . . 4.300 4.324 4.252 4.387 0.087 17 0 "[ . 1 . 2]" 1
387 1 47 ILE H 1 71 PRO HD2 . . 4.710 4.802 4.766 4.854 0.144 13 0 "[ . 1 . 2]" 1
388 1 47 ILE H 1 72 ILE HA . . 3.100 2.569 2.456 2.698 . 0 0 "[ . 1 . 2]" 1
389 1 47 ILE H 1 72 ILE HB . . 4.500 4.282 4.086 4.599 0.099 17 0 "[ . 1 . 2]" 1
390 1 47 ILE MD 1 72 ILE HB . . 4.500 3.314 2.804 4.304 . 0 0 "[ . 1 . 2]" 1
391 1 47 ILE MG 1 72 ILE HA . . 4.000 3.806 3.666 4.042 0.042 13 0 "[ . 1 . 2]" 1
392 1 47 ILE MG 1 72 ILE HB . . 4.000 3.634 3.381 3.868 . 0 0 "[ . 1 . 2]" 1
393 1 47 ILE MG 1 73 LEU H . . 5.000 4.270 4.117 4.571 . 0 0 "[ . 1 . 2]" 1
394 1 47 ILE H 1 179 PHE HZ . . 3.500 2.670 2.490 2.787 . 0 0 "[ . 1 . 2]" 1
395 1 47 ILE H 1 179 PHE QE . . 4.000 3.557 3.315 3.686 . 0 0 "[ . 1 . 2]" 1
396 1 48 ILE H 1 48 ILE HB . . 3.700 2.702 2.658 2.747 . 0 0 "[ . 1 . 2]" 1
397 1 48 ILE H 1 48 ILE MG . . 4.000 3.879 3.860 3.896 . 0 0 "[ . 1 . 2]" 1
398 1 48 ILE HA 1 49 LEU H . . 2.200 2.150 2.140 2.181 . 0 0 "[ . 1 . 2]" 1
399 1 48 ILE MG 1 49 LEU H . . 4.000 2.631 2.467 2.796 . 0 0 "[ . 1 . 2]" 1
400 1 48 ILE MG 1 49 LEU HB3 . . 5.200 4.590 4.489 4.692 . 0 0 "[ . 1 . 2]" 1
401 1 48 ILE HA 1 72 ILE HA . . 4.200 4.198 4.140 4.232 0.032 4 0 "[ . 1 . 2]" 1
402 1 48 ILE HA 1 73 LEU HB2 . . 4.710 4.478 4.169 4.728 0.018 19 0 "[ . 1 . 2]" 1
403 1 48 ILE HA 1 73 LEU HB3 . . 3.130 3.118 3.004 3.164 0.034 12 0 "[ . 1 . 2]" 1
404 1 48 ILE MG 1 73 LEU H . . 5.000 4.238 4.058 4.367 . 0 0 "[ . 1 . 2]" 1
405 1 48 ILE HA 1 74 GLY HA2 . . 4.300 4.368 4.332 4.412 0.112 12 0 "[ . 1 . 2]" 1
406 1 48 ILE H 1 179 PHE QE . . 5.150 5.167 5.058 5.207 0.057 14 0 "[ . 1 . 2]" 1
407 1 48 ILE HA 1 179 PHE QE . . 4.730 4.416 4.311 4.458 . 0 0 "[ . 1 . 2]" 1
408 1 48 ILE HG13 1 180 CYS HB2 . . 5.500 5.176 4.959 5.333 . 0 0 "[ . 1 . 2]" 1
409 1 48 ILE HG13 1 180 CYS HB3 . . 5.000 4.975 4.784 5.040 0.040 17 0 "[ . 1 . 2]" 1
410 1 49 LEU H 1 49 LEU HA . . 3.000 2.932 2.924 2.940 . 0 0 "[ . 1 . 2]" 1
411 1 49 LEU H 1 49 LEU HB2 . . 4.000 2.558 2.342 2.688 . 0 0 "[ . 1 . 2]" 1
412 1 49 LEU HA 1 49 LEU HB3 . . 3.000 2.989 2.921 3.005 0.005 7 0 "[ . 1 . 2]" 1
413 1 49 LEU H 1 50 SER H . . 4.200 4.074 3.970 4.213 0.013 12 0 "[ . 1 . 2]" 1
414 1 49 LEU HB2 1 72 ILE HA . . 5.940 5.637 5.436 5.776 . 0 0 "[ . 1 . 2]" 1
415 1 49 LEU H 1 74 GLY HA2 . . 4.300 2.552 2.491 2.632 . 0 0 "[ . 1 . 2]" 1
416 1 49 LEU H 1 75 ILE H . . 4.000 4.057 4.026 4.103 0.103 16 0 "[ . 1 . 2]" 1
417 1 49 LEU HB3 1 78 GLY HA2 . . 3.500 3.051 2.879 3.210 . 0 0 "[ . 1 . 2]" 1
418 1 49 LEU HB2 1 81 LEU MD1 . . 4.500 4.470 4.167 4.548 0.048 13 0 "[ . 1 . 2]" 1
419 1 50 SER H 1 74 GLY HA2 . . 5.800 5.303 5.138 5.434 . 0 0 "[ . 1 . 2]" 1
420 1 50 SER H 1 75 ILE HG13 . . 5.500 5.418 4.725 5.553 0.053 20 0 "[ . 1 . 2]" 1
421 1 51 GLY HA2 1 75 ILE HB . . 4.550 4.378 3.917 4.629 0.079 19 0 "[ . 1 . 2]" 1
422 1 51 GLY HA2 1 76 CYS HB2 . . 4.300 3.460 2.426 4.325 0.025 5 0 "[ . 1 . 2]" 1
423 1 52 GLY H 1 52 GLY HA2 . . 3.000 2.773 2.708 2.836 . 0 0 "[ . 1 . 2]" 1
424 1 52 GLY H 1 52 GLY HA3 . . 3.000 2.840 2.779 2.889 . 0 0 "[ . 1 . 2]" 1
425 1 52 GLY H 1 77 LEU H . . 3.500 3.443 3.030 3.556 0.056 11 0 "[ . 1 . 2]" 1
426 1 52 GLY H 1 77 LEU HG . . 4.980 3.523 3.051 4.006 . 0 0 "[ . 1 . 2]" 1
427 1 53 PRO HA 1 54 ASP H . . 3.750 3.566 3.564 3.570 . 0 0 "[ . 1 . 2]" 1
428 1 53 PRO HB2 1 54 ASP H . . 3.000 2.982 2.913 3.009 0.009 3 0 "[ . 1 . 2]" 1
429 1 53 PRO HD2 1 54 ASP H . . 3.000 2.718 2.708 2.747 . 0 0 "[ . 1 . 2]" 1
430 1 53 PRO HG2 1 54 ASP H . . 2.000 1.991 1.931 2.016 0.016 3 0 "[ . 1 . 2]" 1
431 1 53 PRO HG2 1 54 ASP HA . . 4.800 4.731 4.706 4.740 . 0 0 "[ . 1 . 2]" 1
432 1 54 ASP H 1 54 ASP HB3 . . 3.500 3.482 3.363 3.524 0.024 10 0 "[ . 1 . 2]" 1
433 1 54 ASP H 1 54 ASP HA . . 3.000 2.878 2.870 2.895 . 0 0 "[ . 1 . 2]" 1
434 1 54 ASP H 1 55 ILE MG . . 5.750 5.787 5.710 5.877 0.127 2 0 "[ . 1 . 2]" 1
435 1 54 ASP HA 1 55 ILE H . . 2.500 2.165 2.138 2.265 . 0 0 "[ . 1 . 2]" 1
436 1 54 ASP HB3 1 55 ILE H . . 4.000 3.623 3.371 3.817 . 0 0 "[ . 1 . 2]" 1
437 1 54 ASP HA 1 56 GLU H . . 3.500 3.551 3.403 3.761 0.261 11 0 "[ . 1 . 2]" 1
438 1 54 ASP HA 1 57 LYS HE3 . . 4.500 4.185 3.883 4.493 . 0 0 "[ . 1 . 2]" 1
439 1 54 ASP H 1 77 LEU HG . . 4.300 4.078 3.497 4.429 0.129 11 0 "[ . 1 . 2]" 1
440 1 55 ILE H 1 55 ILE HA . . 3.000 2.907 2.888 2.915 . 0 0 "[ . 1 . 2]" 1
441 1 55 ILE H 1 55 ILE HB . . 3.000 2.659 2.486 2.939 . 0 0 "[ . 1 . 2]" 1
442 1 55 ILE HA 1 55 ILE HB . . 3.000 2.778 2.535 3.011 0.011 10 0 "[ . 1 . 2]" 1
443 1 55 ILE H 1 56 GLU H . . 2.750 2.490 2.338 2.569 . 0 0 "[ . 1 . 2]" 1
444 1 55 ILE H 1 56 GLU HB3 . . 4.500 4.349 4.253 4.503 0.003 8 0 "[ . 1 . 2]" 1
445 1 55 ILE HA 1 56 GLU H . . 3.500 3.217 3.161 3.321 . 0 0 "[ . 1 . 2]" 1
446 1 55 ILE HB 1 56 GLU H . . 4.500 3.983 3.584 4.378 . 0 0 "[ . 1 . 2]" 1
447 1 55 ILE MG 1 56 GLU H . . 5.200 3.614 2.749 4.330 . 0 0 "[ . 1 . 2]" 1
448 1 55 ILE H 1 57 LYS HG2 . . 5.200 5.103 4.819 5.204 0.004 6 0 "[ . 1 . 2]" 1
449 1 55 ILE H 1 81 LEU HA . . 6.000 5.888 5.362 6.029 0.029 7 0 "[ . 1 . 2]" 1
450 1 55 ILE HB 1 81 LEU HA . . 4.000 4.003 3.664 4.147 0.147 3 0 "[ . 1 . 2]" 1
451 1 56 GLU H 1 56 GLU HA . . 3.000 2.914 2.874 2.940 . 0 0 "[ . 1 . 2]" 1
452 1 56 GLU H 1 56 GLU HB3 . . 2.790 2.579 2.351 2.760 . 0 0 "[ . 1 . 2]" 1
453 1 56 GLU H 1 56 GLU HG2 . . 4.500 2.824 2.091 4.445 . 0 0 "[ . 1 . 2]" 1
454 1 56 GLU H 1 57 LYS H . . 2.800 2.353 2.056 2.548 . 0 0 "[ . 1 . 2]" 1
455 1 56 GLU H 1 57 LYS HA . . 5.000 4.895 4.719 5.075 0.075 15 0 "[ . 1 . 2]" 1
456 1 56 GLU H 1 57 LYS HE2 . . 4.500 4.426 3.986 4.535 0.035 18 0 "[ . 1 . 2]" 1
457 1 56 GLU HA 1 57 LYS H . . 3.500 3.293 3.160 3.509 0.009 11 0 "[ . 1 . 2]" 1
458 1 56 GLU HG2 1 57 LYS H . . 4.300 3.305 2.150 4.343 0.043 18 0 "[ . 1 . 2]" 1
459 1 56 GLU H 1 58 ALA H . . 4.280 4.006 3.708 4.244 . 0 0 "[ . 1 . 2]" 1
460 1 56 GLU HG2 1 58 ALA H . . 5.000 4.977 4.558 5.050 0.050 16 0 "[ . 1 . 2]" 1
461 1 57 LYS H 1 57 LYS HB3 . . 3.300 2.695 2.469 2.877 . 0 0 "[ . 1 . 2]" 1
462 1 57 LYS H 1 57 LYS HD2 . . 5.000 4.726 4.231 4.855 . 0 0 "[ . 1 . 2]" 1
463 1 57 LYS H 1 57 LYS HE3 . . 4.350 4.212 3.878 4.358 0.008 8 0 "[ . 1 . 2]" 1
464 1 57 LYS H 1 57 LYS HG3 . . 3.500 3.470 3.226 3.551 0.051 16 0 "[ . 1 . 2]" 1
465 1 57 LYS HA 1 58 ALA H . . 3.830 3.361 3.256 3.496 . 0 0 "[ . 1 . 2]" 1
466 1 57 LYS HB3 1 58 ALA H . . 5.000 4.138 3.885 4.363 . 0 0 "[ . 1 . 2]" 1
467 1 57 LYS HG2 1 58 ALA H . . 3.500 2.968 2.337 3.403 . 0 0 "[ . 1 . 2]" 1
468 1 57 LYS HG3 1 58 ALA H . . 3.500 3.321 2.824 3.520 0.020 8 0 "[ . 1 . 2]" 1
469 1 58 ALA H 1 59 LYS H . . 4.600 4.462 4.240 4.576 . 0 0 "[ . 1 . 2]" 1
470 1 58 ALA MB 1 59 LYS H . . 4.000 2.892 2.577 3.277 . 0 0 "[ . 1 . 2]" 1
471 1 58 ALA MB 1 60 ASN H . . 2.500 2.468 2.328 2.558 0.058 11 0 "[ . 1 . 2]" 1
472 1 58 ALA MB 1 60 ASN HD21 . . 5.800 4.739 4.151 4.982 . 0 0 "[ . 1 . 2]" 1
473 1 58 ALA H 1 61 CYS HB2 . . 6.000 6.007 5.751 6.096 0.096 18 0 "[ . 1 . 2]" 1
474 1 58 ALA MB 1 61 CYS H . . 4.000 3.135 2.944 3.458 . 0 0 "[ . 1 . 2]" 1
475 1 58 ALA MB 1 61 CYS HB3 . . 4.800 3.691 3.184 4.822 0.022 5 0 "[ . 1 . 2]" 1
476 1 59 LYS H 1 59 LYS HG2 . . 3.200 2.198 1.999 2.456 . 0 0 "[ . 1 . 2]" 1
477 1 59 LYS H 1 60 ASN H . . 4.490 2.325 2.246 2.641 . 0 0 "[ . 1 . 2]" 1
478 1 59 LYS H 1 60 ASN HD21 . . 4.500 4.489 4.354 4.538 0.038 4 0 "[ . 1 . 2]" 1
479 1 59 LYS HA 1 60 ASN H . . 5.220 3.372 3.325 3.428 . 0 0 "[ . 1 . 2]" 1
480 1 59 LYS HG2 1 60 ASN H . . 3.800 2.613 2.296 3.169 . 0 0 "[ . 1 . 2]" 1
481 1 59 LYS HA 1 62 ILE H . . 3.800 3.777 3.513 3.878 0.078 11 0 "[ . 1 . 2]" 1
482 1 60 ASN H 1 61 CYS H . . 4.880 2.590 2.455 2.770 . 0 0 "[ . 1 . 2]" 1
483 1 60 ASN HA 1 61 CYS H . . 4.500 3.444 3.386 3.501 . 0 0 "[ . 1 . 2]" 1
484 1 60 ASN HB3 1 61 CYS H . . 4.000 3.397 3.127 3.632 . 0 0 "[ . 1 . 2]" 1
485 1 60 ASN HA 1 62 ILE H . . 4.900 3.875 3.740 4.365 . 0 0 "[ . 1 . 2]" 1
486 1 60 ASN HA 1 63 ASP H . . 4.530 3.274 3.178 3.441 . 0 0 "[ . 1 . 2]" 1
487 1 61 CYS H 1 61 CYS HB2 . . 3.500 3.451 2.671 3.590 0.090 19 0 "[ . 1 . 2]" 1
488 1 61 CYS H 1 61 CYS HB3 . . 4.000 2.453 2.365 2.518 . 0 0 "[ . 1 . 2]" 1
489 1 61 CYS H 1 62 ILE H . . 2.800 2.746 2.659 2.844 0.044 15 0 "[ . 1 . 2]" 1
490 1 61 CYS HB2 1 62 ILE H . . 3.800 3.897 3.834 3.933 0.133 10 0 "[ . 1 . 2]" 1
491 1 61 CYS HB3 1 62 ILE H . . 4.000 3.757 2.487 3.991 . 0 0 "[ . 1 . 2]" 1
492 1 61 CYS H 1 63 ASP H . . 4.300 4.294 4.209 4.318 0.018 7 0 "[ . 1 . 2]" 1
493 1 61 CYS HA 1 63 ASP H . . 4.400 4.244 4.059 4.421 0.021 15 0 "[ . 1 . 2]" 1
494 1 61 CYS HA 1 64 ILE H . . 3.800 3.394 3.297 3.484 . 0 0 "[ . 1 . 2]" 1
495 1 61 CYS HA 1 64 ILE HB . . 3.000 2.944 2.621 3.050 0.050 9 0 "[ . 1 . 2]" 1
496 1 61 CYS HA 1 64 ILE QG . . 5.260 3.698 3.136 3.975 . 0 0 "[ . 1 . 2]" 1
497 1 61 CYS HA 1 64 ILE MG . . 5.110 4.264 3.972 4.383 . 0 0 "[ . 1 . 2]" 1
498 1 61 CYS HB3 1 64 ILE HB . . 5.200 5.250 5.174 5.311 0.111 15 0 "[ . 1 . 2]" 1
499 1 61 CYS HB2 1 81 LEU HA . . 5.000 4.890 4.616 5.064 0.064 18 0 "[ . 1 . 2]" 1
500 1 61 CYS HB2 1 84 LEU MD1 . . 4.100 3.729 3.334 4.173 0.073 12 0 "[ . 1 . 2]" 1
501 1 61 CYS HB2 1 84 LEU MD2 . . 4.000 4.040 3.987 4.063 0.063 20 0 "[ . 1 . 2]" 1
502 1 62 ILE H 1 62 ILE HB . . 3.440 2.657 2.640 2.678 . 0 0 "[ . 1 . 2]" 1
503 1 62 ILE H 1 62 ILE HG13 . . 3.300 1.929 1.910 1.949 . 0 0 "[ . 1 . 2]" 1
504 1 62 ILE H 1 62 ILE MG . . 3.800 3.763 3.760 3.766 . 0 0 "[ . 1 . 2]" 1
505 1 62 ILE H 1 63 ASP H . . 2.800 2.657 2.577 2.855 0.055 5 0 "[ . 1 . 2]" 1
506 1 62 ILE HA 1 63 ASP H . . 3.500 3.522 3.501 3.547 0.047 20 0 "[ . 1 . 2]" 1
507 1 62 ILE HB 1 63 ASP H . . 4.000 2.678 2.511 2.801 . 0 0 "[ . 1 . 2]" 1
508 1 62 ILE HG13 1 63 ASP H . . 4.000 4.034 4.001 4.059 0.059 8 0 "[ . 1 . 2]" 1
509 1 62 ILE MG 1 63 ASP H . . 4.000 3.692 3.537 3.789 . 0 0 "[ . 1 . 2]" 1
510 1 62 ILE MG 1 63 ASP HB3 . . 5.970 5.514 5.293 5.693 . 0 0 "[ . 1 . 2]" 1
511 1 62 ILE H 1 64 ILE H . . 4.200 4.134 4.057 4.222 0.022 4 0 "[ . 1 . 2]" 1
512 1 62 ILE H 1 65 ALA H . . 5.000 4.949 4.896 4.994 . 0 0 "[ . 1 . 2]" 1
513 1 62 ILE HA 1 65 ALA H . . 3.800 3.469 3.394 3.505 . 0 0 "[ . 1 . 2]" 1
514 1 62 ILE HA 1 65 ALA MB . . 5.420 2.744 2.636 2.844 . 0 0 "[ . 1 . 2]" 1
515 1 62 ILE MG 1 65 ALA HA . . 6.000 5.987 5.905 6.071 0.071 15 0 "[ . 1 . 2]" 1
516 1 62 ILE HA 1 85 ALA HA . . 6.000 5.997 5.635 6.058 0.058 6 0 "[ . 1 . 2]" 1
517 1 63 ASP H 1 63 ASP HB3 . . 4.000 2.821 2.285 3.593 . 0 0 "[ . 1 . 2]" 1
518 1 63 ASP H 1 64 ILE H . . 2.800 2.606 2.567 2.648 . 0 0 "[ . 1 . 2]" 1
519 1 63 ASP HA 1 64 ILE H . . 3.500 3.517 3.494 3.531 0.031 4 0 "[ . 1 . 2]" 1
520 1 63 ASP HA 1 64 ILE HG13 . . 5.500 5.379 5.254 5.483 . 0 0 "[ . 1 . 2]" 1
521 1 63 ASP HB3 1 64 ILE H . . 4.000 3.114 2.657 4.017 0.017 20 0 "[ . 1 . 2]" 1
522 1 63 ASP H 1 65 ALA H . . 4.200 4.033 3.958 4.138 . 0 0 "[ . 1 . 2]" 1
523 1 63 ASP HA 1 66 LEU H . . 3.400 3.368 3.304 3.422 0.022 15 0 "[ . 1 . 2]" 1
524 1 63 ASP H 1 67 ASN H . . 6.000 6.053 6.005 6.088 0.088 13 0 "[ . 1 . 2]" 1
525 1 64 ILE H 1 64 ILE HB . . 4.000 2.455 2.411 2.523 . 0 0 "[ . 1 . 2]" 1
526 1 64 ILE H 1 64 ILE MG . . 4.000 3.751 3.740 3.763 . 0 0 "[ . 1 . 2]" 1
527 1 64 ILE H 1 65 ALA H . . 2.800 2.583 2.537 2.637 . 0 0 "[ . 1 . 2]" 1
528 1 64 ILE HA 1 65 ALA H . . 3.500 3.481 3.466 3.508 0.008 17 0 "[ . 1 . 2]" 1
529 1 64 ILE HB 1 65 ALA H . . 3.000 2.925 2.803 2.990 . 0 0 "[ . 1 . 2]" 1
530 1 64 ILE MG 1 65 ALA H . . 4.000 3.568 3.467 3.640 . 0 0 "[ . 1 . 2]" 1
531 1 64 ILE H 1 66 LEU H . . 4.200 4.171 4.119 4.224 0.024 20 0 "[ . 1 . 2]" 1
532 1 64 ILE HA 1 67 ASN H . . 3.500 3.339 3.266 3.494 . 0 0 "[ . 1 . 2]" 1
533 1 64 ILE HA 1 68 ALA H . . 5.380 5.238 5.144 5.359 . 0 0 "[ . 1 . 2]" 1
534 1 64 ILE HA 1 68 ALA MB . . 5.670 5.670 5.543 5.767 0.097 17 0 "[ . 1 . 2]" 1
535 1 65 ALA MB 1 66 LEU H . . 4.000 2.717 2.648 2.772 . 0 0 "[ . 1 . 2]" 1
536 1 65 ALA MB 1 66 LEU HA . . 5.180 3.893 3.862 3.912 . 0 0 "[ . 1 . 2]" 1
537 1 65 ALA MB 1 67 ASN H . . 5.220 4.318 4.285 4.338 . 0 0 "[ . 1 . 2]" 1
538 1 65 ALA MB 1 67 ASN HB2 . . 5.750 5.778 5.760 5.810 0.060 17 0 "[ . 1 . 2]" 1
539 1 65 ALA HA 1 68 ALA MB . . 5.980 3.645 3.407 3.797 . 0 0 "[ . 1 . 2]" 1
540 1 65 ALA HA 1 72 ILE MG . . 5.300 5.321 5.260 5.428 0.128 17 0 "[ . 1 . 2]" 1
541 1 65 ALA MB 1 86 TYR QD . . 6.000 5.157 4.751 5.467 . 0 0 "[ . 1 . 2]" 1
542 1 66 LEU H 1 66 LEU HA . . 3.000 2.902 2.877 2.910 . 0 0 "[ . 1 . 2]" 1
543 1 66 LEU H 1 66 LEU MD2 . . 4.800 4.018 3.703 4.213 . 0 0 "[ . 1 . 2]" 1
544 1 66 LEU H 1 67 ASN H . . 2.800 2.303 2.265 2.398 . 0 0 "[ . 1 . 2]" 1
545 1 66 LEU H 1 67 ASN HA . . 5.000 4.953 4.913 5.051 0.051 17 0 "[ . 1 . 2]" 1
546 1 66 LEU H 1 67 ASN HB2 . . 4.500 4.268 4.197 4.396 . 0 0 "[ . 1 . 2]" 1
547 1 66 LEU HB3 1 67 ASN H . . 3.500 3.159 3.074 3.225 . 0 0 "[ . 1 . 2]" 1
548 1 66 LEU MD1 1 67 ASN H . . 6.000 5.175 5.064 5.227 . 0 0 "[ . 1 . 2]" 1
549 1 66 LEU MD2 1 67 ASN H . . 4.000 3.746 3.344 3.987 . 0 0 "[ . 1 . 2]" 1
550 1 66 LEU H 1 68 ALA H . . 4.200 4.230 4.213 4.249 0.049 12 0 "[ . 1 . 2]" 1
551 1 67 ASN H 1 67 ASN HA . . 3.000 2.916 2.914 2.918 . 0 0 "[ . 1 . 2]" 1
552 1 67 ASN H 1 67 ASN HB2 . . 4.250 2.291 2.268 2.346 . 0 0 "[ . 1 . 2]" 1
553 1 67 ASN H 1 67 ASN HB3 . . 4.000 3.561 3.540 3.599 . 0 0 "[ . 1 . 2]" 1
554 1 67 ASN H 1 68 ALA H . . 2.800 2.724 2.708 2.743 . 0 0 "[ . 1 . 2]" 1
555 1 67 ASN H 1 68 ALA HA . . 5.000 4.687 4.664 4.722 . 0 0 "[ . 1 . 2]" 1
556 1 67 ASN HA 1 68 ALA H . . 3.500 3.024 3.018 3.029 . 0 0 "[ . 1 . 2]" 1
557 1 67 ASN HB2 1 68 ALA H . . 4.000 4.015 3.987 4.027 0.027 12 0 "[ . 1 . 2]" 1
558 1 67 ASN HB2 1 68 ALA MB . . 5.360 5.216 5.148 5.269 . 0 0 "[ . 1 . 2]" 1
559 1 67 ASN HB3 1 68 ALA H . . 4.400 4.319 4.297 4.358 . 0 0 "[ . 1 . 2]" 1
560 1 68 ALA H 1 69 LYS H . . 4.880 2.630 2.605 2.657 . 0 0 "[ . 1 . 2]" 1
561 1 68 ALA H 1 69 LYS QZ . . 6.000 5.108 4.244 5.864 . 0 0 "[ . 1 . 2]" 1
562 1 68 ALA MB 1 69 LYS H . . 4.000 3.106 3.045 3.196 . 0 0 "[ . 1 . 2]" 1
563 1 68 ALA H 1 157 ILE MD . . 5.500 4.284 3.929 4.812 . 0 0 "[ . 1 . 2]" 1
564 1 69 LYS H 1 69 LYS HG3 . . 4.000 2.882 1.935 3.873 . 0 0 "[ . 1 . 2]" 1
565 1 69 LYS H 1 69 LYS HB3 . . 3.700 2.904 2.394 3.575 . 0 0 "[ . 1 . 2]" 1
566 1 69 LYS H 1 70 LEU H . . 3.720 2.798 2.764 2.831 . 0 0 "[ . 1 . 2]" 1
567 1 69 LYS HB3 1 70 LEU H . . 4.060 4.044 3.964 4.132 0.072 7 0 "[ . 1 . 2]" 1
568 1 69 LYS HG3 1 70 LEU H . . 4.000 3.215 2.059 4.098 0.098 17 0 "[ . 1 . 2]" 1
569 1 70 LEU H 1 70 LEU HB3 . . 4.000 3.613 3.559 3.738 . 0 0 "[ . 1 . 2]" 1
570 1 71 PRO HA 1 72 ILE H . . 4.180 2.182 2.176 2.185 . 0 0 "[ . 1 . 2]" 1
571 1 71 PRO HB2 1 72 ILE H . . 4.500 3.897 3.871 3.909 . 0 0 "[ . 1 . 2]" 1
572 1 71 PRO HD2 1 72 ILE H . . 5.450 5.407 5.397 5.427 . 0 0 "[ . 1 . 2]" 1
573 1 71 PRO HA 1 156 PRO HA . . 4.800 4.462 4.173 4.636 . 0 0 "[ . 1 . 2]" 1
574 1 71 PRO HA 1 156 PRO HB2 . . 3.200 2.536 2.215 2.795 . 0 0 "[ . 1 . 2]" 1
575 1 72 ILE H 1 72 ILE HB . . 4.050 3.103 3.005 3.760 . 0 0 "[ . 1 . 2]" 1
576 1 72 ILE H 1 72 ILE MG . . 4.000 1.966 1.894 2.399 . 0 0 "[ . 1 . 2]" 1
577 1 72 ILE H 1 73 LEU H . . 4.600 4.383 4.330 4.484 . 0 0 "[ . 1 . 2]" 1
578 1 72 ILE HA 1 73 LEU H . . 3.500 2.151 2.141 2.197 . 0 0 "[ . 1 . 2]" 1
579 1 72 ILE HB 1 73 LEU H . . 5.000 4.101 3.018 4.257 . 0 0 "[ . 1 . 2]" 1
580 1 72 ILE MG 1 73 LEU H . . 4.000 4.034 4.000 4.082 0.082 6 0 "[ . 1 . 2]" 1
581 1 72 ILE H 1 158 TYR H . . 4.000 3.454 3.198 3.808 . 0 0 "[ . 1 . 2]" 1
582 1 72 ILE MG 1 158 TYR H . . 6.000 2.984 2.569 4.692 . 0 0 "[ . 1 . 2]" 1
583 1 72 ILE H 1 179 PHE QE . . 4.600 4.494 4.278 4.604 0.004 14 0 "[ . 1 . 2]" 1
584 1 72 ILE HA 1 183 CYS HG . . 5.500 5.563 5.521 5.609 0.109 5 0 "[ . 1 . 2]" 1
585 1 73 LEU H 1 73 LEU HB2 . . 4.200 2.799 2.661 3.196 . 0 0 "[ . 1 . 2]" 1
586 1 73 LEU H 1 73 LEU MD2 . . 4.580 4.381 4.312 4.477 . 0 0 "[ . 1 . 2]" 1
587 1 73 LEU HA 1 74 GLY H . . 2.200 2.164 2.146 2.194 . 0 0 "[ . 1 . 2]" 1
588 1 73 LEU HA 1 74 GLY HA2 . . 4.400 4.419 4.401 4.438 0.038 4 0 "[ . 1 . 2]" 1
589 1 73 LEU HA 1 74 GLY HA3 . . 4.380 4.417 4.395 4.447 0.067 4 0 "[ . 1 . 2]" 1
590 1 73 LEU HB2 1 74 GLY H . . 4.700 4.467 4.363 4.556 . 0 0 "[ . 1 . 2]" 1
591 1 73 LEU MD1 1 74 GLY H . . 3.620 2.982 2.735 3.308 . 0 0 "[ . 1 . 2]" 1
592 1 73 LEU MD1 1 75 ILE HG12 . . 4.640 4.578 4.198 4.661 0.021 9 0 "[ . 1 . 2]" 1
593 1 73 LEU MD1 1 75 ILE QG . . 4.500 4.293 3.965 4.487 . 0 0 "[ . 1 . 2]" 1
594 1 73 LEU HA 1 158 TYR HB2 . . 2.900 2.409 2.074 2.842 . 0 0 "[ . 1 . 2]" 1
595 1 73 LEU HA 1 158 TYR QD . . 4.100 4.049 3.794 4.127 0.027 16 0 "[ . 1 . 2]" 1
596 1 73 LEU MD1 1 158 TYR HB2 . . 3.100 2.187 1.903 3.030 . 0 0 "[ . 1 . 2]" 1
597 1 73 LEU MD1 1 158 TYR HB3 . . 3.100 2.402 2.033 3.111 0.011 9 0 "[ . 1 . 2]" 1
598 1 73 LEU MD1 1 158 TYR QD . . 4.900 3.592 3.196 4.456 . 0 0 "[ . 1 . 2]" 1
599 1 73 LEU HA 1 159 GLY HA2 . . 4.800 3.850 3.564 4.208 . 0 0 "[ . 1 . 2]" 1
600 1 73 LEU MD1 1 159 GLY H . . 4.700 3.621 3.257 4.202 . 0 0 "[ . 1 . 2]" 1
601 1 73 LEU MD1 1 159 GLY HA2 . . 3.720 3.270 2.812 3.719 . 0 0 "[ . 1 . 2]" 1
602 1 73 LEU MD1 1 179 PHE QD . . 4.100 3.593 3.126 4.124 0.024 4 0 "[ . 1 . 2]" 1
603 1 74 GLY HA3 1 75 ILE HA . . 4.600 4.422 4.418 4.427 . 0 0 "[ . 1 . 2]" 1
604 1 74 GLY H 1 160 VAL MG2 . . 5.800 4.256 3.942 4.642 . 0 0 "[ . 1 . 2]" 1
605 1 75 ILE H 1 75 ILE HB . . 4.000 2.971 2.736 3.695 . 0 0 "[ . 1 . 2]" 1
606 1 75 ILE HA 1 75 ILE MD . . 4.500 3.899 3.827 4.163 . 0 0 "[ . 1 . 2]" 1
607 1 75 ILE H 1 75 ILE MG . . 4.300 3.852 3.350 3.948 . 0 0 "[ . 1 . 2]" 1
608 1 75 ILE MG 1 76 CYS H . . 5.000 2.541 2.205 3.547 . 0 0 "[ . 1 . 2]" 1
609 1 75 ILE H 1 78 GLY H . . 3.000 2.870 2.724 2.948 . 0 0 "[ . 1 . 2]" 1
610 1 75 ILE H 1 78 GLY HA2 . . 4.160 3.892 3.817 3.978 . 0 0 "[ . 1 . 2]" 1
611 1 75 ILE H 1 78 GLY HA3 . . 2.400 2.429 2.337 2.493 0.093 19 0 "[ . 1 . 2]" 1
612 1 75 ILE HA 1 78 GLY HA3 . . 4.750 4.324 4.212 4.587 . 0 0 "[ . 1 . 2]" 1
613 1 75 ILE HG13 1 78 GLY H . . 5.900 5.237 4.003 5.579 . 0 0 "[ . 1 . 2]" 1
614 1 75 ILE HA 1 79 HIS HB3 . . 4.440 4.384 4.014 4.483 0.043 14 0 "[ . 1 . 2]" 1
615 1 75 ILE HA 1 160 VAL HA . . 5.210 5.249 5.054 5.298 0.088 20 0 "[ . 1 . 2]" 1
616 1 75 ILE HA 1 160 VAL HB . . 4.730 4.618 4.518 4.746 0.016 5 0 "[ . 1 . 2]" 1
617 1 75 ILE HA 1 164 PRO HD2 . . 4.600 4.438 3.981 4.652 0.052 9 0 "[ . 1 . 2]" 1
618 1 75 ILE HA 1 164 PRO HD3 . . 5.000 4.875 4.485 5.086 0.086 14 0 "[ . 1 . 2]" 1
619 1 77 LEU H 1 77 LEU MD2 . . 5.000 3.362 2.766 4.131 . 0 0 "[ . 1 . 2]" 1
620 1 77 LEU MD2 1 78 GLY H . . 4.500 4.453 4.106 4.545 0.045 10 0 "[ . 1 . 2]" 1
621 1 78 GLY HA3 1 79 HIS H . . 4.600 2.626 2.564 2.655 . 0 0 "[ . 1 . 2]" 1
622 1 78 GLY H 1 80 GLN HB3 . . 5.000 5.054 4.995 5.125 0.125 15 0 "[ . 1 . 2]" 1
623 1 78 GLY HA2 1 81 LEU HB2 . . 4.900 3.603 3.407 3.770 . 0 0 "[ . 1 . 2]" 1
624 1 78 GLY HA3 1 81 LEU MD2 . . 4.400 4.390 4.162 4.442 0.042 19 0 "[ . 1 . 2]" 1
625 1 79 HIS H 1 79 HIS HA . . 3.000 2.767 2.742 2.782 . 0 0 "[ . 1 . 2]" 1
626 1 79 HIS HA 1 79 HIS HB2 . . 2.500 2.292 2.260 2.320 . 0 0 "[ . 1 . 2]" 1
627 1 79 HIS HA 1 79 HIS HB3 . . 3.000 2.661 2.615 2.726 . 0 0 "[ . 1 . 2]" 1
628 1 79 HIS HA 1 80 GLN H . . 3.500 3.497 3.468 3.519 0.019 12 0 "[ . 1 . 2]" 1
629 1 79 HIS HB3 1 80 GLN H . . 3.650 3.690 3.568 3.817 0.167 14 0 "[ . 1 . 2]" 1
630 1 79 HIS HB3 1 81 LEU H . . 5.440 5.545 5.493 5.693 0.253 12 0 "[ . 1 . 2]" 1
631 1 79 HIS HA 1 82 ILE MG . . 5.500 4.564 3.142 4.797 . 0 0 "[ . 1 . 2]" 1
632 1 79 HIS HB2 1 129 VAL H . . 5.750 5.684 5.547 5.772 0.022 16 0 "[ . 1 . 2]" 1
633 1 79 HIS HB2 1 129 VAL MG2 . . 4.750 3.831 3.726 3.988 . 0 0 "[ . 1 . 2]" 1
634 1 79 HIS HB2 1 147 VAL MG2 . . 6.000 5.577 5.314 5.629 . 0 0 "[ . 1 . 2]" 1
635 1 79 HIS HA 1 159 GLY HA2 . . 4.600 3.408 3.113 3.607 . 0 0 "[ . 1 . 2]" 1
636 1 79 HIS H 1 160 VAL MG2 . . 6.000 4.426 4.262 4.615 . 0 0 "[ . 1 . 2]" 1
637 1 79 HIS HB2 1 160 VAL HA . . 4.000 3.999 3.800 4.061 0.061 20 0 "[ . 1 . 2]" 1
638 1 79 HIS HB3 1 160 VAL H . . 3.000 2.418 2.042 2.784 . 0 0 "[ . 1 . 2]" 1
639 1 79 HIS HB3 1 161 GLN HB2 . . 5.000 4.571 4.264 5.003 0.003 11 0 "[ . 1 . 2]" 1
640 1 80 GLN H 1 80 GLN HA . . 3.000 2.866 2.847 2.896 . 0 0 "[ . 1 . 2]" 1
641 1 80 GLN H 1 80 GLN HB2 . . 4.000 2.705 2.639 2.783 . 0 0 "[ . 1 . 2]" 1
642 1 80 GLN H 1 80 GLN HB3 . . 4.000 2.410 2.341 2.459 . 0 0 "[ . 1 . 2]" 1
643 1 80 GLN HA 1 81 LEU H . . 3.500 3.482 3.449 3.529 0.029 12 0 "[ . 1 . 2]" 1
644 1 80 GLN HB3 1 81 LEU H . . 4.000 2.903 2.709 3.027 . 0 0 "[ . 1 . 2]" 1
645 1 80 GLN HB3 1 81 LEU HA . . 4.300 4.383 4.330 4.432 0.132 20 0 "[ . 1 . 2]" 1
646 1 80 GLN HA 1 83 ALA MB . . 6.000 2.552 2.224 2.844 . 0 0 "[ . 1 . 2]" 1
647 1 80 GLN HA 1 129 VAL MG1 . . 5.850 4.813 4.636 5.079 . 0 0 "[ . 1 . 2]" 1
648 1 80 GLN HA 1 129 VAL MG2 . . 3.000 2.996 2.888 3.078 0.078 17 0 "[ . 1 . 2]" 1
649 1 81 LEU H 1 81 LEU HA . . 3.000 2.832 2.774 2.855 . 0 0 "[ . 1 . 2]" 1
650 1 81 LEU H 1 81 LEU HB2 . . 3.700 2.896 2.782 3.004 . 0 0 "[ . 1 . 2]" 1
651 1 81 LEU H 1 81 LEU MD2 . . 4.000 3.606 3.375 3.807 . 0 0 "[ . 1 . 2]" 1
652 1 81 LEU H 1 82 ILE H . . 2.800 2.573 2.501 2.721 . 0 0 "[ . 1 . 2]" 1
653 1 81 LEU HA 1 82 ILE H . . 3.500 3.503 3.477 3.523 0.023 1 0 "[ . 1 . 2]" 1
654 1 81 LEU HA 1 82 ILE QG . . 5.420 5.088 4.874 5.361 . 0 0 "[ . 1 . 2]" 1
655 1 81 LEU HB2 1 82 ILE H . . 4.050 4.154 4.127 4.204 0.154 12 0 "[ . 1 . 2]" 1
656 1 81 LEU HA 1 83 ALA H . . 4.300 4.297 4.138 4.359 0.059 15 0 "[ . 1 . 2]" 1
657 1 81 LEU HA 1 83 ALA MB . . 5.590 4.863 4.790 4.931 . 0 0 "[ . 1 . 2]" 1
658 1 81 LEU HA 1 84 LEU MD1 . . 5.530 3.448 1.891 3.777 . 0 0 "[ . 1 . 2]" 1
659 1 82 ILE H 1 82 ILE HA . . 3.000 2.853 2.823 2.892 . 0 0 "[ . 1 . 2]" 1
660 1 82 ILE H 1 82 ILE HB . . 4.000 2.568 2.452 3.630 . 0 0 "[ . 1 . 2]" 1
661 1 82 ILE H 1 82 ILE MG . . 4.000 3.676 1.954 3.779 . 0 0 "[ . 1 . 2]" 1
662 1 82 ILE MG 1 83 ALA H . . 4.000 3.564 3.482 3.719 . 0 0 "[ . 1 . 2]" 1
663 1 82 ILE MG 1 83 ALA HA . . 5.190 3.590 3.411 5.320 0.130 9 0 "[ . 1 . 2]" 1
664 1 82 ILE MG 1 83 ALA MB . . 5.210 4.259 4.122 4.790 . 0 0 "[ . 1 . 2]" 1
665 1 82 ILE MG 1 84 LEU H . . 5.400 5.422 5.353 5.627 0.227 9 0 "[ . 1 . 2]" 1
666 1 83 ALA H 1 84 LEU H . . 2.800 2.869 2.828 2.938 0.138 18 0 "[ . 1 . 2]" 1
667 1 83 ALA HA 1 84 LEU H . . 3.500 3.572 3.569 3.573 0.073 8 0 "[ . 1 . 2]" 1
668 1 83 ALA HA 1 84 LEU HA . . 5.170 4.796 4.730 4.822 . 0 0 "[ . 1 . 2]" 1
669 1 83 ALA HA 1 84 LEU MD1 . . 6.000 5.958 4.412 6.062 0.062 16 0 "[ . 1 . 2]" 1
670 1 83 ALA MB 1 84 LEU H . . 4.000 2.327 2.144 2.427 . 0 0 "[ . 1 . 2]" 1
671 1 83 ALA MB 1 84 LEU HA . . 4.600 3.645 3.594 3.715 . 0 0 "[ . 1 . 2]" 1
672 1 83 ALA MB 1 84 LEU MD2 . . 4.860 4.353 4.279 4.950 0.090 12 0 "[ . 1 . 2]" 1
673 1 83 ALA HA 1 85 ALA H . . 4.400 4.065 3.878 4.128 . 0 0 "[ . 1 . 2]" 1
674 1 83 ALA HA 1 85 ALA MB . . 5.910 4.701 4.631 4.792 . 0 0 "[ . 1 . 2]" 1
675 1 83 ALA HA 1 86 TYR H . . 3.400 3.428 3.309 3.545 0.145 12 0 "[ . 1 . 2]" 1
676 1 83 ALA HA 1 87 GLY H . . 4.200 4.230 4.213 4.254 0.054 15 0 "[ . 1 . 2]" 1
677 1 83 ALA HA 1 88 GLY HA2 . . 5.000 5.129 5.071 5.185 0.185 15 0 "[ . 1 . 2]" 1
678 1 83 ALA H 1 129 VAL MG1 . . 5.130 5.154 5.067 5.223 0.093 9 0 "[ . 1 . 2]" 1
679 1 83 ALA MB 1 129 VAL H . . 5.100 5.112 4.966 5.168 0.068 16 0 "[ . 1 . 2]" 1
680 1 83 ALA MB 1 129 VAL MG2 . . 5.140 2.308 2.042 2.614 . 0 0 "[ . 1 . 2]" 1
681 1 83 ALA MB 1 133 PRO HD2 . . 5.000 4.883 4.436 5.088 0.088 12 0 "[ . 1 . 2]" 1
682 1 83 ALA MB 1 136 PHE HE2 . . 5.800 5.841 5.804 5.877 0.077 12 0 "[ . 1 . 2]" 1
683 1 84 LEU H 1 84 LEU MD2 . . 4.000 3.203 3.136 3.701 . 0 0 "[ . 1 . 2]" 1
684 1 84 LEU HA 1 84 LEU MD1 . . 4.680 3.580 3.436 3.600 . 0 0 "[ . 1 . 2]" 1
685 1 84 LEU H 1 84 LEU HB2 . . 4.000 3.574 3.557 3.580 . 0 0 "[ . 1 . 2]" 1
686 1 84 LEU H 1 84 LEU MD1 . . 5.610 3.709 1.909 3.856 . 0 0 "[ . 1 . 2]" 1
687 1 84 LEU H 1 85 ALA H . . 2.800 2.726 2.653 2.772 . 0 0 "[ . 1 . 2]" 1
688 1 84 LEU HA 1 85 ALA MB . . 5.580 4.991 4.943 4.998 . 0 0 "[ . 1 . 2]" 1
689 1 84 LEU HB2 1 85 ALA H . . 4.100 3.998 3.923 4.270 0.170 12 0 "[ . 1 . 2]" 1
690 1 84 LEU MD2 1 85 ALA H . . 4.000 3.949 2.766 4.033 0.033 13 0 "[ . 1 . 2]" 1
691 1 84 LEU MD2 1 85 ALA HA . . 5.110 4.959 2.327 5.116 0.006 4 0 "[ . 1 . 2]" 1
692 1 84 LEU MD2 1 85 ALA MB . . 5.820 4.300 2.567 4.432 . 0 0 "[ . 1 . 2]" 1
693 1 84 LEU H 1 86 TYR H . . 4.300 4.318 4.268 4.339 0.039 15 0 "[ . 1 . 2]" 1
694 1 84 LEU MD1 1 86 TYR H . . 5.800 4.498 4.004 4.576 . 0 0 "[ . 1 . 2]" 1
695 1 85 ALA H 1 86 TYR H . . 2.800 2.536 2.347 2.588 . 0 0 "[ . 1 . 2]" 1
696 1 85 ALA HA 1 86 TYR H . . 3.500 3.522 3.487 3.536 0.036 15 0 "[ . 1 . 2]" 1
697 1 85 ALA MB 1 86 TYR H . . 4.060 2.653 2.594 2.784 . 0 0 "[ . 1 . 2]" 1
698 1 85 ALA MB 1 86 TYR HA . . 5.980 3.900 3.795 3.983 . 0 0 "[ . 1 . 2]" 1
699 1 85 ALA MB 1 86 TYR QD . . 5.910 3.213 2.801 3.736 . 0 0 "[ . 1 . 2]" 1
700 1 85 ALA H 1 87 GLY H . . 3.750 3.691 3.586 3.752 0.002 9 0 "[ . 1 . 2]" 1
701 1 85 ALA MB 1 87 GLY H . . 4.300 4.303 4.229 4.403 0.103 12 0 "[ . 1 . 2]" 1
702 1 86 TYR H 1 86 TYR HB2 . . 4.000 2.181 2.136 2.243 . 0 0 "[ . 1 . 2]" 1
703 1 86 TYR H 1 86 TYR HB3 . . 4.000 3.333 3.124 3.505 . 0 0 "[ . 1 . 2]" 1
704 1 86 TYR H 1 86 TYR QD . . 4.500 3.277 2.787 3.805 . 0 0 "[ . 1 . 2]" 1
705 1 86 TYR H 1 87 GLY H . . 3.490 2.285 2.131 2.409 . 0 0 "[ . 1 . 2]" 1
706 1 86 TYR HB3 1 87 GLY H . . 4.500 3.583 3.357 3.818 . 0 0 "[ . 1 . 2]" 1
707 1 86 TYR H 1 88 GLY H . . 3.910 3.654 3.547 3.769 . 0 0 "[ . 1 . 2]" 1
708 1 86 TYR HA 1 133 PRO HB3 . . 6.000 5.766 5.576 6.036 0.036 13 0 "[ . 1 . 2]" 1
709 1 87 GLY H 1 88 GLY H . . 3.500 2.109 2.042 2.216 . 0 0 "[ . 1 . 2]" 1
710 1 87 GLY HA3 1 88 GLY H . . 33.800 3.530 3.497 3.543 . 0 0 "[ . 1 . 2]" 1
711 1 88 GLY H 1 89 GLU H . . 4.500 4.361 4.287 4.443 . 0 0 "[ . 1 . 2]" 1
712 1 88 GLY H 1 89 GLU HB2 . . 5.800 5.833 5.687 5.920 0.120 16 0 "[ . 1 . 2]" 1
713 1 88 GLY HA3 1 89 GLU H . . 3.540 2.397 2.308 2.483 . 0 0 "[ . 1 . 2]" 1
714 1 88 GLY H 1 90 VAL MG2 . . 5.500 5.526 5.316 5.593 0.093 12 0 "[ . 1 . 2]" 1
715 1 88 GLY H 1 131 LYS HB3 . . 6.000 5.159 4.977 5.624 . 0 0 "[ . 1 . 2]" 1
716 1 88 GLY HA2 1 131 LYS HD2 . . 5.500 4.808 3.438 5.361 . 0 0 "[ . 1 . 2]" 1
717 1 89 GLU H 1 89 GLU HB3 . . 4.000 3.068 2.947 3.260 . 0 0 "[ . 1 . 2]" 1
718 1 89 GLU H 1 90 VAL H . . 4.300 4.334 3.946 4.421 0.121 18 0 "[ . 1 . 2]" 1
719 1 89 GLU HA 1 90 VAL H . . 2.600 2.294 2.149 2.367 . 0 0 "[ . 1 . 2]" 1
720 1 89 GLU HB3 1 90 VAL H . . 4.000 3.559 3.232 4.055 0.055 9 0 "[ . 1 . 2]" 1
721 1 89 GLU H 1 129 VAL HA . . 4.700 4.558 4.470 4.654 . 0 0 "[ . 1 . 2]" 1
722 1 89 GLU HB2 1 129 VAL MG1 . . 5.620 5.150 4.774 5.345 . 0 0 "[ . 1 . 2]" 1
723 1 89 GLU H 1 130 LYS H . . 3.700 3.807 3.761 3.865 0.165 17 0 "[ . 1 . 2]" 1
724 1 89 GLU H 1 132 VAL H . . 5.200 5.264 5.212 5.319 0.119 11 0 "[ . 1 . 2]" 1
725 1 90 VAL H 1 90 VAL HB . . 4.000 2.841 2.517 2.942 . 0 0 "[ . 1 . 2]" 1
726 1 90 VAL H 1 90 VAL MG1 . . 4.000 3.932 3.799 3.974 . 0 0 "[ . 1 . 2]" 1
727 1 90 VAL H 1 90 VAL MG2 . . 3.700 2.906 2.644 3.029 . 0 0 "[ . 1 . 2]" 1
728 1 90 VAL H 1 91 GLY H . . 4.420 4.389 4.319 4.554 0.134 4 0 "[ . 1 . 2]" 1
729 1 90 VAL HA 1 91 GLY H . . 2.200 2.240 2.206 2.256 0.056 11 0 "[ . 1 . 2]" 1
730 1 90 VAL HB 1 91 GLY H . . 4.000 3.863 3.810 3.929 . 0 0 "[ . 1 . 2]" 1
731 1 90 VAL MG2 1 91 GLY H . . 4.030 3.959 3.879 4.035 0.005 18 0 "[ . 1 . 2]" 1
732 1 90 VAL MG1 1 92 ARG H . . 6.000 5.106 5.015 5.198 . 0 0 "[ . 1 . 2]" 1
733 1 90 VAL HB 1 127 ASP HB3 . . 4.810 4.548 4.224 4.832 0.022 11 0 "[ . 1 . 2]" 1
734 1 90 VAL MG1 1 128 GLU H . . 3.600 2.714 2.577 2.840 . 0 0 "[ . 1 . 2]" 1
735 1 90 VAL HA 1 129 VAL HA . . 2.300 2.282 2.049 2.359 0.059 8 0 "[ . 1 . 2]" 1
736 1 90 VAL HA 1 129 VAL MG1 . . 4.900 3.779 3.601 3.896 . 0 0 "[ . 1 . 2]" 1
737 1 90 VAL HA 1 129 VAL MG2 . . 4.900 4.134 3.974 4.198 . 0 0 "[ . 1 . 2]" 1
738 1 90 VAL MG2 1 129 VAL MG2 . . 4.110 2.362 2.216 2.492 . 0 0 "[ . 1 . 2]" 1
739 1 90 VAL HB 1 130 LYS H . . 5.000 5.056 5.022 5.085 0.085 20 0 "[ . 1 . 2]" 1
740 1 90 VAL H 1 131 LYS HE2 . . 6.000 5.903 5.714 6.041 0.041 9 0 "[ . 1 . 2]" 1
741 1 90 VAL HA 1 131 LYS H . . 4.300 4.038 3.935 4.082 . 0 0 "[ . 1 . 2]" 1
742 1 90 VAL MG2 1 133 PRO HD3 . . 6.000 6.071 6.006 6.139 0.139 5 0 "[ . 1 . 2]" 1
743 1 91 GLY HA2 1 92 ARG H . . 3.700 2.641 2.483 2.690 . 0 0 "[ . 1 . 2]" 1
744 1 91 GLY HA3 1 92 ARG H . . 3.700 2.490 2.443 2.646 . 0 0 "[ . 1 . 2]" 1
745 1 91 GLY H 1 127 ASP HA . . 4.330 4.461 4.435 4.479 0.149 8 0 "[ . 1 . 2]" 1
746 1 91 GLY H 1 127 ASP HB3 . . 4.000 3.889 3.784 4.016 0.016 16 0 "[ . 1 . 2]" 1
747 1 91 GLY H 1 128 GLU H . . 3.000 2.998 2.910 3.037 0.037 14 0 "[ . 1 . 2]" 1
748 1 91 GLY H 1 129 VAL MG2 . . 5.400 5.350 5.192 5.421 0.021 12 0 "[ . 1 . 2]" 1
749 1 91 GLY H 1 130 LYS HG2 . . 2.560 2.508 2.348 2.564 0.004 20 0 "[ . 1 . 2]" 1
750 1 91 GLY H 1 130 LYS HG3 . . 3.400 2.854 2.484 3.120 . 0 0 "[ . 1 . 2]" 1
751 1 92 ARG H 1 92 ARG HB2 . . 3.500 3.507 3.330 3.561 0.061 17 0 "[ . 1 . 2]" 1
752 1 92 ARG H 1 92 ARG HB3 . . 4.000 3.011 2.199 3.275 . 0 0 "[ . 1 . 2]" 1
753 1 92 ARG H 1 92 ARG HD3 . . 4.000 3.418 3.175 4.120 0.120 10 0 "[ . 1 . 2]" 1
754 1 92 ARG HA 1 92 ARG HD2 . . 4.090 4.152 4.122 4.211 0.121 11 0 "[ . 1 . 2]" 1
755 1 92 ARG HB3 1 92 ARG HD2 . . 4.000 3.466 2.093 3.926 . 0 0 "[ . 1 . 2]" 1
756 1 92 ARG HA 1 93 ALA H . . 2.200 2.231 2.211 2.248 0.048 17 0 "[ . 1 . 2]" 1
757 1 92 ARG HB2 1 93 ALA H . . 3.500 3.118 2.917 3.617 0.117 11 0 "[ . 1 . 2]" 1
758 1 92 ARG HB3 1 93 ALA H . . 4.300 3.857 3.696 4.298 . 0 0 "[ . 1 . 2]" 1
759 1 92 ARG HB3 1 93 ALA MB . . 5.600 5.519 5.460 5.649 0.049 10 0 "[ . 1 . 2]" 1
760 1 92 ARG HD3 1 93 ALA H . . 4.080 4.073 3.806 4.164 0.084 14 0 "[ . 1 . 2]" 1
761 1 92 ARG H 1 127 ASP HA . . 4.600 4.556 4.396 4.655 0.055 20 0 "[ . 1 . 2]" 1
762 1 92 ARG HA 1 127 ASP HA . . 2.300 2.082 1.985 2.207 . 0 0 "[ . 1 . 2]" 1
763 1 92 ARG HB3 1 127 ASP HA . . 4.630 4.107 3.709 4.679 0.049 10 0 "[ . 1 . 2]" 1
764 1 92 ARG HA 1 128 GLU H . . 3.740 3.592 3.391 3.743 0.003 9 0 "[ . 1 . 2]" 1
765 1 92 ARG H 1 130 LYS HE3 . . 3.800 3.691 3.182 3.802 0.002 10 0 "[ . 1 . 2]" 1
766 1 92 ARG H 1 130 LYS HG3 . . 4.800 4.758 4.433 4.841 0.041 15 0 "[ . 1 . 2]" 1
767 1 92 ARG HA 1 130 LYS QZ . . 5.000 4.862 4.660 4.994 . 0 0 "[ . 1 . 2]" 1
768 1 93 ALA H 1 94 GLU H . . 4.400 2.305 2.202 2.328 . 0 0 "[ . 1 . 2]" 1
769 1 93 ALA MB 1 94 GLU H . . 4.000 2.209 2.105 2.360 . 0 0 "[ . 1 . 2]" 1
770 1 93 ALA H 1 125 HIS HB3 . . 4.500 4.528 4.485 4.591 0.091 9 0 "[ . 1 . 2]" 1
771 1 93 ALA MB 1 125 HIS HA . . 6.000 4.374 4.119 4.765 . 0 0 "[ . 1 . 2]" 1
772 1 93 ALA H 1 127 ASP HA . . 3.200 3.199 3.159 3.231 0.031 4 0 "[ . 1 . 2]" 1
773 1 93 ALA MB 1 127 ASP HA . . 6.000 4.108 3.921 4.283 . 0 0 "[ . 1 . 2]" 1
774 1 94 GLU H 1 94 GLU HB2 . . 3.000 2.947 2.922 2.963 . 0 0 "[ . 1 . 2]" 1
775 1 94 GLU H 1 94 GLU HB3 . . 3.900 3.906 3.888 3.915 0.015 20 0 "[ . 1 . 2]" 1
776 1 94 GLU H 1 95 ALA H . . 3.900 3.906 3.889 3.929 0.029 18 0 "[ . 1 . 2]" 1
777 1 94 GLU HA 1 95 ALA H . . 3.640 2.171 2.169 2.173 . 0 0 "[ . 1 . 2]" 1
778 1 94 GLU HB2 1 95 ALA H . . 4.200 4.296 4.290 4.303 0.103 9 0 "[ . 1 . 2]" 1
779 1 94 GLU HB2 1 95 ALA MB . . 5.400 5.479 5.472 5.485 0.085 9 0 "[ . 1 . 2]" 1
780 1 94 GLU HB3 1 95 ALA H . . 4.000 3.813 3.805 3.822 . 0 0 "[ . 1 . 2]" 1
781 1 94 GLU HB3 1 95 ALA MB . . 5.000 5.163 5.152 5.173 0.173 15 0 "[ . 1 . 2]" 1
782 1 94 GLU H 1 125 HIS HA . . 5.530 4.523 4.439 4.615 . 0 0 "[ . 1 . 2]" 1
783 1 94 GLU HB2 1 144 ILE MG . . 5.750 5.000 4.437 5.476 . 0 0 "[ . 1 . 2]" 1
784 1 95 ALA H 1 96 GLU H . . 4.200 2.590 2.587 2.596 . 0 0 "[ . 1 . 2]" 1
785 1 95 ALA HA 1 96 GLU H . . 4.170 3.367 3.361 3.370 . 0 0 "[ . 1 . 2]" 1
786 1 95 ALA MB 1 96 GLU H . . 4.560 3.160 3.155 3.170 . 0 0 "[ . 1 . 2]" 1
787 1 95 ALA MB 1 96 GLU HA . . 5.550 3.971 3.965 3.980 . 0 0 "[ . 1 . 2]" 1
788 1 95 ALA H 1 126 LYS HA . . 4.700 4.414 4.107 4.529 . 0 0 "[ . 1 . 2]" 1
789 1 95 ALA HA 1 126 LYS HA . . 2.500 2.388 2.092 2.500 0.000 17 0 "[ . 1 . 2]" 1
790 1 95 ALA MB 1 126 LYS HG3 . . 4.500 4.379 3.672 4.512 0.012 20 0 "[ . 1 . 2]" 1
791 1 96 GLU H 1 96 GLU HB3 . . 4.000 3.566 3.457 3.589 . 0 0 "[ . 1 . 2]" 1
792 1 96 GLU H 1 97 GLU H . . 4.600 4.641 4.631 4.648 0.048 1 0 "[ . 1 . 2]" 1
793 1 96 GLU HA 1 97 GLU H . . 4.560 2.411 2.264 2.472 . 0 0 "[ . 1 . 2]" 1
794 1 96 GLU HB3 1 97 GLU H . . 3.200 2.437 2.271 2.881 . 0 0 "[ . 1 . 2]" 1
795 1 96 GLU HB3 1 97 GLU HA . . 4.500 4.448 4.325 4.500 . 0 0 "[ . 1 . 2]" 1
796 1 96 GLU HB2 1 125 HIS H . . 5.550 5.392 5.098 5.546 . 0 0 "[ . 1 . 2]" 1
797 1 97 GLU H 1 97 GLU HB3 . . 3.000 2.755 2.476 2.992 . 0 0 "[ . 1 . 2]" 1
798 1 97 GLU H 1 98 TYR H . . 4.100 2.070 2.005 2.513 . 0 0 "[ . 1 . 2]" 1
799 1 97 GLU HA 1 98 TYR H . . 3.420 3.491 3.467 3.568 0.148 1 0 "[ . 1 . 2]" 1
800 1 97 GLU HB3 1 98 TYR H . . 4.000 2.883 2.014 3.999 . 0 0 "[ . 1 . 2]" 1
801 1 98 TYR H 1 98 TYR HB2 . . 3.500 2.835 2.691 3.581 0.081 9 0 "[ . 1 . 2]" 1
802 1 98 TYR H 1 98 TYR QD . . 4.500 2.928 2.356 4.170 . 0 0 "[ . 1 . 2]" 1
803 1 98 TYR HB2 1 99 ALA H . . 4.300 4.297 3.902 4.384 0.084 1 0 "[ . 1 . 2]" 1
804 1 98 TYR QD 1 99 ALA H . . 5.000 4.550 3.272 4.847 . 0 0 "[ . 1 . 2]" 1
805 1 99 ALA H 1 100 LEU H . . 4.490 4.052 4.017 4.398 . 0 0 "[ . 1 . 2]" 1
806 1 99 ALA MB 1 100 LEU H . . 4.000 3.237 2.509 3.306 . 0 0 "[ . 1 . 2]" 1
807 1 99 ALA MB 1 144 ILE HB . . 6.000 4.828 4.347 5.257 . 0 0 "[ . 1 . 2]" 1
808 1 99 ALA MB 1 144 ILE MG . . 5.500 3.503 3.151 4.230 . 0 0 "[ . 1 . 2]" 1
809 1 100 LEU H 1 100 LEU HG . . 3.700 2.681 1.939 3.809 0.109 20 0 "[ . 1 . 2]" 1
810 1 100 LEU H 1 100 LEU HB2 . . 3.600 2.874 2.181 3.603 0.003 9 0 "[ . 1 . 2]" 1
811 1 100 LEU H 1 101 THR H . . 4.670 4.613 4.462 4.635 . 0 0 "[ . 1 . 2]" 1
812 1 100 LEU HA 1 101 THR H . . 2.300 2.260 2.138 2.275 . 0 0 "[ . 1 . 2]" 1
813 1 100 LEU HA 1 101 THR MG . . 5.420 5.406 5.336 5.424 0.004 14 0 "[ . 1 . 2]" 1
814 1 100 LEU HB2 1 101 THR H . . 4.200 3.507 2.748 4.203 0.003 10 0 "[ . 1 . 2]" 1
815 1 101 THR H 1 101 THR HA . . 3.000 2.921 2.906 2.948 . 0 0 "[ . 1 . 2]" 1
816 1 101 THR H 1 101 THR HB . . 3.000 2.931 2.880 3.040 0.040 1 0 "[ . 1 . 2]" 1
817 1 101 THR HA 1 102 LYS H . . 2.300 2.322 2.278 2.343 0.043 20 0 "[ . 1 . 2]" 1
818 1 101 THR HA 1 102 LYS HA . . 4.950 4.498 4.475 4.512 . 0 0 "[ . 1 . 2]" 1
819 1 101 THR HB 1 102 LYS HA . . 5.370 4.876 4.725 4.930 . 0 0 "[ . 1 . 2]" 1
820 1 101 THR MG 1 120 ASN HA . . 5.790 5.507 5.316 5.793 0.003 18 0 "[ . 1 . 2]" 1
821 1 101 THR H 1 121 ALA H . . 3.300 3.332 3.303 3.394 0.094 6 0 "[ . 1 . 2]" 1
822 1 101 THR HB 1 121 ALA MB . . 5.510 2.775 2.436 3.355 . 0 0 "[ . 1 . 2]" 1
823 1 101 THR MG 1 121 ALA H . . 5.500 4.165 3.930 4.578 . 0 0 "[ . 1 . 2]" 1
824 1 101 THR MG 1 121 ALA MB . . 5.180 3.155 2.752 3.974 . 0 0 "[ . 1 . 2]" 1
825 1 101 THR HB 1 123 ALA MB . . 5.220 3.409 2.647 3.792 . 0 0 "[ . 1 . 2]" 1
826 1 101 THR HG1 1 123 ALA H . . 4.000 2.827 2.311 4.001 0.001 5 0 "[ . 1 . 2]" 1
827 1 101 THR MG 1 142 SER H . . 5.200 4.281 4.186 4.458 . 0 0 "[ . 1 . 2]" 1
828 1 101 THR MG 1 144 ILE H . . 4.750 3.396 3.113 3.551 . 0 0 "[ . 1 . 2]" 1
829 1 101 THR MG 1 144 ILE HA . . 6.000 5.122 4.722 5.333 . 0 0 "[ . 1 . 2]" 1
830 1 102 LYS H 1 102 LYS HA . . 3.000 2.892 2.882 2.904 . 0 0 "[ . 1 . 2]" 1
831 1 102 LYS H 1 102 LYS HB2 . . 3.800 3.629 3.620 3.644 . 0 0 "[ . 1 . 2]" 1
832 1 102 LYS H 1 102 LYS HG2 . . 2.200 2.265 2.245 2.289 0.089 14 0 "[ . 1 . 2]" 1
833 1 102 LYS H 1 102 LYS HG3 . . 3.300 3.323 3.295 3.372 0.072 9 0 "[ . 1 . 2]" 1
834 1 102 LYS H 1 102 LYS HE2 . . 5.000 5.047 5.011 5.119 0.119 7 0 "[ . 1 . 2]" 1
835 1 102 LYS H 1 103 VAL H . . 4.600 4.589 4.573 4.601 0.001 9 0 "[ . 1 . 2]" 1
836 1 102 LYS HA 1 103 VAL HA . . 5.290 4.408 4.398 4.427 . 0 0 "[ . 1 . 2]" 1
837 1 102 LYS HB2 1 103 VAL H . . 3.000 2.945 2.840 3.004 0.004 13 0 "[ . 1 . 2]" 1
838 1 102 LYS HB3 1 103 VAL MG2 . . 5.660 5.156 5.076 5.205 . 0 0 "[ . 1 . 2]" 1
839 1 102 LYS HE2 1 103 VAL H . . 4.500 4.143 3.836 4.541 0.041 1 0 "[ . 1 . 2]" 1
840 1 102 LYS HG3 1 103 VAL H . . 4.000 3.829 3.737 3.883 . 0 0 "[ . 1 . 2]" 1
841 1 102 LYS QZ 1 103 VAL MG2 . . 6.000 5.672 4.727 6.099 0.099 16 0 "[ . 1 . 2]" 1
842 1 102 LYS HE2 1 118 GLU HB3 . . 4.000 3.799 3.544 4.010 0.010 9 0 "[ . 1 . 2]" 1
843 1 102 LYS HA 1 119 PHE H . . 4.500 4.451 4.321 4.529 0.029 17 0 "[ . 1 . 2]" 1
844 1 102 LYS HA 1 119 PHE HA . . 5.200 5.262 5.151 5.323 0.123 14 0 "[ . 1 . 2]" 1
845 1 102 LYS HG3 1 119 PHE H . . 5.500 5.524 5.494 5.614 0.114 8 0 "[ . 1 . 2]" 1
846 1 102 LYS HA 1 120 ASN HA . . 2.300 1.943 1.901 1.963 . 0 0 "[ . 1 . 2]" 1
847 1 102 LYS HA 1 121 ALA H . . 2.710 2.294 1.968 2.484 . 0 0 "[ . 1 . 2]" 1
848 1 102 LYS HG3 1 121 ALA H . . 6.000 5.865 5.545 6.040 0.040 11 0 "[ . 1 . 2]" 1
849 1 102 LYS HA 1 142 SER HA . . 5.500 5.286 5.228 5.381 . 0 0 "[ . 1 . 2]" 1
850 1 102 LYS HA 1 142 SER HB2 . . 4.500 4.356 4.288 4.524 0.024 14 0 "[ . 1 . 2]" 1
851 1 102 LYS HA 1 142 SER HB3 . . 6.000 6.051 5.991 6.104 0.104 20 0 "[ . 1 . 2]" 1
852 1 102 LYS HG3 1 142 SER HA . . 4.000 4.135 4.068 4.157 0.157 4 0 "[ . 1 . 2]" 1
853 1 103 VAL H 1 103 VAL HA . . 3.000 2.948 2.942 2.950 . 0 0 "[ . 1 . 2]" 1
854 1 103 VAL H 1 103 VAL MG2 . . 3.000 2.274 2.199 2.336 . 0 0 "[ . 1 . 2]" 1
855 1 103 VAL H 1 104 TYR H . . 4.500 4.344 4.237 4.383 . 0 0 "[ . 1 . 2]" 1
856 1 103 VAL HA 1 104 TYR H . . 2.200 2.154 2.141 2.174 . 0 0 "[ . 1 . 2]" 1
857 1 103 VAL MG2 1 104 TYR H . . 5.420 4.328 4.301 4.377 . 0 0 "[ . 1 . 2]" 1
858 1 103 VAL H 1 119 PHE H . . 3.200 2.880 2.781 3.009 . 0 0 "[ . 1 . 2]" 1
859 1 103 VAL H 1 119 PHE HA . . 4.800 4.833 4.790 4.920 0.120 17 0 "[ . 1 . 2]" 1
860 1 103 VAL MG2 1 119 PHE H . . 4.000 4.121 4.083 4.161 0.161 17 0 "[ . 1 . 2]" 1
861 1 103 VAL H 1 120 ASN HA . . 3.600 3.559 3.474 3.616 0.016 8 0 "[ . 1 . 2]" 1
862 1 103 VAL MG2 1 121 ALA H . . 5.500 3.591 3.453 3.843 . 0 0 "[ . 1 . 2]" 1
863 1 103 VAL MG2 1 121 ALA MB . . 5.940 2.469 2.207 2.849 . 0 0 "[ . 1 . 2]" 1
864 1 103 VAL MG1 1 140 ALA MB . . 4.000 2.230 1.972 2.623 . 0 0 "[ . 1 . 2]" 1
865 1 103 VAL MG1 1 141 HIS H . . 5.000 2.533 2.239 2.780 . 0 0 "[ . 1 . 2]" 1
866 1 103 VAL HA 1 142 SER HA . . 3.000 2.084 1.988 2.304 . 0 0 "[ . 1 . 2]" 1
867 1 103 VAL MG1 1 142 SER H . . 5.000 3.374 3.177 3.596 . 0 0 "[ . 1 . 2]" 1
868 1 103 VAL MG1 1 162 PHE QE . . 5.900 5.402 4.687 5.903 0.003 15 0 "[ . 1 . 2]" 1
869 1 104 TYR H 1 104 TYR HB3 . . 4.000 3.553 2.338 3.633 . 0 0 "[ . 1 . 2]" 1
870 1 104 TYR H 1 104 TYR HA . . 3.000 2.875 2.844 2.893 . 0 0 "[ . 1 . 2]" 1
871 1 104 TYR H 1 104 TYR HB2 . . 3.000 2.598 2.454 3.568 0.568 8 1 "[ . + 1 . 2]" 1
872 1 104 TYR H 1 104 TYR QE . . 4.750 4.035 3.915 4.265 . 0 0 "[ . 1 . 2]" 1
873 1 104 TYR H 1 105 VAL H . . 4.500 4.453 4.422 4.485 . 0 0 "[ . 1 . 2]" 1
874 1 104 TYR HA 1 118 GLU H . . 5.000 4.677 4.514 5.035 0.035 14 0 "[ . 1 . 2]" 1
875 1 104 TYR HA 1 118 GLU HA . . 2.500 2.480 2.312 2.670 0.170 14 0 "[ . 1 . 2]" 1
876 1 104 TYR HA 1 119 PHE H . . 4.000 4.085 4.049 4.156 0.156 14 0 "[ . 1 . 2]" 1
877 1 104 TYR H 1 141 HIS H . . 4.750 4.656 4.488 4.810 0.060 8 0 "[ . 1 . 2]" 1
878 1 104 TYR H 1 142 SER H . . 6.000 5.648 5.446 5.881 . 0 0 "[ . 1 . 2]" 1
879 1 105 VAL HA 1 106 ASP H . . 2.200 2.223 2.195 2.244 0.044 17 0 "[ . 1 . 2]" 1
880 1 105 VAL MG1 1 106 ASP H . . 4.200 4.207 4.196 4.256 0.056 8 0 "[ . 1 . 2]" 1
881 1 105 VAL MG2 1 107 LYS HB3 . . 5.560 5.332 5.203 5.535 . 0 0 "[ . 1 . 2]" 1
882 1 105 VAL H 1 117 ARG HA . . 4.720 4.720 4.304 4.809 0.089 14 0 "[ . 1 . 2]" 1
883 1 105 VAL HA 1 117 ARG HD2 . . 5.500 5.424 5.055 5.556 0.056 20 0 "[ . 1 . 2]" 1
884 1 105 VAL MG2 1 117 ARG HA . . 5.500 3.786 3.627 3.933 . 0 0 "[ . 1 . 2]" 1
885 1 105 VAL MG2 1 117 ARG HB3 . . 4.000 2.868 2.626 3.400 . 0 0 "[ . 1 . 2]" 1
886 1 105 VAL MG2 1 117 ARG HG2 . . 4.000 3.078 2.799 4.107 0.107 14 0 "[ . 1 . 2]" 1
887 1 105 VAL H 1 118 GLU HA . . 4.400 4.445 4.323 4.571 0.171 9 0 "[ . 1 . 2]" 1
888 1 106 ASP H 1 106 ASP HB2 . . 4.300 3.878 3.859 3.915 . 0 0 "[ . 1 . 2]" 1
889 1 106 ASP H 1 107 LYS H . . 4.500 4.035 3.935 4.141 . 0 0 "[ . 1 . 2]" 1
890 1 106 ASP H 1 107 LYS HB3 . . 4.000 3.825 3.761 3.968 . 0 0 "[ . 1 . 2]" 1
891 1 106 ASP HB2 1 107 LYS H . . 3.500 3.412 3.225 3.566 0.066 18 0 "[ . 1 . 2]" 1
892 1 106 ASP HB2 1 107 LYS HB3 . . 5.500 5.081 5.006 5.281 . 0 0 "[ . 1 . 2]" 1
893 1 106 ASP HB3 1 107 LYS H . . 4.200 4.063 3.968 4.134 . 0 0 "[ . 1 . 2]" 1
894 1 106 ASP H 1 117 ARG HA . . 5.700 3.447 3.227 3.766 . 0 0 "[ . 1 . 2]" 1
895 1 106 ASP H 1 140 ALA HA . . 5.500 5.072 4.697 5.346 . 0 0 "[ . 1 . 2]" 1
896 1 106 ASP H 1 140 ALA MB . . 5.500 5.174 4.374 5.576 0.076 9 0 "[ . 1 . 2]" 1
897 1 106 ASP HB2 1 140 ALA H . . 5.000 4.601 4.362 4.875 . 0 0 "[ . 1 . 2]" 1
898 1 106 ASP HB2 1 140 ALA MB . . 5.200 3.867 3.281 4.560 . 0 0 "[ . 1 . 2]" 1
899 1 106 ASP HA 1 141 HIS H . . 5.500 5.356 5.229 5.510 0.010 6 0 "[ . 1 . 2]" 1
900 1 106 ASP HB2 1 141 HIS H . . 3.300 2.976 2.826 3.156 . 0 0 "[ . 1 . 2]" 1
901 1 106 ASP HB3 1 141 HIS H . . 4.300 3.602 3.382 3.881 . 0 0 "[ . 1 . 2]" 1
902 1 107 LYS H 1 107 LYS HG2 . . 3.000 2.886 2.808 2.925 . 0 0 "[ . 1 . 2]" 1
903 1 107 LYS H 1 107 LYS HG3 . . 4.500 4.401 4.332 4.435 . 0 0 "[ . 1 . 2]" 1
904 1 107 LYS H 1 107 LYS HA . . 3.000 2.821 2.810 2.857 . 0 0 "[ . 1 . 2]" 1
905 1 107 LYS HA 1 107 LYS HB3 . . 3.000 2.538 2.535 2.542 . 0 0 "[ . 1 . 2]" 1
906 1 107 LYS HA 1 107 LYS HG3 . . 4.000 4.010 4.004 4.015 0.015 8 0 "[ . 1 . 2]" 1
907 1 107 LYS H 1 107 LYS HB3 . . 3.500 3.401 3.335 3.418 . 0 0 "[ . 1 . 2]" 1
908 1 107 LYS HB3 1 107 LYS HG3 . . 3.050 2.851 2.844 2.858 . 0 0 "[ . 1 . 2]" 1
909 1 107 LYS H 1 108 GLU H . . 4.300 4.259 4.250 4.293 . 0 0 "[ . 1 . 2]" 1
910 1 107 LYS HA 1 108 GLU H . . 2.500 2.282 2.280 2.286 . 0 0 "[ . 1 . 2]" 1
911 1 107 LYS HG2 1 108 GLU H . . 4.100 4.022 3.995 4.039 . 0 0 "[ . 1 . 2]" 1
912 1 107 LYS HG3 1 108 GLU H . . 4.000 4.007 3.990 4.015 0.015 13 0 "[ . 1 . 2]" 1
913 1 107 LYS QZ 1 108 GLU H . . 6.000 5.697 5.193 5.977 . 0 0 "[ . 1 . 2]" 1
914 1 107 LYS HB2 1 109 ASN HA . . 4.300 4.024 4.016 4.062 . 0 0 "[ . 1 . 2]" 1
915 1 107 LYS HG2 1 109 ASN H . . 2.800 2.863 2.825 2.895 0.095 20 0 "[ . 1 . 2]" 1
916 1 107 LYS H 1 140 ALA HA . . 5.100 4.955 4.720 5.172 0.072 14 0 "[ . 1 . 2]" 1
917 1 108 GLU H 1 108 GLU HA . . 3.000 2.900 2.871 2.910 . 0 0 "[ . 1 . 2]" 1
918 1 108 GLU H 1 108 GLU HB2 . . 2.250 2.273 2.246 2.299 0.049 6 0 "[ . 1 . 2]" 1
919 1 108 GLU H 1 108 GLU HB3 . . 3.000 2.981 2.875 3.007 0.007 20 0 "[ . 1 . 2]" 1
920 1 108 GLU HA 1 108 GLU HB2 . . 3.000 2.724 2.664 2.739 . 0 0 "[ . 1 . 2]" 1
921 1 108 GLU HA 1 108 GLU HB3 . . 3.000 2.946 2.938 2.977 . 0 0 "[ . 1 . 2]" 1
922 1 108 GLU H 1 109 ASN H . . 4.100 2.513 2.480 2.536 . 0 0 "[ . 1 . 2]" 1
923 1 108 GLU H 1 109 ASN HB2 . . 5.500 5.288 5.231 5.386 . 0 0 "[ . 1 . 2]" 1
924 1 108 GLU HA 1 109 ASN H . . 3.200 3.217 3.192 3.293 0.093 17 0 "[ . 1 . 2]" 1
925 1 108 GLU HA 1 109 ASN HA . . 5.200 5.112 5.093 5.151 . 0 0 "[ . 1 . 2]" 1
926 1 108 GLU HB2 1 109 ASN H . . 4.100 4.094 4.039 4.127 0.027 18 0 "[ . 1 . 2]" 1
927 1 108 GLU HB3 1 109 ASN H . . 3.750 3.729 3.533 3.784 0.034 16 0 "[ . 1 . 2]" 1
928 1 108 GLU H 1 111 LEU HG . . 5.000 4.620 4.316 5.011 0.011 17 0 "[ . 1 . 2]" 1
929 1 108 GLU H 1 112 PHE H . . 5.000 4.115 3.617 4.759 . 0 0 "[ . 1 . 2]" 1
930 1 108 GLU H 1 112 PHE HB2 . . 4.500 3.011 2.317 3.712 . 0 0 "[ . 1 . 2]" 1
931 1 108 GLU HA 1 112 PHE HB2 . . 6.000 5.621 5.092 6.004 0.004 18 0 "[ . 1 . 2]" 1
932 1 108 GLU HA 1 139 LEU HB3 . . 4.000 3.863 3.611 4.022 0.022 5 0 "[ . 1 . 2]" 1
933 1 108 GLU HA 1 139 LEU MD1 . . 5.500 4.214 3.810 4.413 . 0 0 "[ . 1 . 2]" 1
934 1 108 GLU HA 1 139 LEU MD2 . . 4.500 3.419 3.232 4.175 . 0 0 "[ . 1 . 2]" 1
935 1 109 ASN H 1 109 ASN HA . . 2.500 2.277 2.274 2.280 . 0 0 "[ . 1 . 2]" 1
936 1 109 ASN H 1 109 ASN HB2 . . 3.200 3.002 2.963 3.074 . 0 0 "[ . 1 . 2]" 1
937 1 109 ASN H 1 109 ASN HB3 . . 3.750 3.700 3.621 3.744 . 0 0 "[ . 1 . 2]" 1
938 1 109 ASN HA 1 109 ASN HB2 . . 2.700 2.583 2.521 2.626 . 0 0 "[ . 1 . 2]" 1
939 1 109 ASN HB2 1 109 ASN HD21 . . 3.500 3.122 2.902 3.366 . 0 0 "[ . 1 . 2]" 1
940 1 109 ASN HB3 1 109 ASN HD21 . . 2.500 2.154 2.116 2.244 . 0 0 "[ . 1 . 2]" 1
941 1 109 ASN HB2 1 109 ASN HD22 . . 4.000 3.877 3.770 3.999 . 0 0 "[ . 1 . 2]" 1
942 1 109 ASN HB3 1 109 ASN HD22 . . 3.500 3.450 3.435 3.484 . 0 0 "[ . 1 . 2]" 1
943 1 109 ASN H 1 139 LEU MD2 . . 5.600 5.553 5.244 5.637 0.037 20 0 "[ . 1 . 2]" 1
944 1 110 ASP HB2 1 111 LEU H . . 3.800 3.273 2.799 3.579 . 0 0 "[ . 1 . 2]" 1
945 1 110 ASP HB3 1 111 LEU H . . 2.500 2.198 2.084 2.439 . 0 0 "[ . 1 . 2]" 1
946 1 111 LEU H 1 111 LEU HB3 . . 3.200 3.219 3.162 3.284 0.084 20 0 "[ . 1 . 2]" 1
947 1 111 LEU H 1 111 LEU HG . . 2.700 2.112 1.947 2.200 . 0 0 "[ . 1 . 2]" 1
948 1 111 LEU H 1 111 LEU MD2 . . 3.000 2.162 1.930 2.386 . 0 0 "[ . 1 . 2]" 1
949 1 111 LEU H 1 111 LEU HA . . 3.000 2.940 2.938 2.941 . 0 0 "[ . 1 . 2]" 1
950 1 111 LEU H 1 112 PHE H . . 2.200 2.033 2.018 2.088 . 0 0 "[ . 1 . 2]" 1
951 1 111 LEU HA 1 112 PHE H . . 3.500 3.411 3.331 3.458 . 0 0 "[ . 1 . 2]" 1
952 1 111 LEU HA 1 112 PHE HA . . 4.600 4.655 4.627 4.678 0.078 11 0 "[ . 1 . 2]" 1
953 1 111 LEU HB3 1 112 PHE H . . 4.450 4.327 4.235 4.435 . 0 0 "[ . 1 . 2]" 1
954 1 111 LEU HG 1 112 PHE H . . 3.000 2.622 2.393 2.930 . 0 0 "[ . 1 . 2]" 1
955 1 111 LEU MD1 1 112 PHE H . . 5.000 4.057 3.899 4.318 . 0 0 "[ . 1 . 2]" 1
956 1 111 LEU MD2 1 112 PHE H . . 4.400 3.653 3.452 3.921 . 0 0 "[ . 1 . 2]" 1
957 1 111 LEU HA 1 113 LYS H . . 3.500 3.357 3.262 3.460 . 0 0 "[ . 1 . 2]" 1
958 1 111 LEU HG 1 139 LEU MD1 . . 4.750 3.645 3.017 3.806 . 0 0 "[ . 1 . 2]" 1
959 1 111 LEU H 1 158 TYR QE . . 6.000 5.333 4.789 6.020 0.020 18 0 "[ . 1 . 2]" 1
960 1 111 LEU H 1 175 ILE HA . . 5.500 5.555 5.470 5.606 0.106 13 0 "[ . 1 . 2]" 1
961 1 111 LEU HA 1 175 ILE HA . . 4.200 3.987 3.871 4.107 . 0 0 "[ . 1 . 2]" 1
962 1 111 LEU HB2 1 175 ILE H . . 5.300 5.370 5.327 5.417 0.117 7 0 "[ . 1 . 2]" 1
963 1 111 LEU HB2 1 175 ILE HA . . 3.000 2.609 2.567 2.653 . 0 0 "[ . 1 . 2]" 1
964 1 111 LEU HB2 1 178 ASN HD21 . . 5.000 4.470 4.277 4.747 . 0 0 "[ . 1 . 2]" 1
965 1 111 LEU HB3 1 178 ASN HD21 . . 5.500 5.328 5.181 5.500 0.000 6 0 "[ . 1 . 2]" 1
966 1 112 PHE H 1 112 PHE HA . . 3.000 2.906 2.895 2.919 . 0 0 "[ . 1 . 2]" 1
967 1 112 PHE H 1 112 PHE HB2 . . 2.400 2.218 2.144 2.314 . 0 0 "[ . 1 . 2]" 1
968 1 112 PHE H 1 112 PHE HB3 . . 3.500 3.484 3.358 3.578 0.078 20 0 "[ . 1 . 2]" 1
969 1 112 PHE HA 1 112 PHE HB2 . . 3.000 2.970 2.913 3.007 0.007 15 0 "[ . 1 . 2]" 1
970 1 112 PHE HA 1 112 PHE HB3 . . 2.750 2.678 2.592 2.778 0.028 11 0 "[ . 1 . 2]" 1
971 1 112 PHE H 1 113 LYS H . . 2.730 2.753 2.685 2.797 0.067 19 0 "[ . 1 . 2]" 1
972 1 112 PHE H 1 113 LYS HA . . 4.900 4.743 4.707 4.768 . 0 0 "[ . 1 . 2]" 1
973 1 112 PHE HB2 1 113 LYS H . . 4.000 4.040 3.947 4.081 0.081 5 0 "[ . 1 . 2]" 1
974 1 112 PHE HB2 1 113 LYS HA . . 5.200 5.004 4.832 5.177 . 0 0 "[ . 1 . 2]" 1
975 1 112 PHE HB3 1 113 LYS H . . 4.300 4.248 4.092 4.354 0.054 20 0 "[ . 1 . 2]" 1
976 1 112 PHE H 1 115 VAL HB . . 6.000 5.914 5.699 6.017 0.017 11 0 "[ . 1 . 2]" 1
977 1 112 PHE HA 1 115 VAL MG1 . . 5.000 4.330 3.930 4.591 . 0 0 "[ . 1 . 2]" 1
978 1 112 PHE HB3 1 115 VAL H . . 5.000 5.013 4.953 5.073 0.073 17 0 "[ . 1 . 2]" 1
979 1 112 PHE HB3 1 115 VAL MG2 . . 4.750 3.938 3.302 4.623 . 0 0 "[ . 1 . 2]" 1
980 1 112 PHE H 1 139 LEU MD1 . . 5.000 4.940 4.001 5.042 0.042 14 0 "[ . 1 . 2]" 1
981 1 112 PHE QD 1 139 LEU HB3 . . 6.000 4.668 4.049 6.017 0.017 20 0 "[ . 1 . 2]" 1
982 1 112 PHE QE 1 140 ALA MB . . 4.750 2.610 1.928 3.218 . 0 0 "[ . 1 . 2]" 1
983 1 112 PHE H 1 175 ILE HA . . 5.000 4.875 4.706 5.025 0.025 14 0 "[ . 1 . 2]" 1
984 1 112 PHE HB2 1 175 ILE MD . . 5.000 4.865 3.795 5.039 0.039 5 0 "[ . 1 . 2]" 1
985 1 112 PHE H 1 178 ASN HB3 . . 5.000 4.971 4.830 5.057 0.057 14 0 "[ . 1 . 2]" 1
986 1 112 PHE H 1 178 ASN HD21 . . 4.600 4.252 4.175 4.335 . 0 0 "[ . 1 . 2]" 1
987 1 113 LYS H 1 113 LYS HA . . 3.000 2.825 2.794 2.856 . 0 0 "[ . 1 . 2]" 1
988 1 113 LYS H 1 113 LYS HB2 . . 2.500 2.448 2.292 2.512 0.012 4 0 "[ . 1 . 2]" 1
989 1 113 LYS H 1 113 LYS HB3 . . 3.600 3.585 3.549 3.602 0.002 20 0 "[ . 1 . 2]" 1
990 1 113 LYS H 1 113 LYS HE2 . . 5.000 4.709 4.261 4.999 . 0 0 "[ . 1 . 2]" 1
991 1 113 LYS H 1 113 LYS QZ . . 6.000 5.280 4.897 5.607 . 0 0 "[ . 1 . 2]" 1
992 1 113 LYS H 1 114 ASN H . . 4.600 4.632 4.619 4.641 0.041 11 0 "[ . 1 . 2]" 1
993 1 113 LYS HA 1 114 ASN H . . 2.500 2.376 2.370 2.387 . 0 0 "[ . 1 . 2]" 1
994 1 113 LYS HB2 1 114 ASN H . . 4.000 3.705 3.617 3.840 . 0 0 "[ . 1 . 2]" 1
995 1 113 LYS HB2 1 114 ASN HD21 . . 4.400 4.328 4.168 4.416 0.016 11 0 "[ . 1 . 2]" 1
996 1 113 LYS HB3 1 114 ASN H . . 2.500 2.501 2.473 2.515 0.015 7 0 "[ . 1 . 2]" 1
997 1 113 LYS H 1 115 VAL H . . 5.000 5.005 4.891 5.052 0.052 7 0 "[ . 1 . 2]" 1
998 1 113 LYS HB3 1 115 VAL H . . 4.750 4.687 4.649 4.703 . 0 0 "[ . 1 . 2]" 1
999 1 113 LYS HE2 1 115 VAL H . . 6.000 5.372 4.519 5.981 . 0 0 "[ . 1 . 2]" 1
1000 1 113 LYS H 1 178 ASN HD21 . . 2.500 2.221 2.157 2.309 . 0 0 "[ . 1 . 2]" 1
1001 1 113 LYS HA 1 178 ASN HD21 . . 4.300 4.364 4.340 4.396 0.096 16 0 "[ . 1 . 2]" 1
1002 1 113 LYS HA 1 178 ASN HD22 . . 4.000 4.051 3.999 4.101 0.101 5 0 "[ . 1 . 2]" 1
1003 1 113 LYS HB2 1 178 ASN HB2 . . 4.750 4.386 4.239 4.481 . 0 0 "[ . 1 . 2]" 1
1004 1 113 LYS HB2 1 178 ASN HB3 . . 4.030 3.621 3.396 3.770 . 0 0 "[ . 1 . 2]" 1
1005 1 114 ASN H 1 114 ASN HA . . 3.000 2.274 2.273 2.275 . 0 0 "[ . 1 . 2]" 1
1006 1 114 ASN HA 1 114 ASN HB2 . . 3.000 2.944 2.930 2.956 . 0 0 "[ . 1 . 2]" 1
1007 1 114 ASN HA 1 114 ASN HB3 . . 3.000 2.734 2.713 2.758 . 0 0 "[ . 1 . 2]" 1
1008 1 114 ASN H 1 114 ASN HB2 . . 3.500 3.241 3.218 3.259 . 0 0 "[ . 1 . 2]" 1
1009 1 114 ASN H 1 114 ASN HB3 . . 4.100 4.087 4.072 4.094 . 0 0 "[ . 1 . 2]" 1
1010 1 114 ASN HA 1 114 ASN HD21 . . 2.500 2.236 2.159 2.301 . 0 0 "[ . 1 . 2]" 1
1011 1 114 ASN HB2 1 114 ASN HD21 . . 3.000 2.789 2.776 2.802 . 0 0 "[ . 1 . 2]" 1
1012 1 114 ASN HB3 1 114 ASN HD22 . . 4.100 4.083 4.080 4.085 . 0 0 "[ . 1 . 2]" 1
1013 1 114 ASN H 1 115 VAL H . . 2.750 2.627 2.601 2.692 . 0 0 "[ . 1 . 2]" 1
1014 1 114 ASN H 1 115 VAL MG1 . . 6.000 5.727 5.289 6.028 0.028 14 0 "[ . 1 . 2]" 1
1015 1 114 ASN H 1 115 VAL MG2 . . 6.000 4.850 4.292 5.548 . 0 0 "[ . 1 . 2]" 1
1016 1 114 ASN HA 1 115 VAL H . . 3.000 3.023 3.013 3.043 0.043 14 0 "[ . 1 . 2]" 1
1017 1 114 ASN HD21 1 115 VAL H . . 4.500 4.559 4.536 4.580 0.080 7 0 "[ . 1 . 2]" 1
1018 1 114 ASN HD22 1 115 VAL H . . 6.000 6.110 6.093 6.125 0.125 19 0 "[ . 1 . 2]" 1
1019 1 114 ASN HB2 1 178 ASN HD21 . . 4.210 4.233 4.167 4.267 0.057 4 0 "[ . 1 . 2]" 1
1020 1 114 ASN HB3 1 178 ASN HD22 . . 4.000 4.089 4.073 4.119 0.119 14 0 "[ . 1 . 2]" 1
1021 1 115 VAL H 1 115 VAL HA . . 3.000 2.947 2.943 2.949 . 0 0 "[ . 1 . 2]" 1
1022 1 115 VAL H 1 115 VAL HB . . 3.000 2.630 2.432 2.761 . 0 0 "[ . 1 . 2]" 1
1023 1 115 VAL H 1 115 VAL MG1 . . 4.500 3.608 3.133 3.904 . 0 0 "[ . 1 . 2]" 1
1024 1 115 VAL HA 1 115 VAL MG2 . . 3.000 2.197 1.927 2.405 . 0 0 "[ . 1 . 2]" 1
1025 1 115 VAL MG1 1 117 ARG H . . 6.000 4.736 4.516 4.958 . 0 0 "[ . 1 . 2]" 1
1026 1 115 VAL MG1 1 118 GLU H . . 6.000 5.776 5.257 5.931 . 0 0 "[ . 1 . 2]" 1
1027 1 115 VAL HA 1 174 GLU HG2 . . 4.000 3.913 3.594 4.041 0.041 4 0 "[ . 1 . 2]" 1
1028 1 115 VAL MG2 1 178 ASN HD22 . . 4.750 4.213 3.625 4.816 0.066 10 0 "[ . 1 . 2]" 1
1029 1 116 PRO HA 1 117 ARG H . . 3.000 2.654 2.605 2.667 . 0 0 "[ . 1 . 2]" 1
1030 1 116 PRO HA 1 117 ARG HA . . 4.500 4.366 4.352 4.397 . 0 0 "[ . 1 . 2]" 1
1031 1 116 PRO HB2 1 117 ARG H . . 2.300 2.040 2.014 2.143 . 0 0 "[ . 1 . 2]" 1
1032 1 116 PRO HG2 1 117 ARG H . . 4.000 3.926 3.899 4.025 0.025 14 0 "[ . 1 . 2]" 1
1033 1 116 PRO HG3 1 117 ARG HD2 . . 6.000 6.055 5.701 6.159 0.159 20 0 "[ . 1 . 2]" 1
1034 1 116 PRO HG3 1 119 PHE HB3 . . 3.100 3.135 3.080 3.283 0.183 20 0 "[ . 1 . 2]" 1
1035 1 117 ARG H 1 117 ARG HA . . 3.000 2.915 2.901 2.938 . 0 0 "[ . 1 . 2]" 1
1036 1 117 ARG H 1 117 ARG HB3 . . 4.000 3.591 2.327 3.714 . 0 0 "[ . 1 . 2]" 1
1037 1 117 ARG H 1 117 ARG HD2 . . 2.000 1.915 1.869 1.937 . 0 0 "[ . 1 . 2]" 1
1038 1 117 ARG H 1 117 ARG HE . . 4.500 2.998 2.603 3.523 . 0 0 "[ . 1 . 2]" 1
1039 1 117 ARG HA 1 117 ARG HD3 . . 5.000 4.859 4.822 4.914 . 0 0 "[ . 1 . 2]" 1
1040 1 117 ARG H 1 118 GLU H . . 2.500 2.508 2.288 2.593 0.093 9 0 "[ . 1 . 2]" 1
1041 1 117 ARG HA 1 118 GLU H . . 3.580 3.568 3.509 3.572 . 0 0 "[ . 1 . 2]" 1
1042 1 117 ARG HB3 1 118 GLU H . . 4.000 3.541 3.444 3.621 . 0 0 "[ . 1 . 2]" 1
1043 1 117 ARG HD2 1 118 GLU H . . 3.000 2.837 1.943 3.029 0.029 9 0 "[ . 1 . 2]" 1
1044 1 117 ARG HE 1 118 GLU H . . 5.000 4.959 4.204 5.029 0.029 19 0 "[ . 1 . 2]" 1
1045 1 117 ARG H 1 119 PHE H . . 6.000 5.851 5.341 6.059 0.059 14 0 "[ . 1 . 2]" 1
1046 1 118 GLU H 1 118 GLU HA . . 3.000 2.937 2.933 2.947 . 0 0 "[ . 1 . 2]" 1
1047 1 118 GLU HA 1 118 GLU HB3 . . 2.500 2.421 2.375 2.529 0.029 14 0 "[ . 1 . 2]" 1
1048 1 118 GLU H 1 118 GLU HB3 . . 4.000 3.710 3.686 3.769 . 0 0 "[ . 1 . 2]" 1
1049 1 118 GLU H 1 119 PHE H . . 4.300 4.257 4.055 4.314 0.014 7 0 "[ . 1 . 2]" 1
1050 1 118 GLU H 1 119 PHE HB3 . . 5.000 4.855 4.608 5.031 0.031 20 0 "[ . 1 . 2]" 1
1051 1 118 GLU HA 1 119 PHE H . . 2.200 2.150 2.141 2.188 . 0 0 "[ . 1 . 2]" 1
1052 1 118 GLU HB2 1 119 PHE H . . 4.350 4.312 4.250 4.412 0.062 14 0 "[ . 1 . 2]" 1
1053 1 118 GLU HB3 1 119 PHE H . . 4.000 3.651 3.571 3.870 . 0 0 "[ . 1 . 2]" 1
1054 1 119 PHE H 1 119 PHE HA . . 3.000 2.907 2.901 2.919 . 0 0 "[ . 1 . 2]" 1
1055 1 119 PHE H 1 119 PHE HB3 . . 3.500 3.335 2.731 3.490 . 0 0 "[ . 1 . 2]" 1
1056 1 119 PHE H 1 119 PHE QD . . 4.000 3.117 2.737 4.288 0.288 17 0 "[ . 1 . 2]" 1
1057 1 119 PHE H 1 120 ASN H . . 4.300 4.354 4.348 4.375 0.075 13 0 "[ . 1 . 2]" 1
1058 1 119 PHE HB3 1 120 ASN H . . 4.000 3.906 3.825 4.079 0.079 20 0 "[ . 1 . 2]" 1
1059 1 119 PHE QD 1 120 ASN H . . 4.750 3.684 2.474 3.996 . 0 0 "[ . 1 . 2]" 1
1060 1 120 ASN H 1 120 ASN HA . . 3.000 2.901 2.874 2.918 . 0 0 "[ . 1 . 2]" 1
1061 1 120 ASN H 1 120 ASN HB2 . . 3.600 3.306 2.347 3.606 0.006 15 0 "[ . 1 . 2]" 1
1062 1 120 ASN H 1 120 ASN HB3 . . 3.000 2.760 2.283 2.983 . 0 0 "[ . 1 . 2]" 1
1063 1 120 ASN HA 1 120 ASN HB2 . . 3.000 2.515 2.340 2.719 . 0 0 "[ . 1 . 2]" 1
1064 1 120 ASN HA 1 121 ALA H . . 2.200 2.145 2.139 2.180 . 0 0 "[ . 1 . 2]" 1
1065 1 120 ASN HB3 1 121 ALA H . . 4.500 4.192 3.908 4.393 . 0 0 "[ . 1 . 2]" 1
1066 1 121 ALA H 1 121 ALA HA . . 3.000 2.946 2.936 2.949 . 0 0 "[ . 1 . 2]" 1
1067 1 121 ALA HA 1 172 GLY H . . 5.700 5.746 5.719 5.775 0.075 17 0 "[ . 1 . 2]" 1
1068 1 122 TRP HB3 1 123 ALA MB . . 5.740 4.855 4.572 5.084 . 0 0 "[ . 1 . 2]" 1
1069 1 123 ALA H 1 123 ALA MB . . 3.300 2.692 2.567 2.885 . 0 0 "[ . 1 . 2]" 1
1070 1 123 ALA MB 1 124 SER H . . 3.000 1.973 1.873 3.011 0.011 1 0 "[ . 1 . 2]" 1
1071 1 123 ALA H 1 125 HIS H . . 6.000 6.081 6.055 6.119 0.119 1 0 "[ . 1 . 2]" 1
1072 1 123 ALA HA 1 162 PHE HA . . 3.500 3.559 3.514 3.640 0.140 11 0 "[ . 1 . 2]" 1
1073 1 123 ALA MB 1 162 PHE HA . . 3.000 2.009 1.879 3.015 0.015 1 0 "[ . 1 . 2]" 1
1074 1 124 SER H 1 162 PHE HA . . 4.200 3.052 2.578 3.720 . 0 0 "[ . 1 . 2]" 1
1075 1 125 HIS H 1 125 HIS HB3 . . 3.750 3.556 3.273 3.639 . 0 0 "[ . 1 . 2]" 1
1076 1 125 HIS H 1 126 LYS HB2 . . 5.000 4.842 4.736 5.024 0.024 1 0 "[ . 1 . 2]" 1
1077 1 125 HIS HB3 1 126 LYS H . . 4.500 4.345 4.153 4.431 . 0 0 "[ . 1 . 2]" 1
1078 1 125 HIS HB3 1 144 ILE MG . . 5.500 4.413 4.047 4.784 . 0 0 "[ . 1 . 2]" 1
1079 1 125 HIS HA 1 161 GLN HG2 . . 4.400 4.184 3.569 4.479 0.079 16 0 "[ . 1 . 2]" 1
1080 1 125 HIS HA 1 161 GLN HG3 . . 4.200 4.191 3.828 4.278 0.078 14 0 "[ . 1 . 2]" 1
1081 1 126 LYS H 1 126 LYS HB3 . . 3.500 3.474 3.443 3.491 . 0 0 "[ . 1 . 2]" 1
1082 1 126 LYS H 1 126 LYS HA . . 3.000 2.756 2.747 2.784 . 0 0 "[ . 1 . 2]" 1
1083 1 126 LYS H 1 126 LYS HG2 . . 4.000 3.959 3.693 4.019 0.019 20 0 "[ . 1 . 2]" 1
1084 1 126 LYS H 1 127 ASP H . . 3.300 3.132 3.020 3.237 . 0 0 "[ . 1 . 2]" 1
1085 1 126 LYS HA 1 127 ASP H . . 3.600 3.564 3.551 3.569 . 0 0 "[ . 1 . 2]" 1
1086 1 126 LYS HB2 1 127 ASP H . . 2.500 2.490 2.386 2.556 0.056 1 0 "[ . 1 . 2]" 1
1087 1 126 LYS HB3 1 127 ASP H . . 2.500 2.478 2.326 2.536 0.036 1 0 "[ . 1 . 2]" 1
1088 1 127 ASP H 1 127 ASP HB3 . . 4.000 3.856 3.800 3.884 . 0 0 "[ . 1 . 2]" 1
1089 1 127 ASP H 1 127 ASP HA . . 3.000 2.926 2.914 2.935 . 0 0 "[ . 1 . 2]" 1
1090 1 127 ASP HA 1 127 ASP HB3 . . 2.750 2.494 2.464 2.542 . 0 0 "[ . 1 . 2]" 1
1091 1 127 ASP H 1 128 GLU H . . 4.500 4.348 4.329 4.374 . 0 0 "[ . 1 . 2]" 1
1092 1 127 ASP HA 1 128 GLU H . . 2.200 2.219 2.198 2.242 0.042 12 0 "[ . 1 . 2]" 1
1093 1 127 ASP HB3 1 128 GLU H . . 3.000 2.959 2.880 3.035 0.035 11 0 "[ . 1 . 2]" 1
1094 1 128 GLU H 1 128 GLU HA . . 3.000 2.911 2.898 2.925 . 0 0 "[ . 1 . 2]" 1
1095 1 128 GLU H 1 128 GLU HB3 . . 3.800 3.626 3.576 3.656 . 0 0 "[ . 1 . 2]" 1
1096 1 128 GLU HA 1 128 GLU HB3 . . 2.500 2.293 2.287 2.298 . 0 0 "[ . 1 . 2]" 1
1097 1 128 GLU HB2 1 129 VAL HA . . 4.750 4.765 4.740 4.785 0.035 9 0 "[ . 1 . 2]" 1
1098 1 128 GLU HB3 1 129 VAL H . . 3.520 3.574 3.558 3.606 0.086 9 0 "[ . 1 . 2]" 1
1099 1 128 GLU HB3 1 129 VAL MG2 . . 6.000 4.968 4.813 5.106 . 0 0 "[ . 1 . 2]" 1
1100 1 128 GLU H 1 130 LYS HG2 . . 4.300 4.167 3.939 4.351 0.051 13 0 "[ . 1 . 2]" 1
1101 1 128 GLU HB2 1 130 LYS HA . . 5.500 5.521 5.448 5.548 0.048 12 0 "[ . 1 . 2]" 1
1102 1 129 VAL HA 1 129 VAL MG1 . . 3.300 2.356 2.282 2.406 . 0 0 "[ . 1 . 2]" 1
1103 1 129 VAL H 1 129 VAL MG2 . . 2.800 2.039 1.932 2.203 . 0 0 "[ . 1 . 2]" 1
1104 1 129 VAL HA 1 129 VAL MG2 . . 3.270 2.379 2.276 2.420 . 0 0 "[ . 1 . 2]" 1
1105 1 129 VAL MG2 1 130 LYS H . . 4.500 4.051 3.984 4.133 . 0 0 "[ . 1 . 2]" 1
1106 1 129 VAL MG1 1 131 LYS H . . 3.400 2.061 1.920 2.384 . 0 0 "[ . 1 . 2]" 1
1107 1 129 VAL HA 1 147 VAL HB . . 6.000 6.062 6.012 6.089 0.089 10 0 "[ . 1 . 2]" 1
1108 1 129 VAL MG1 1 147 VAL HB . . 5.800 4.764 4.345 4.926 . 0 0 "[ . 1 . 2]" 1
1109 1 130 LYS H 1 130 LYS HG2 . . 4.000 2.958 2.847 3.142 . 0 0 "[ . 1 . 2]" 1
1110 1 130 LYS H 1 130 LYS HB3 . . 3.900 3.673 3.649 3.690 . 0 0 "[ . 1 . 2]" 1
1111 1 130 LYS H 1 131 LYS H . . 3.670 2.020 1.976 2.062 . 0 0 "[ . 1 . 2]" 1
1112 1 130 LYS HB3 1 131 LYS H . . 4.000 3.952 3.721 4.013 0.013 4 0 "[ . 1 . 2]" 1
1113 1 131 LYS H 1 131 LYS HE2 . . 4.530 4.142 3.770 4.567 0.037 13 0 "[ . 1 . 2]" 1
1114 1 131 LYS H 1 132 VAL H . . 4.500 4.556 4.547 4.560 0.060 19 0 "[ . 1 . 2]" 1
1115 1 131 LYS HA 1 132 VAL H . . 3.500 2.358 2.308 2.380 . 0 0 "[ . 1 . 2]" 1
1116 1 131 LYS HB2 1 132 VAL H . . 4.320 4.000 3.896 4.033 . 0 0 "[ . 1 . 2]" 1
1117 1 131 LYS HG2 1 132 VAL H . . 4.500 3.441 2.892 3.650 . 0 0 "[ . 1 . 2]" 1
1118 1 131 LYS HG3 1 132 VAL HA . . 4.360 4.414 4.365 4.563 0.203 1 0 "[ . 1 . 2]" 1
1119 1 131 LYS H 1 147 VAL MG1 . . 5.750 5.734 5.633 5.805 0.055 13 0 "[ . 1 . 2]" 1
1120 1 132 VAL H 1 132 VAL HB . . 4.000 3.168 3.124 3.232 . 0 0 "[ . 1 . 2]" 1
1121 1 132 VAL H 1 132 VAL MG1 . . 3.600 1.965 1.932 2.010 . 0 0 "[ . 1 . 2]" 1
1122 1 132 VAL HA 1 132 VAL HB . . 2.500 2.392 2.379 2.401 . 0 0 "[ . 1 . 2]" 1
1123 1 132 VAL HA 1 132 VAL MG2 . . 3.200 2.405 2.369 2.424 . 0 0 "[ . 1 . 2]" 1
1124 1 132 VAL H 1 133 PRO HB3 . . 5.750 5.709 5.636 5.782 0.032 13 0 "[ . 1 . 2]" 1
1125 1 132 VAL H 1 133 PRO HD3 . . 5.000 3.774 3.709 3.907 . 0 0 "[ . 1 . 2]" 1
1126 1 132 VAL HA 1 133 PRO HD2 . . 2.000 1.949 1.920 1.958 . 0 0 "[ . 1 . 2]" 1
1127 1 132 VAL HA 1 133 PRO HD3 . . 2.600 2.672 2.579 2.698 0.098 10 0 "[ . 1 . 2]" 1
1128 1 132 VAL HB 1 133 PRO HD3 . . 5.000 4.951 4.911 4.960 . 0 0 "[ . 1 . 2]" 1
1129 1 132 VAL MG2 1 133 PRO HD2 . . 4.150 3.291 3.001 3.374 . 0 0 "[ . 1 . 2]" 1
1130 1 132 VAL MG2 1 133 PRO HD3 . . 5.250 4.313 4.136 4.362 . 0 0 "[ . 1 . 2]" 1
1131 1 132 VAL MG2 1 136 PHE H . . 6.000 5.174 4.139 5.463 . 0 0 "[ . 1 . 2]" 1
1132 1 132 VAL MG2 1 136 PHE HD1 . . 5.000 4.090 2.983 5.141 0.141 16 0 "[ . 1 . 2]" 1
1133 1 133 PRO HA 1 133 PRO HD2 . . 4.340 4.098 4.098 4.099 . 0 0 "[ . 1 . 2]" 1
1134 1 133 PRO HA 1 134 GLU H . . 2.500 2.377 2.340 2.416 . 0 0 "[ . 1 . 2]" 1
1135 1 133 PRO HB2 1 134 GLU H . . 2.750 2.677 2.575 2.775 0.025 13 0 "[ . 1 . 2]" 1
1136 1 133 PRO HB3 1 134 GLU H . . 3.500 3.487 3.436 3.539 0.039 13 0 "[ . 1 . 2]" 1
1137 1 133 PRO HB2 1 136 PHE H . . 4.500 4.440 4.265 4.551 0.051 16 0 "[ . 1 . 2]" 1
1138 1 133 PRO HB3 1 136 PHE HB3 . . 5.300 5.326 4.928 5.387 0.087 12 0 "[ . 1 . 2]" 1
1139 1 134 GLU H 1 134 GLU HA . . 3.000 2.922 2.866 2.934 . 0 0 "[ . 1 . 2]" 1
1140 1 134 GLU H 1 134 GLU HB2 . . 2.750 2.344 2.249 2.514 . 0 0 "[ . 1 . 2]" 1
1141 1 134 GLU H 1 134 GLU HB3 . . 3.750 3.532 3.292 3.658 . 0 0 "[ . 1 . 2]" 1
1142 1 134 GLU HB3 1 135 GLY H . . 3.500 3.372 3.089 3.492 . 0 0 "[ . 1 . 2]" 1
1143 1 135 GLY H 1 135 GLY HA2 . . 2.500 2.456 2.379 2.499 . 0 0 "[ . 1 . 2]" 1
1144 1 135 GLY H 1 135 GLY HA3 . . 3.000 2.954 2.935 2.957 . 0 0 "[ . 1 . 2]" 1
1145 1 135 GLY H 1 136 PHE H . . 2.500 2.217 2.100 2.403 . 0 0 "[ . 1 . 2]" 1
1146 1 135 GLY HA2 1 136 PHE H . . 3.500 3.341 3.290 3.413 . 0 0 "[ . 1 . 2]" 1
1147 1 135 GLY HA3 1 136 PHE H . . 3.200 3.203 3.107 3.264 0.064 14 0 "[ . 1 . 2]" 1
1148 1 136 PHE H 1 136 PHE HA . . 3.000 2.945 2.939 2.947 . 0 0 "[ . 1 . 2]" 1
1149 1 136 PHE H 1 136 PHE HB2 . . 3.900 3.720 3.539 3.781 . 0 0 "[ . 1 . 2]" 1
1150 1 136 PHE H 1 136 PHE HB3 . . 2.700 2.599 2.339 2.707 0.007 14 0 "[ . 1 . 2]" 1
1151 1 136 PHE H 1 136 PHE QD . . 4.200 2.192 1.907 3.414 . 0 0 "[ . 1 . 2]" 1
1152 1 136 PHE HB2 1 136 PHE QD . . 3.250 2.299 2.263 2.496 . 0 0 "[ . 1 . 2]" 1
1153 1 136 PHE H 1 137 GLU H . . 4.500 4.504 4.490 4.536 0.036 6 0 "[ . 1 . 2]" 1
1154 1 136 PHE HA 1 137 GLU H . . 2.200 2.272 2.219 2.289 0.089 9 0 "[ . 1 . 2]" 1
1155 1 136 PHE HA 1 137 GLU HB3 . . 4.750 4.569 4.379 4.733 . 0 0 "[ . 1 . 2]" 1
1156 1 136 PHE HB3 1 137 GLU H . . 4.200 4.184 4.150 4.311 0.111 11 0 "[ . 1 . 2]" 1
1157 1 136 PHE QD 1 137 GLU H . . 4.000 3.492 2.434 3.724 . 0 0 "[ . 1 . 2]" 1
1158 1 136 PHE HB2 1 151 LYS H . . 5.000 4.485 3.993 5.020 0.020 11 0 "[ . 1 . 2]" 1
1159 1 136 PHE HA 1 152 HIS HA . . 2.300 1.980 1.951 2.042 . 0 0 "[ . 1 . 2]" 1
1160 1 136 PHE HA 1 152 HIS HB2 . . 4.530 4.544 4.451 4.581 0.051 18 0 "[ . 1 . 2]" 1
1161 1 136 PHE HA 1 152 HIS HB3 . . 5.000 4.154 3.982 4.404 . 0 0 "[ . 1 . 2]" 1
1162 1 136 PHE H 1 153 LYS H . . 5.100 5.086 4.885 5.146 0.046 18 0 "[ . 1 . 2]" 1
1163 1 136 PHE HA 1 153 LYS H . . 3.300 3.302 3.203 3.362 0.062 13 0 "[ . 1 . 2]" 1
1164 1 137 GLU H 1 137 GLU HA . . 3.000 2.923 2.908 2.929 . 0 0 "[ . 1 . 2]" 1
1165 1 137 GLU H 1 138 ILE H . . 4.500 4.289 4.229 4.347 . 0 0 "[ . 1 . 2]" 1
1166 1 137 GLU HA 1 138 ILE H . . 2.500 2.183 2.158 2.264 . 0 0 "[ . 1 . 2]" 1
1167 1 137 GLU HA 1 138 ILE HB . . 4.500 4.472 4.293 4.562 0.062 5 0 "[ . 1 . 2]" 1
1168 1 137 GLU H 1 152 HIS H . . 5.000 4.550 4.434 4.791 . 0 0 "[ . 1 . 2]" 1
1169 1 137 GLU H 1 152 HIS HB2 . . 5.600 5.665 5.597 5.743 0.143 18 0 "[ . 1 . 2]" 1
1170 1 137 GLU H 1 153 LYS H . . 4.390 4.284 3.994 4.478 0.088 5 0 "[ . 1 . 2]" 1
1171 1 138 ILE H 1 138 ILE HA . . 3.000 2.879 2.875 2.905 . 0 0 "[ . 1 . 2]" 1
1172 1 138 ILE H 1 138 ILE HB . . 2.500 2.328 2.185 2.392 . 0 0 "[ . 1 . 2]" 1
1173 1 138 ILE H 1 138 ILE HG13 . . 4.000 3.531 3.331 3.638 . 0 0 "[ . 1 . 2]" 1
1174 1 138 ILE H 1 138 ILE MG . . 4.500 3.688 3.514 3.737 . 0 0 "[ . 1 . 2]" 1
1175 1 138 ILE HA 1 138 ILE HB . . 3.000 3.003 2.953 3.015 0.015 18 0 "[ . 1 . 2]" 1
1176 1 138 ILE HA 1 138 ILE HG13 . . 2.500 2.223 2.081 2.267 . 0 0 "[ . 1 . 2]" 1
1177 1 138 ILE HA 1 138 ILE MD . . 4.000 3.097 2.916 3.564 . 0 0 "[ . 1 . 2]" 1
1178 1 138 ILE HB 1 138 ILE MD . . 3.000 2.183 2.127 2.240 . 0 0 "[ . 1 . 2]" 1
1179 1 138 ILE HA 1 139 LEU H . . 2.200 2.169 2.147 2.204 0.004 16 0 "[ . 1 . 2]" 1
1180 1 138 ILE MD 1 139 LEU H . . 6.000 4.803 4.715 4.963 . 0 0 "[ . 1 . 2]" 1
1181 1 138 ILE HA 1 140 ALA H . . 4.200 3.780 3.626 3.974 . 0 0 "[ . 1 . 2]" 1
1182 1 138 ILE HG13 1 140 ALA H . . 5.000 4.860 4.615 5.053 0.053 13 0 "[ . 1 . 2]" 1
1183 1 138 ILE MG 1 142 SER H . . 6.000 4.808 4.684 4.976 . 0 0 "[ . 1 . 2]" 1
1184 1 138 ILE HG12 1 147 VAL H . . 5.000 4.939 4.774 5.024 0.024 3 0 "[ . 1 . 2]" 1
1185 1 138 ILE HG13 1 147 VAL MG1 . . 4.500 3.757 3.311 3.993 . 0 0 "[ . 1 . 2]" 1
1186 1 138 ILE MD 1 147 VAL HA . . 3.800 3.615 2.336 3.841 0.041 14 0 "[ . 1 . 2]" 1
1187 1 138 ILE HA 1 149 ALA H . . 4.600 4.660 4.601 4.724 0.124 20 0 "[ . 1 . 2]" 1
1188 1 138 ILE HG12 1 149 ALA H . . 4.600 4.351 3.209 4.608 0.008 10 0 "[ . 1 . 2]" 1
1189 1 138 ILE HA 1 150 MET HA . . 2.300 2.074 1.980 2.148 . 0 0 "[ . 1 . 2]" 1
1190 1 138 ILE MD 1 150 MET H . . 5.820 5.842 5.826 5.872 0.052 13 0 "[ . 1 . 2]" 1
1191 1 138 ILE HA 1 151 LYS H . . 3.500 3.216 3.098 3.389 . 0 0 "[ . 1 . 2]" 1
1192 1 139 LEU H 1 139 LEU MD1 . . 5.330 3.679 3.459 3.822 . 0 0 "[ . 1 . 2]" 1
1193 1 139 LEU H 1 139 LEU MD2 . . 5.160 3.275 3.064 3.439 . 0 0 "[ . 1 . 2]" 1
1194 1 139 LEU H 1 140 ALA H . . 2.500 2.146 1.948 2.266 . 0 0 "[ . 1 . 2]" 1
1195 1 139 LEU H 1 140 ALA MB . . 5.500 4.115 3.880 4.289 . 0 0 "[ . 1 . 2]" 1
1196 1 139 LEU HA 1 140 ALA HA . . 4.600 4.521 4.501 4.541 . 0 0 "[ . 1 . 2]" 1
1197 1 139 LEU HA 1 140 ALA MB . . 5.710 4.716 4.624 4.822 . 0 0 "[ . 1 . 2]" 1
1198 1 139 LEU MD2 1 140 ALA H . . 5.700 4.559 3.968 4.695 . 0 0 "[ . 1 . 2]" 1
1199 1 139 LEU H 1 149 ALA MB . . 4.300 3.007 2.773 3.218 . 0 0 "[ . 1 . 2]" 1
1200 1 139 LEU H 1 150 MET HA . . 3.200 3.075 2.813 3.244 0.044 11 0 "[ . 1 . 2]" 1
1201 1 139 LEU MD1 1 151 LYS HE2 . . 5.000 3.454 2.756 5.033 0.033 20 0 "[ . 1 . 2]" 1
1202 1 139 LEU MD1 1 151 LYS QD . . 5.000 2.258 1.931 4.450 . 0 0 "[ . 1 . 2]" 1
1203 1 139 LEU MD2 1 151 LYS HB2 . . 4.800 3.273 2.059 4.432 . 0 0 "[ . 1 . 2]" 1
1204 1 139 LEU MD2 1 151 LYS HB3 . . 4.000 2.290 1.950 3.810 . 0 0 "[ . 1 . 2]" 1
1205 1 139 LEU MD1 1 158 TYR QD . . 6.000 3.051 2.357 4.985 . 0 0 "[ . 1 . 2]" 1
1206 1 139 LEU MD1 1 158 TYR QE . . 6.000 3.641 2.732 6.003 0.003 5 0 "[ . 1 . 2]" 1
1207 1 140 ALA H 1 140 ALA HA . . 3.000 2.939 2.924 2.949 . 0 0 "[ . 1 . 2]" 1
1208 1 140 ALA H 1 140 ALA MB . . 3.500 2.503 2.358 2.592 . 0 0 "[ . 1 . 2]" 1
1209 1 140 ALA H 1 141 HIS H . . 4.200 4.209 4.018 4.326 0.126 9 0 "[ . 1 . 2]" 1
1210 1 140 ALA HA 1 141 HIS H . . 2.200 2.146 2.141 2.168 . 0 0 "[ . 1 . 2]" 1
1211 1 140 ALA MB 1 141 HIS H . . 4.000 3.228 3.011 3.385 . 0 0 "[ . 1 . 2]" 1
1212 1 140 ALA MB 1 142 SER H . . 6.000 4.940 4.567 5.206 . 0 0 "[ . 1 . 2]" 1
1213 1 140 ALA MB 1 148 GLU HB2 . . 4.000 3.284 2.423 4.015 0.015 9 0 "[ . 1 . 2]" 1
1214 1 140 ALA MB 1 148 GLU HB3 . . 3.800 2.643 1.950 4.070 0.270 9 0 "[ . 1 . 2]" 1
1215 1 140 ALA H 1 149 ALA MB . . 3.800 2.472 2.235 2.738 . 0 0 "[ . 1 . 2]" 1
1216 1 140 ALA HA 1 149 ALA H . . 5.500 5.355 5.113 5.523 0.023 17 0 "[ . 1 . 2]" 1
1217 1 140 ALA MB 1 149 ALA H . . 4.210 3.479 3.088 3.926 . 0 0 "[ . 1 . 2]" 1
1218 1 140 ALA MB 1 149 ALA MB . . 4.000 2.065 1.802 2.480 . 0 0 "[ . 1 . 2]" 1
1219 1 140 ALA H 1 150 MET H . . 6.000 5.478 5.334 5.695 . 0 0 "[ . 1 . 2]" 1
1220 1 140 ALA H 1 162 PHE HE2 . . 6.000 6.009 5.908 6.074 0.074 13 0 "[ . 1 . 2]" 1
1221 1 140 ALA MB 1 162 PHE QE . . 6.000 3.641 3.195 4.110 . 0 0 "[ . 1 . 2]" 1
1222 1 141 HIS H 1 141 HIS HA . . 3.000 2.947 2.942 2.948 . 0 0 "[ . 1 . 2]" 1
1223 1 141 HIS H 1 141 HIS HD1 . . 4.500 4.424 4.367 4.505 0.005 10 0 "[ . 1 . 2]" 1
1224 1 141 HIS H 1 142 SER H . . 4.300 4.340 4.103 4.444 0.144 6 0 "[ . 1 . 2]" 1
1225 1 141 HIS HD1 1 142 SER HA . . 4.000 3.707 3.537 3.863 . 0 0 "[ . 1 . 2]" 1
1226 1 141 HIS HD1 1 143 ASP H . . 4.600 4.627 4.608 4.643 0.043 17 0 "[ . 1 . 2]" 1
1227 1 141 HIS H 1 148 GLU H . . 5.500 5.530 5.345 5.585 0.085 9 0 "[ . 1 . 2]" 1
1228 1 141 HIS HB2 1 148 GLU H . . 5.500 5.005 4.688 5.576 0.076 9 0 "[ . 1 . 2]" 1
1229 1 142 SER H 1 142 SER HA . . 3.000 2.939 2.934 2.942 . 0 0 "[ . 1 . 2]" 1
1230 1 142 SER H 1 142 SER HB2 . . 3.500 3.419 3.188 3.498 . 0 0 "[ . 1 . 2]" 1
1231 1 142 SER H 1 143 ASP H . . 4.600 4.543 4.534 4.552 . 0 0 "[ . 1 . 2]" 1
1232 1 142 SER HA 1 143 ASP H . . 2.300 2.334 2.315 2.361 0.061 10 0 "[ . 1 . 2]" 1
1233 1 142 SER HA 1 144 ILE H . . 4.500 3.989 3.940 4.025 . 0 0 "[ . 1 . 2]" 1
1234 1 142 SER H 1 145 CYS H . . 3.600 3.644 3.615 3.669 0.069 11 0 "[ . 1 . 2]" 1
1235 1 142 SER H 1 145 CYS HA . . 4.600 4.599 4.543 4.664 0.064 8 0 "[ . 1 . 2]" 1
1236 1 142 SER H 1 145 CYS HB3 . . 3.750 3.750 3.681 3.867 0.117 20 0 "[ . 1 . 2]" 1
1237 1 142 SER H 1 146 GLN HA . . 2.000 2.082 2.027 2.141 0.141 16 0 "[ . 1 . 2]" 1
1238 1 142 SER H 1 148 GLU H . . 3.750 3.484 3.265 3.818 0.068 9 0 "[ . 1 . 2]" 1
1239 1 143 ASP H 1 143 ASP HA . . 3.000 2.781 2.768 2.796 . 0 0 "[ . 1 . 2]" 1
1240 1 143 ASP H 1 143 ASP HB2 . . 3.700 2.391 2.076 3.591 . 0 0 "[ . 1 . 2]" 1
1241 1 143 ASP H 1 144 ILE H . . 3.000 2.700 2.661 2.735 . 0 0 "[ . 1 . 2]" 1
1242 1 143 ASP HB2 1 144 ILE H . . 4.000 3.868 3.211 4.051 0.051 16 0 "[ . 1 . 2]" 1
1243 1 144 ILE H 1 144 ILE HA . . 3.000 2.948 2.946 2.949 . 0 0 "[ . 1 . 2]" 1
1244 1 144 ILE H 1 144 ILE HB . . 3.000 2.736 2.694 2.782 . 0 0 "[ . 1 . 2]" 1
1245 1 144 ILE H 1 144 ILE MD . . 4.300 3.158 2.166 4.058 . 0 0 "[ . 1 . 2]" 1
1246 1 144 ILE H 1 144 ILE MG . . 4.700 3.888 3.873 3.905 . 0 0 "[ . 1 . 2]" 1
1247 1 144 ILE H 1 145 CYS H . . 2.000 1.911 1.852 1.985 . 0 0 "[ . 1 . 2]" 1
1248 1 144 ILE HB 1 145 CYS H . . 3.000 2.861 2.700 2.939 . 0 0 "[ . 1 . 2]" 1
1249 1 144 ILE MD 1 145 CYS H . . 5.500 4.149 3.300 4.825 . 0 0 "[ . 1 . 2]" 1
1250 1 144 ILE MG 1 145 CYS H . . 4.900 3.811 3.734 3.879 . 0 0 "[ . 1 . 2]" 1
1251 1 144 ILE MG 1 145 CYS HB3 . . 5.870 5.200 5.013 5.322 . 0 0 "[ . 1 . 2]" 1
1252 1 144 ILE HB 1 146 GLN H . . 6.000 5.855 5.819 5.978 . 0 0 "[ . 1 . 2]" 1
1253 1 145 CYS H 1 145 CYS HB3 . . 4.190 2.869 2.693 3.065 . 0 0 "[ . 1 . 2]" 1
1254 1 146 GLN H 1 147 VAL H . . 4.280 2.612 2.573 2.645 . 0 0 "[ . 1 . 2]" 1
1255 1 146 GLN H 1 147 VAL MG2 . . 5.000 3.909 3.780 4.074 . 0 0 "[ . 1 . 2]" 1
1256 1 146 GLN HA 1 147 VAL H . . 4.290 3.452 3.372 3.513 . 0 0 "[ . 1 . 2]" 1
1257 1 147 VAL H 1 147 VAL HB . . 3.700 3.693 3.655 3.727 0.027 6 0 "[ . 1 . 2]" 1
1258 1 147 VAL H 1 147 VAL MG1 . . 4.040 2.613 2.394 2.778 . 0 0 "[ . 1 . 2]" 1
1259 1 147 VAL H 1 147 VAL MG2 . . 4.040 2.005 1.908 2.186 . 0 0 "[ . 1 . 2]" 1
1260 1 147 VAL H 1 149 ALA H . . 5.090 5.134 5.013 5.190 0.100 20 0 "[ . 1 . 2]" 1
1261 1 147 VAL HB 1 150 MET HB2 . . 6.000 5.834 5.638 6.013 0.013 1 0 "[ . 1 . 2]" 1
1262 1 148 GLU H 1 149 ALA H . . 4.020 2.697 2.494 2.803 . 0 0 "[ . 1 . 2]" 1
1263 1 149 ALA H 1 150 MET H . . 4.300 4.215 4.095 4.273 . 0 0 "[ . 1 . 2]" 1
1264 1 149 ALA HA 1 150 MET H . . 2.300 2.175 2.143 2.204 . 0 0 "[ . 1 . 2]" 1
1265 1 149 ALA MB 1 150 MET H . . 5.800 3.025 2.899 3.251 . 0 0 "[ . 1 . 2]" 1
1266 1 149 ALA HA 1 160 VAL H . . 4.700 4.715 4.690 4.742 0.042 16 0 "[ . 1 . 2]" 1
1267 1 149 ALA HA 1 160 VAL HA . . 2.300 2.324 2.279 2.358 0.058 13 0 "[ . 1 . 2]" 1
1268 1 149 ALA HA 1 160 VAL MG1 . . 4.120 2.331 2.133 2.564 . 0 0 "[ . 1 . 2]" 1
1269 1 149 ALA MB 1 160 VAL HA . . 3.600 3.558 3.498 3.620 0.020 9 0 "[ . 1 . 2]" 1
1270 1 149 ALA MB 1 160 VAL HB . . 4.690 3.953 3.621 4.267 . 0 0 "[ . 1 . 2]" 1
1271 1 149 ALA MB 1 160 VAL MG1 . . 3.800 2.079 1.899 2.298 . 0 0 "[ . 1 . 2]" 1
1272 1 149 ALA MB 1 161 GLN H . . 4.800 4.656 4.530 4.751 . 0 0 "[ . 1 . 2]" 1
1273 1 149 ALA H 1 162 PHE HE2 . . 5.000 4.445 4.087 4.962 . 0 0 "[ . 1 . 2]" 1
1274 1 149 ALA MB 1 162 PHE HZ . . 4.600 3.356 2.938 4.307 . 0 0 "[ . 1 . 2]" 1
1275 1 149 ALA MB 1 162 PHE QE . . 3.700 2.671 2.310 2.997 . 0 0 "[ . 1 . 2]" 1
1276 1 150 MET H 1 150 MET HB3 . . 4.300 3.359 3.158 3.454 . 0 0 "[ . 1 . 2]" 1
1277 1 150 MET H 1 151 LYS H . . 4.300 4.321 4.261 4.429 0.129 13 0 "[ . 1 . 2]" 1
1278 1 150 MET HA 1 151 LYS H . . 2.200 2.171 2.156 2.242 0.042 13 0 "[ . 1 . 2]" 1
1279 1 150 MET HB3 1 151 LYS H . . 4.000 4.026 3.970 4.085 0.085 18 0 "[ . 1 . 2]" 1
1280 1 150 MET H 1 158 TYR HB3 . . 5.500 5.334 5.144 5.529 0.029 9 0 "[ . 1 . 2]" 1
1281 1 150 MET H 1 159 GLY H . . 3.300 2.908 2.764 2.988 . 0 0 "[ . 1 . 2]" 1
1282 1 150 MET H 1 159 GLY HA2 . . 4.730 4.568 4.473 4.701 . 0 0 "[ . 1 . 2]" 1
1283 1 150 MET H 1 159 GLY HA3 . . 3.820 3.640 3.562 3.853 0.033 18 0 "[ . 1 . 2]" 1
1284 1 150 MET HG2 1 159 GLY H . . 3.200 3.211 2.920 3.291 0.091 18 0 "[ . 1 . 2]" 1
1285 1 150 MET H 1 160 VAL HA . . 3.500 3.526 3.475 3.584 0.084 14 0 "[ . 1 . 2]" 1
1286 1 150 MET H 1 160 VAL MG1 . . 4.830 3.435 3.296 3.643 . 0 0 "[ . 1 . 2]" 1
1287 1 150 MET H 1 160 VAL MG2 . . 5.900 5.379 5.149 5.493 . 0 0 "[ . 1 . 2]" 1
1288 1 151 LYS H 1 151 LYS HB3 . . 4.000 2.749 2.663 2.976 . 0 0 "[ . 1 . 2]" 1
1289 1 151 LYS H 1 151 LYS HE2 . . 4.300 4.313 4.217 4.401 0.101 18 0 "[ . 1 . 2]" 1
1290 1 151 LYS HA 1 152 HIS H . . 2.250 2.204 2.176 2.369 0.119 18 0 "[ . 1 . 2]" 1
1291 1 151 LYS HB3 1 152 HIS H . . 4.000 4.075 3.958 4.119 0.119 9 0 "[ . 1 . 2]" 1
1292 1 151 LYS HG3 1 152 HIS H . . 3.500 3.419 3.233 3.763 0.263 18 0 "[ . 1 . 2]" 1
1293 1 151 LYS HA 1 157 ILE HB . . 4.500 4.055 3.619 4.405 . 0 0 "[ . 1 . 2]" 1
1294 1 151 LYS HA 1 158 TYR H . . 4.750 4.643 4.492 4.746 . 0 0 "[ . 1 . 2]" 1
1295 1 151 LYS HA 1 158 TYR HA . . 2.300 2.400 2.204 2.471 0.171 11 0 "[ . 1 . 2]" 1
1296 1 151 LYS HB2 1 158 TYR HA . . 4.000 3.140 2.834 3.362 . 0 0 "[ . 1 . 2]" 1
1297 1 151 LYS HB2 1 158 TYR HB3 . . 4.350 4.037 3.855 4.278 . 0 0 "[ . 1 . 2]" 1
1298 1 151 LYS HA 1 159 GLY H . . 3.750 3.620 3.338 3.793 0.043 13 0 "[ . 1 . 2]" 1
1299 1 152 HIS H 1 152 HIS HB3 . . 3.500 3.508 3.387 3.567 0.067 2 0 "[ . 1 . 2]" 1
1300 1 152 HIS H 1 152 HIS HD1 . . 3.500 2.901 2.356 3.524 0.024 18 0 "[ . 1 . 2]" 1
1301 1 152 HIS H 1 152 HIS HB2 . . 3.500 2.243 2.168 2.298 . 0 0 "[ . 1 . 2]" 1
1302 1 152 HIS HB3 1 153 LYS H . . 3.500 3.155 3.016 3.357 . 0 0 "[ . 1 . 2]" 1
1303 1 152 HIS HB3 1 154 THR H . . 3.500 2.983 2.865 3.221 . 0 0 "[ . 1 . 2]" 1
1304 1 152 HIS H 1 157 ILE H . . 3.300 3.105 2.881 3.301 0.001 17 0 "[ . 1 . 2]" 1
1305 1 152 HIS H 1 157 ILE HB . . 3.000 2.599 2.234 2.848 . 0 0 "[ . 1 . 2]" 1
1306 1 152 HIS HA 1 157 ILE HB . . 5.150 4.502 4.113 4.777 . 0 0 "[ . 1 . 2]" 1
1307 1 153 LYS H 1 153 LYS HA . . 3.000 2.902 2.881 2.915 . 0 0 "[ . 1 . 2]" 1
1308 1 153 LYS H 1 153 LYS HB2 . . 2.500 2.352 2.212 2.533 0.033 13 0 "[ . 1 . 2]" 1
1309 1 153 LYS H 1 153 LYS HB3 . . 3.600 3.586 3.503 3.646 0.046 13 0 "[ . 1 . 2]" 1
1310 1 153 LYS H 1 153 LYS HE2 . . 4.750 4.542 3.861 4.760 0.010 13 0 "[ . 1 . 2]" 1
1311 1 153 LYS H 1 153 LYS HG2 . . 3.500 3.197 2.390 3.480 . 0 0 "[ . 1 . 2]" 1
1312 1 153 LYS H 1 154 THR H . . 2.500 2.291 2.229 2.383 . 0 0 "[ . 1 . 2]" 1
1313 1 153 LYS HA 1 154 THR H . . 3.500 3.479 3.446 3.523 0.023 12 0 "[ . 1 . 2]" 1
1314 1 153 LYS HB2 1 154 THR H . . 3.000 2.945 2.774 3.031 0.031 4 0 "[ . 1 . 2]" 1
1315 1 153 LYS HB3 1 154 THR H . . 4.000 3.757 3.508 4.003 0.003 4 0 "[ . 1 . 2]" 1
1316 1 153 LYS HE2 1 154 THR H . . 6.000 5.446 5.074 5.773 . 0 0 "[ . 1 . 2]" 1
1317 1 153 LYS H 1 157 ILE HB . . 6.000 6.053 5.931 6.140 0.140 18 0 "[ . 1 . 2]" 1
1318 1 154 THR H 1 154 THR HA . . 3.000 2.849 2.774 2.914 . 0 0 "[ . 1 . 2]" 1
1319 1 154 THR H 1 154 THR MG . . 3.000 1.981 1.871 2.087 . 0 0 "[ . 1 . 2]" 1
1320 1 154 THR H 1 155 LYS H . . 2.750 2.500 2.255 2.734 . 0 0 "[ . 1 . 2]" 1
1321 1 154 THR HA 1 155 LYS H . . 3.500 3.492 3.488 3.507 0.007 4 0 "[ . 1 . 2]" 1
1322 1 154 THR MG 1 155 LYS H . . 3.000 2.144 1.926 3.238 0.238 4 0 "[ . 1 . 2]" 1
1323 1 155 LYS H 1 155 LYS HA . . 3.000 2.919 2.903 2.945 . 0 0 "[ . 1 . 2]" 1
1324 1 155 LYS H 1 155 LYS HB2 . . 3.000 2.736 2.631 2.786 . 0 0 "[ . 1 . 2]" 1
1325 1 155 LYS H 1 155 LYS HB3 . . 3.750 3.681 3.565 3.849 0.099 10 0 "[ . 1 . 2]" 1
1326 1 155 LYS H 1 155 LYS HE2 . . 4.000 3.972 3.829 4.078 0.078 4 0 "[ . 1 . 2]" 1
1327 1 155 LYS H 1 155 LYS QZ . . 5.200 4.905 4.527 5.158 . 0 0 "[ . 1 . 2]" 1
1328 1 156 PRO HA 1 157 ILE H . . 2.500 2.450 2.413 2.476 . 0 0 "[ . 1 . 2]" 1
1329 1 156 PRO HB2 1 157 ILE H . . 4.400 4.279 4.255 4.295 . 0 0 "[ . 1 . 2]" 1
1330 1 156 PRO HB3 1 157 ILE H . . 4.600 4.574 4.550 4.590 . 0 0 "[ . 1 . 2]" 1
1331 1 156 PRO HD2 1 157 ILE QG . . 4.050 3.899 3.813 3.992 . 0 0 "[ . 1 . 2]" 1
1332 1 156 PRO HD3 1 157 ILE H . . 5.000 5.088 5.057 5.135 0.135 2 0 "[ . 1 . 2]" 1
1333 1 156 PRO HG2 1 157 ILE H . . 5.000 4.881 4.857 4.917 . 0 0 "[ . 1 . 2]" 1
1334 1 157 ILE H 1 157 ILE HB . . 3.000 2.758 2.666 2.828 . 0 0 "[ . 1 . 2]" 1
1335 1 157 ILE H 1 157 ILE HA . . 3.000 2.947 2.944 2.948 . 0 0 "[ . 1 . 2]" 1
1336 1 157 ILE H 1 157 ILE MD . . 4.500 3.684 3.389 4.150 . 0 0 "[ . 1 . 2]" 1
1337 1 157 ILE H 1 158 TYR H . . 4.800 4.424 4.327 4.485 . 0 0 "[ . 1 . 2]" 1
1338 1 157 ILE HA 1 158 TYR H . . 2.200 2.212 2.156 2.264 0.064 11 0 "[ . 1 . 2]" 1
1339 1 157 ILE MD 1 158 TYR H . . 4.800 3.898 3.305 4.844 0.044 19 0 "[ . 1 . 2]" 1
1340 1 157 ILE MG 1 159 GLY H . . 6.000 4.593 4.308 4.799 . 0 0 "[ . 1 . 2]" 1
1341 1 158 TYR H 1 158 TYR HB2 . . 3.000 2.852 2.741 2.974 . 0 0 "[ . 1 . 2]" 1
1342 1 158 TYR H 1 158 TYR HB3 . . 4.040 3.883 3.832 3.942 . 0 0 "[ . 1 . 2]" 1
1343 1 158 TYR H 1 158 TYR QE . . 5.500 4.681 4.581 4.796 . 0 0 "[ . 1 . 2]" 1
1344 1 158 TYR HA 1 159 GLY H . . 4.680 2.248 2.219 2.276 . 0 0 "[ . 1 . 2]" 1
1345 1 158 TYR HB2 1 159 GLY H . . 3.800 3.828 3.751 3.894 0.094 14 0 "[ . 1 . 2]" 1
1346 1 158 TYR HB3 1 159 GLY H . . 3.000 2.882 2.786 2.990 . 0 0 "[ . 1 . 2]" 1
1347 1 158 TYR QD 1 159 GLY H . . 5.000 4.258 4.136 4.387 . 0 0 "[ . 1 . 2]" 1
1348 1 158 TYR HB3 1 160 VAL MG1 . . 4.860 4.121 3.966 4.308 . 0 0 "[ . 1 . 2]" 1
1349 1 159 GLY H 1 159 GLY HA3 . . 3.000 2.651 2.610 2.660 . 0 0 "[ . 1 . 2]" 1
1350 1 159 GLY H 1 160 VAL HA . . 4.860 4.864 4.828 4.888 0.028 10 0 "[ . 1 . 2]" 1
1351 1 159 GLY H 1 160 VAL MG1 . . 4.300 3.598 3.464 3.780 . 0 0 "[ . 1 . 2]" 1
1352 1 159 GLY HA3 1 160 VAL H . . 3.050 2.952 2.920 3.011 . 0 0 "[ . 1 . 2]" 1
1353 1 160 VAL MG2 1 162 PHE H . . 5.000 3.717 3.211 3.974 . 0 0 "[ . 1 . 2]" 1
1354 1 161 GLN H 1 162 PHE H . . 4.750 2.213 2.145 2.298 . 0 0 "[ . 1 . 2]" 1
1355 1 162 PHE QE 1 175 ILE MD . . 4.800 3.372 2.923 4.081 . 0 0 "[ . 1 . 2]" 1
1356 1 164 PRO HA 1 172 GLY HA2 . . 4.200 3.501 2.771 4.221 0.021 13 0 "[ . 1 . 2]" 1
1357 1 164 PRO HA 1 172 GLY HA3 . . 3.000 2.406 1.987 3.036 0.036 9 0 "[ . 1 . 2]" 1
1358 1 166 VAL H 1 166 VAL HB . . 4.000 2.736 2.500 3.667 . 0 0 "[ . 1 . 2]" 1
1359 1 166 VAL H 1 166 VAL MG1 . . 4.650 3.379 1.985 3.853 . 0 0 "[ . 1 . 2]" 1
1360 1 169 THR HA 1 172 GLY H . . 4.700 4.734 4.589 4.841 0.141 20 0 "[ . 1 . 2]" 1
1361 1 169 THR HB 1 172 GLY H . . 5.000 3.857 2.636 4.859 . 0 0 "[ . 1 . 2]" 1
1362 1 172 GLY H 1 172 GLY HA2 . . 3.000 2.895 2.859 2.929 . 0 0 "[ . 1 . 2]" 1
1363 1 172 GLY H 1 173 ASN H . . 2.750 2.466 2.341 2.590 . 0 0 "[ . 1 . 2]" 1
1364 1 172 GLY HA2 1 173 ASN H . . 3.500 3.545 3.519 3.570 0.070 6 0 "[ . 1 . 2]" 1
1365 1 172 GLY H 1 174 GLU H . . 4.200 3.778 3.446 4.065 . 0 0 "[ . 1 . 2]" 1
1366 1 172 GLY HA2 1 175 ILE HB . . 4.000 3.744 3.255 4.010 0.010 15 0 "[ . 1 . 2]" 1
1367 1 172 GLY HA2 1 175 ILE MD . . 4.800 2.660 1.952 4.284 . 0 0 "[ . 1 . 2]" 1
1368 1 172 GLY HA2 1 176 LEU H . . 5.000 4.735 4.528 4.784 . 0 0 "[ . 1 . 2]" 1
1369 1 173 ASN H 1 173 ASN HB2 . . 2.500 2.248 2.067 2.549 0.049 13 0 "[ . 1 . 2]" 1
1370 1 173 ASN H 1 173 ASN HD22 . . 5.500 5.201 4.658 5.721 0.221 13 0 "[ . 1 . 2]" 1
1371 1 173 ASN HB2 1 173 ASN HD22 . . 4.000 3.870 3.743 4.074 0.074 6 0 "[ . 1 . 2]" 1
1372 1 173 ASN HB3 1 173 ASN HD22 . . 3.500 3.469 3.435 3.517 0.017 6 0 "[ . 1 . 2]" 1
1373 1 173 ASN H 1 174 GLU H . . 2.800 2.664 2.524 2.744 . 0 0 "[ . 1 . 2]" 1
1374 1 173 ASN HA 1 174 GLU HA . . 4.800 4.792 4.779 4.831 0.031 6 0 "[ . 1 . 2]" 1
1375 1 173 ASN HB2 1 174 GLU H . . 4.000 3.376 3.037 4.144 0.144 6 0 "[ . 1 . 2]" 1
1376 1 173 ASN HA 1 176 LEU HB2 . . 3.500 3.058 2.584 3.374 . 0 0 "[ . 1 . 2]" 1
1377 1 173 ASN HA 1 176 LEU MD1 . . 6.000 4.801 4.430 5.338 . 0 0 "[ . 1 . 2]" 1
1378 1 174 GLU H 1 174 GLU HA . . 3.000 2.830 2.803 2.838 . 0 0 "[ . 1 . 2]" 1
1379 1 174 GLU H 1 174 GLU HB2 . . 2.500 2.144 2.071 2.351 . 0 0 "[ . 1 . 2]" 1
1380 1 174 GLU HA 1 175 ILE H . . 3.600 3.541 3.468 3.568 . 0 0 "[ . 1 . 2]" 1
1381 1 174 GLU HB2 1 175 ILE H . . 3.000 2.876 2.528 3.004 0.004 4 0 "[ . 1 . 2]" 1
1382 1 174 GLU HB3 1 175 ILE MD . . 4.300 2.887 2.417 3.218 . 0 0 "[ . 1 . 2]" 1
1383 1 175 ILE HA 1 175 ILE HB . . 3.100 3.015 3.004 3.020 . 0 0 "[ . 1 . 2]" 1
1384 1 175 ILE H 1 175 ILE MD . . 3.000 1.991 1.882 2.829 . 0 0 "[ . 1 . 2]" 1
1385 1 175 ILE HA 1 175 ILE MD . . 4.500 3.078 2.116 3.370 . 0 0 "[ . 1 . 2]" 1
1386 1 175 ILE HB 1 175 ILE MD . . 3.200 2.276 2.115 3.225 0.025 20 0 "[ . 1 . 2]" 1
1387 1 175 ILE H 1 176 LEU H . . 2.800 2.531 2.316 2.615 . 0 0 "[ . 1 . 2]" 1
1388 1 175 ILE HB 1 176 LEU H . . 3.000 2.811 2.655 2.948 . 0 0 "[ . 1 . 2]" 1
1389 1 175 ILE MD 1 176 LEU H . . 5.000 3.865 3.655 4.494 . 0 0 "[ . 1 . 2]" 1
1390 1 175 ILE HA 1 178 ASN H . . 4.000 3.556 3.370 3.707 . 0 0 "[ . 1 . 2]" 1
1391 1 175 ILE MD 1 178 ASN H . . 6.000 5.456 4.952 5.601 . 0 0 "[ . 1 . 2]" 1
1392 1 175 ILE MD 1 178 ASN HD21 . . 4.800 4.565 3.578 4.802 0.002 13 0 "[ . 1 . 2]" 1
1393 1 175 ILE HB 1 179 PHE H . . 6.000 5.761 5.422 6.015 0.015 5 0 "[ . 1 . 2]" 1
1394 1 176 LEU H 1 176 LEU HA . . 3.000 2.874 2.834 2.888 . 0 0 "[ . 1 . 2]" 1
1395 1 176 LEU H 1 176 LEU HB3 . . 3.000 2.921 2.843 3.064 0.064 20 0 "[ . 1 . 2]" 1
1396 1 176 LEU H 1 176 LEU MD1 . . 5.500 4.275 4.248 4.304 . 0 0 "[ . 1 . 2]" 1
1397 1 176 LEU H 1 176 LEU MD2 . . 5.350 3.549 3.315 3.733 . 0 0 "[ . 1 . 2]" 1
1398 1 176 LEU HA 1 176 LEU MD1 . . 3.500 2.577 2.325 2.687 . 0 0 "[ . 1 . 2]" 1
1399 1 176 LEU H 1 177 LYS H . . 2.800 2.412 2.352 2.573 . 0 0 "[ . 1 . 2]" 1
1400 1 176 LEU HB3 1 177 LYS H . . 3.500 2.954 2.779 3.152 . 0 0 "[ . 1 . 2]" 1
1401 1 176 LEU HB3 1 177 LYS HA . . 4.500 4.037 3.986 4.072 . 0 0 "[ . 1 . 2]" 1
1402 1 176 LEU MD2 1 177 LYS H . . 5.500 4.699 4.651 4.737 . 0 0 "[ . 1 . 2]" 1
1403 1 176 LEU HB2 1 178 ASN H . . 5.750 5.618 5.486 5.763 0.013 7 0 "[ . 1 . 2]" 1
1404 1 176 LEU H 1 179 PHE H . . 4.800 4.685 4.566 4.843 0.043 5 0 "[ . 1 . 2]" 1
1405 1 176 LEU HA 1 179 PHE H . . 3.750 3.788 3.745 3.836 0.086 13 0 "[ . 1 . 2]" 1
1406 1 176 LEU HA 1 180 CYS H . . 3.800 3.646 3.522 3.804 0.004 7 0 "[ . 1 . 2]" 1
1407 1 176 LEU HB3 1 180 CYS H . . 5.500 5.417 5.194 5.514 0.014 13 0 "[ . 1 . 2]" 1
1408 1 177 LYS H 1 177 LYS HA . . 3.000 2.892 2.884 2.900 . 0 0 "[ . 1 . 2]" 1
1409 1 177 LYS H 1 177 LYS HB3 . . 2.500 2.457 2.352 2.502 0.002 11 0 "[ . 1 . 2]" 1
1410 1 177 LYS H 1 178 ASN HB2 . . 4.200 4.315 4.286 4.349 0.149 7 0 "[ . 1 . 2]" 1
1411 1 177 LYS H 1 178 ASN HD21 . . 5.800 5.799 5.663 5.848 0.048 5 0 "[ . 1 . 2]" 1
1412 1 177 LYS HB3 1 178 ASN H . . 2.750 2.724 2.607 2.771 0.021 12 0 "[ . 1 . 2]" 1
1413 1 177 LYS HB3 1 179 PHE H . . 5.500 5.114 4.967 5.222 . 0 0 "[ . 1 . 2]" 1
1414 1 177 LYS HA 1 180 CYS HG . . 3.000 2.820 2.621 2.925 . 0 0 "[ . 1 . 2]" 1
1415 1 178 ASN H 1 178 ASN HA . . 3.000 2.850 2.822 2.856 . 0 0 "[ . 1 . 2]" 1
1416 1 178 ASN H 1 178 ASN HB2 . . 2.500 2.233 2.182 2.292 . 0 0 "[ . 1 . 2]" 1
1417 1 178 ASN H 1 178 ASN HD21 . . 4.000 4.015 3.912 4.043 0.043 12 0 "[ . 1 . 2]" 1
1418 1 178 ASN H 1 179 PHE H . . 2.800 2.558 2.521 2.611 . 0 0 "[ . 1 . 2]" 1
1419 1 178 ASN HB2 1 179 PHE H . . 3.000 2.760 2.702 2.851 . 0 0 "[ . 1 . 2]" 1
1420 1 178 ASN H 1 181 LYS HB2 . . 5.000 4.851 4.754 5.068 0.068 7 0 "[ . 1 . 2]" 1
1421 1 178 ASN HA 1 181 LYS H . . 3.800 3.786 3.697 3.835 0.035 7 0 "[ . 1 . 2]" 1
1422 1 178 ASN HA 1 182 VAL H . . 4.300 4.295 4.220 4.329 0.029 7 0 "[ . 1 . 2]" 1
1423 1 178 ASN HB2 1 182 VAL H . . 6.000 6.028 6.013 6.049 0.049 20 0 "[ . 1 . 2]" 1
1424 1 179 PHE H 1 179 PHE HB2 . . 3.000 2.718 2.642 2.783 . 0 0 "[ . 1 . 2]" 1
1425 1 179 PHE H 1 179 PHE QD . . 4.750 4.133 4.099 4.163 . 0 0 "[ . 1 . 2]" 1
1426 1 179 PHE H 1 180 CYS H . . 2.800 2.733 2.645 2.819 0.019 16 0 "[ . 1 . 2]" 1
1427 1 179 PHE QD 1 180 CYS H . . 4.000 2.591 2.544 2.662 . 0 0 "[ . 1 . 2]" 1
1428 1 179 PHE QE 1 180 CYS H . . 5.750 4.841 4.796 4.919 . 0 0 "[ . 1 . 2]" 1
1429 1 179 PHE H 1 181 LYS HB2 . . 5.000 4.749 4.693 4.833 . 0 0 "[ . 1 . 2]" 1
1430 1 179 PHE HA 1 182 VAL HB . . 3.000 2.703 2.591 2.814 . 0 0 "[ . 1 . 2]" 1
1431 1 179 PHE HB2 1 182 VAL H . . 5.500 5.449 5.389 5.506 0.006 4 0 "[ . 1 . 2]" 1
1432 1 180 CYS H 1 180 CYS HB2 . . 3.600 3.534 3.528 3.545 . 0 0 "[ . 1 . 2]" 1
1433 1 180 CYS H 1 180 CYS HB3 . . 2.500 2.256 2.242 2.281 . 0 0 "[ . 1 . 2]" 1
1434 1 180 CYS H 1 181 LYS H . . 2.800 2.738 2.720 2.752 . 0 0 "[ . 1 . 2]" 1
1435 1 180 CYS H 1 181 LYS HB2 . . 5.500 4.731 4.664 4.825 . 0 0 "[ . 1 . 2]" 1
1436 1 180 CYS H 1 181 LYS HG2 . . 5.500 5.270 4.820 5.389 . 0 0 "[ . 1 . 2]" 1
1437 1 180 CYS HA 1 181 LYS H . . 3.500 3.445 3.441 3.453 . 0 0 "[ . 1 . 2]" 1
1438 1 180 CYS HB2 1 181 LYS H . . 4.200 4.193 4.172 4.214 0.014 11 0 "[ . 1 . 2]" 1
1439 1 180 CYS HG 1 182 VAL H . . 4.500 4.472 4.417 4.513 0.013 4 0 "[ . 1 . 2]" 1
1440 1 181 LYS H 1 181 LYS HA . . 3.000 2.899 2.895 2.904 . 0 0 "[ . 1 . 2]" 1
1441 1 181 LYS H 1 181 LYS HB2 . . 2.500 2.236 2.189 2.301 . 0 0 "[ . 1 . 2]" 1
1442 1 181 LYS H 1 181 LYS HE2 . . 4.500 4.552 4.516 4.718 0.218 7 0 "[ . 1 . 2]" 1
1443 1 181 LYS H 1 181 LYS HG2 . . 3.500 3.166 2.838 3.253 . 0 0 "[ . 1 . 2]" 1
1444 1 181 LYS H 1 182 VAL H . . 2.800 2.351 2.298 2.399 . 0 0 "[ . 1 . 2]" 1
1445 1 181 LYS HB2 1 182 VAL H . . 3.000 2.822 2.678 2.958 . 0 0 "[ . 1 . 2]" 1
1446 1 181 LYS HB3 1 182 VAL MG2 . . 5.500 3.962 3.838 4.163 . 0 0 "[ . 1 . 2]" 1
1447 1 181 LYS HB2 1 183 CYS H . . 5.300 5.209 5.127 5.299 . 0 0 "[ . 1 . 2]" 1
1448 1 181 LYS HA 1 184 GLY H . . 3.200 3.151 3.095 3.223 0.023 20 0 "[ . 1 . 2]" 1
1449 1 181 LYS H 1 185 TYR H . . 6.000 6.101 6.074 6.131 0.131 4 0 "[ . 1 . 2]" 1
1450 1 181 LYS HE2 1 185 TYR H . . 4.800 4.769 4.440 4.826 0.026 10 0 "[ . 1 . 2]" 1
1451 1 182 VAL H 1 182 VAL HA . . 3.000 2.801 2.775 2.828 . 0 0 "[ . 1 . 2]" 1
1452 1 182 VAL H 1 182 VAL MG2 . . 3.500 2.359 2.230 2.420 . 0 0 "[ . 1 . 2]" 1
1453 1 182 VAL H 1 182 VAL HB . . 2.500 2.457 2.417 2.503 0.003 4 0 "[ . 1 . 2]" 1
1454 1 182 VAL HA 1 182 VAL HB . . 3.000 3.018 3.013 3.020 0.020 4 0 "[ . 1 . 2]" 1
1455 1 182 VAL HA 1 182 VAL MG2 . . 3.000 2.286 2.241 2.338 . 0 0 "[ . 1 . 2]" 1
1456 1 182 VAL H 1 183 CYS H . . 2.800 2.706 2.626 2.782 . 0 0 "[ . 1 . 2]" 1
1457 1 182 VAL HA 1 183 CYS H . . 3.500 3.535 3.533 3.538 0.038 6 0 "[ . 1 . 2]" 1
1458 1 182 VAL HB 1 183 CYS H . . 3.000 2.660 2.638 2.679 . 0 0 "[ . 1 . 2]" 1
1459 1 182 VAL HB 1 183 CYS HA . . 4.750 4.586 4.555 4.643 . 0 0 "[ . 1 . 2]" 1
1460 1 182 VAL MG2 1 183 CYS H . . 5.000 3.939 3.911 3.978 . 0 0 "[ . 1 . 2]" 1
1461 1 183 CYS H 1 183 CYS HA . . 3.000 2.934 2.933 2.935 . 0 0 "[ . 1 . 2]" 1
1462 1 183 CYS H 1 183 CYS HB2 . . 3.750 3.626 3.620 3.633 . 0 0 "[ . 1 . 2]" 1
1463 1 183 CYS H 1 183 CYS HB3 . . 3.150 3.088 3.066 3.114 . 0 0 "[ . 1 . 2]" 1
1464 1 183 CYS H 1 183 CYS HG . . 4.000 3.792 3.778 3.805 . 0 0 "[ . 1 . 2]" 1
1465 1 183 CYS HA 1 183 CYS HB3 . . 3.000 2.356 2.348 2.363 . 0 0 "[ . 1 . 2]" 1
1466 1 183 CYS HB2 1 184 GLY H . . 4.100 4.001 3.983 4.022 . 0 0 "[ . 1 . 2]" 1
1467 1 183 CYS HB3 1 184 GLY H . . 4.500 4.339 4.332 4.352 . 0 0 "[ . 1 . 2]" 1
1468 1 183 CYS HG 1 184 GLY H . . 5.000 4.824 4.808 4.846 . 0 0 "[ . 1 . 2]" 1
1469 1 184 GLY H 1 184 GLY HA2 . . 3.000 2.826 2.823 2.835 . 0 0 "[ . 1 . 2]" 1
1470 1 184 GLY H 1 184 GLY HA3 . . 2.500 2.297 2.296 2.299 . 0 0 "[ . 1 . 2]" 1
1471 1 184 GLY H 1 185 TYR HB3 . . 5.000 4.721 4.696 4.733 . 0 0 "[ . 1 . 2]" 1
1472 1 184 GLY HA2 1 185 TYR H . . 3.500 3.487 3.468 3.505 0.005 16 0 "[ . 1 . 2]" 1
1473 1 184 GLY HA3 1 185 TYR H . . 3.000 2.967 2.923 3.011 0.011 20 0 "[ . 1 . 2]" 1
1474 1 185 TYR H 1 185 TYR HA . . 3.000 2.741 2.740 2.745 . 0 0 "[ . 1 . 2]" 1
1475 1 185 TYR H 1 185 TYR HB3 . . 2.500 2.321 2.311 2.333 . 0 0 "[ . 1 . 2]" 1
1476 1 185 TYR H 1 185 TYR QD . . 3.500 1.924 1.902 1.945 . 0 0 "[ . 1 . 2]" 1
1477 1 185 TYR H 1 185 TYR QE . . 5.500 4.286 4.257 4.309 . 0 0 "[ . 1 . 2]" 1
1478 1 185 TYR HA 1 185 TYR QD . . 4.500 3.681 3.673 3.690 . 0 0 "[ . 1 . 2]" 1
1479 1 185 TYR H 1 186 LYS H . . 4.500 4.526 4.470 4.536 0.036 19 0 "[ . 1 . 2]" 1
1480 1 185 TYR HA 1 186 LYS H . . 2.500 2.144 2.137 2.147 . 0 0 "[ . 1 . 2]" 1
1481 1 186 LYS H 1 186 LYS HA . . 3.000 2.931 2.929 2.945 . 0 0 "[ . 1 . 2]" 1
1482 1 186 LYS H 1 186 LYS HB2 . . 3.000 2.918 2.798 2.942 . 0 0 "[ . 1 . 2]" 1
1483 1 186 LYS H 1 186 LYS HB3 . . 3.100 3.061 2.991 3.119 0.019 20 0 "[ . 1 . 2]" 1
1484 1 186 LYS H 1 186 LYS HE3 . . 4.500 4.517 4.500 4.597 0.097 20 0 "[ . 1 . 2]" 1
1485 1 186 LYS H 1 186 LYS HG3 . . 4.500 4.581 4.527 4.668 0.168 20 0 "[ . 1 . 2]" 1
1486 1 186 LYS H 1 186 LYS QZ . . 6.000 4.228 3.575 5.814 . 0 0 "[ . 1 . 2]" 1
1487 1 186 LYS HA 1 186 LYS HG3 . . 2.500 2.220 2.134 2.457 . 0 0 "[ . 1 . 2]" 1
1488 1 186 LYS HA 1 187 PHE H . . 2.500 2.472 2.432 2.478 . 0 0 "[ . 1 . 2]" 1
1489 1 186 LYS HB2 1 187 PHE H . . 4.000 3.905 3.894 3.971 . 0 0 "[ . 1 . 2]" 1
1490 1 186 LYS HB3 1 187 PHE H . . 3.000 3.061 3.031 3.076 0.076 20 0 "[ . 1 . 2]" 1
1491 1 186 LYS HB3 1 187 PHE HA . . 4.500 4.424 4.392 4.437 . 0 0 "[ . 1 . 2]" 1
1492 1 186 LYS HE3 1 187 PHE H . . 5.200 4.175 3.613 5.130 . 0 0 "[ . 1 . 2]" 1
1493 1 186 LYS HG3 1 187 PHE H . . 2.500 1.945 1.895 2.217 . 0 0 "[ . 1 . 2]" 1
1494 1 187 PHE H 1 187 PHE HA . . 3.000 2.945 2.944 2.945 . 0 0 "[ . 1 . 2]" 1
1495 1 187 PHE H 1 187 PHE HB2 . . 3.000 2.710 2.704 2.714 . 0 0 "[ . 1 . 2]" 1
1496 1 187 PHE H 1 187 PHE HB3 . . 4.000 3.754 3.753 3.756 . 0 0 "[ . 1 . 2]" 1
1497 1 187 PHE H 1 187 PHE QD . . 4.000 2.982 2.435 3.369 . 0 0 "[ . 1 . 2]" 1
1498 1 187 PHE H 1 188 GLU H . . 4.490 4.514 4.513 4.515 0.025 4 0 "[ . 1 . 2]" 1
1499 1 187 PHE HB2 1 188 GLU H . . 3.700 3.702 3.697 3.706 0.006 2 0 "[ . 1 . 2]" 1
1500 1 187 PHE HB3 1 188 GLU H . . 3.000 2.796 2.785 2.805 . 0 0 "[ . 1 . 2]" 1
1501 1 187 PHE HB3 1 188 GLU HB2 . . 5.000 4.887 4.575 4.998 . 0 0 "[ . 1 . 2]" 1
1502 1 187 PHE QD 1 188 GLU H . . 5.000 4.112 4.067 4.209 . 0 0 "[ . 1 . 2]" 1
1503 1 188 GLU H 1 188 GLU HA . . 3.000 2.899 2.833 2.928 . 0 0 "[ . 1 . 2]" 1
1504 1 188 GLU H 1 188 GLU HB2 . . 3.750 2.315 2.103 2.549 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 109
_Distance_constraint_stats_list.Viol_count 438
_Distance_constraint_stats_list.Viol_total 308.831
_Distance_constraint_stats_list.Viol_max 0.159
_Distance_constraint_stats_list.Viol_rms 0.0198
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0071
_Distance_constraint_stats_list.Viol_average_violations_only 0.0353
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ILE 1.153 0.058 9 0 "[ . 1 . 2]"
1 3 VAL 0.050 0.023 16 0 "[ . 1 . 2]"
1 4 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 5 LEU 2.406 0.100 12 0 "[ . 1 . 2]"
1 6 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 VAL 1.478 0.127 15 0 "[ . 1 . 2]"
1 13 HIS 0.015 0.009 15 0 "[ . 1 . 2]"
1 14 ARG 0.131 0.027 5 0 "[ . 1 . 2]"
1 15 ILE 0.062 0.012 8 0 "[ . 1 . 2]"
1 16 HIS 1.548 0.127 15 0 "[ . 1 . 2]"
1 17 ARG 0.522 0.159 7 0 "[ . 1 . 2]"
1 18 SER 0.169 0.039 2 0 "[ . 1 . 2]"
1 19 LEU 0.062 0.012 8 0 "[ . 1 . 2]"
1 20 LYS 0.069 0.033 15 0 "[ . 1 . 2]"
1 21 TYR 0.508 0.159 7 0 "[ . 1 . 2]"
1 22 ILE 0.039 0.039 2 0 "[ . 1 . 2]"
1 25 SER 0.555 0.045 5 0 "[ . 1 . 2]"
1 27 LYS 0.598 0.058 9 0 "[ . 1 . 2]"
1 29 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLU 0.017 0.017 20 0 "[ . 1 . 2]"
1 39 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 SER 0.017 0.017 20 0 "[ . 1 . 2]"
1 46 GLY 0.050 0.023 16 0 "[ . 1 . 2]"
1 47 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 ILE 1.150 0.100 12 0 "[ . 1 . 2]"
1 49 LEU 0.079 0.033 9 0 "[ . 1 . 2]"
1 50 SER 1.256 0.088 20 0 "[ . 1 . 2]"
1 61 CYS 0.573 0.054 17 0 "[ . 1 . 2]"
1 62 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 ALA 0.573 0.054 17 0 "[ . 1 . 2]"
1 66 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 ILE 0.079 0.033 9 0 "[ . 1 . 2]"
1 77 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 GLY 0.773 0.132 12 0 "[ . 1 . 2]"
1 79 HIS 1.081 0.145 12 0 "[ . 1 . 2]"
1 80 GLN 0.677 0.110 12 0 "[ . 1 . 2]"
1 81 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 ILE 0.853 0.132 12 0 "[ . 1 . 2]"
1 83 ALA 1.081 0.145 12 0 "[ . 1 . 2]"
1 84 LEU 0.677 0.110 12 0 "[ . 1 . 2]"
1 85 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 TYR 0.080 0.020 17 0 "[ . 1 . 2]"
1 89 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 GLY 0.020 0.013 6 0 "[ . 1 . 2]"
1 93 ALA 0.652 0.064 10 0 "[ . 1 . 2]"
1 101 THR 0.116 0.023 8 0 "[ . 1 . 2]"
1 103 VAL 0.348 0.103 8 0 "[ . 1 . 2]"
1 105 VAL 0.252 0.045 10 0 "[ . 1 . 2]"
1 117 ARG 0.252 0.045 10 0 "[ . 1 . 2]"
1 119 PHE 0.348 0.103 8 0 "[ . 1 . 2]"
1 121 ALA 0.116 0.023 8 0 "[ . 1 . 2]"
1 126 LYS 0.652 0.064 10 0 "[ . 1 . 2]"
1 128 GLU 0.020 0.013 6 0 "[ . 1 . 2]"
1 130 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 137 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 139 LEU 0.158 0.033 20 0 "[ . 1 . 2]"
1 149 ALA 0.158 0.033 20 0 "[ . 1 . 2]"
1 150 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 151 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 152 HIS 0.385 0.090 4 0 "[ . 1 . 2]"
1 157 ILE 0.385 0.090 4 0 "[ . 1 . 2]"
1 159 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 172 GLY 2.733 0.134 19 0 "[ . 1 . 2]"
1 173 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 174 GLU 0.121 0.072 20 0 "[ . 1 . 2]"
1 175 ILE 0.094 0.019 5 0 "[ . 1 . 2]"
1 176 LEU 3.963 0.134 19 0 "[ . 1 . 2]"
1 177 LYS 0.142 0.026 13 0 "[ . 1 . 2]"
1 178 ASN 0.121 0.072 20 0 "[ . 1 . 2]"
1 179 PHE 0.094 0.019 5 0 "[ . 1 . 2]"
1 180 CYS 1.230 0.088 4 0 "[ . 1 . 2]"
1 181 LYS 0.142 0.026 13 0 "[ . 1 . 2]"
1 182 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 183 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 ILE H 1 25 SER O . . 2.300 2.327 2.296 2.345 0.045 5 0 "[ . 1 . 2]" 2
2 1 2 ILE N 1 25 SER O . . 3.300 3.286 3.253 3.302 0.002 5 0 "[ . 1 . 2]" 2
3 1 3 VAL H 1 46 GLY O . . 2.300 2.284 2.229 2.323 0.023 16 0 "[ . 1 . 2]" 2
4 1 3 VAL N 1 46 GLY O . . 3.300 3.237 3.185 3.271 . 0 0 "[ . 1 . 2]" 2
5 1 4 ILE H 1 27 LYS O . . 2.300 2.021 1.789 2.272 . 0 0 "[ . 1 . 2]" 2
6 1 4 ILE N 1 27 LYS O . . 3.300 2.989 2.753 3.238 . 0 0 "[ . 1 . 2]" 2
7 1 5 LEU H 1 48 ILE O . . 2.300 2.357 2.313 2.400 0.100 12 0 "[ . 1 . 2]" 2
8 1 5 LEU N 1 48 ILE O . . 3.300 3.051 2.950 3.193 . 0 0 "[ . 1 . 2]" 2
9 1 6 ASP H 1 29 VAL O . . 2.300 2.176 2.079 2.219 . 0 0 "[ . 1 . 2]" 2
10 1 6 ASP N 1 29 VAL O . . 3.300 3.127 3.032 3.174 . 0 0 "[ . 1 . 2]" 2
11 1 12 VAL O 1 16 HIS H . . 2.400 2.470 2.436 2.527 0.127 15 0 "[ . 1 . 2]" 2
12 1 12 VAL O 1 16 HIS N . . 3.400 3.390 3.360 3.441 0.041 15 0 "[ . 1 . 2]" 2
13 1 13 HIS O 1 17 ARG H . . 2.300 2.079 1.868 2.309 0.009 15 0 "[ . 1 . 2]" 2
14 1 13 HIS O 1 17 ARG N . . 3.300 2.962 2.763 3.259 . 0 0 "[ . 1 . 2]" 2
15 1 14 ARG O 1 18 SER H . . 2.300 2.263 2.091 2.327 0.027 5 0 "[ . 1 . 2]" 2
16 1 14 ARG O 1 18 SER N . . 3.300 3.169 3.029 3.296 . 0 0 "[ . 1 . 2]" 2
17 1 15 ILE O 1 19 LEU H . . 2.300 2.150 1.803 2.312 0.012 8 0 "[ . 1 . 2]" 2
18 1 15 ILE O 1 19 LEU N . . 3.300 3.088 2.725 3.274 . 0 0 "[ . 1 . 2]" 2
19 1 16 HIS O 1 20 LYS H . . 2.300 2.210 1.979 2.333 0.033 15 0 "[ . 1 . 2]" 2
20 1 16 HIS O 1 20 LYS N . . 3.300 3.118 2.939 3.211 . 0 0 "[ . 1 . 2]" 2
21 1 17 ARG O 1 21 TYR H . . 2.300 2.278 1.950 2.459 0.159 7 0 "[ . 1 . 2]" 2
22 1 17 ARG O 1 21 TYR N . . 3.300 3.210 2.844 3.315 0.015 11 0 "[ . 1 . 2]" 2
23 1 18 SER O 1 22 ILE H . . 2.300 2.146 1.917 2.339 0.039 2 0 "[ . 1 . 2]" 2
24 1 18 SER O 1 22 ILE N . . 3.300 2.946 2.732 3.139 . 0 0 "[ . 1 . 2]" 2
25 1 2 ILE O 1 27 LYS H . . 2.300 2.319 2.178 2.358 0.058 9 0 "[ . 1 . 2]" 2
26 1 2 ILE O 1 27 LYS N . . 3.300 3.213 3.078 3.256 . 0 0 "[ . 1 . 2]" 2
27 1 4 ILE O 1 29 VAL H . . 2.300 1.856 1.794 1.998 . 0 0 "[ . 1 . 2]" 2
28 1 35 LEU O 1 39 GLU H . . 2.300 2.037 1.920 2.144 . 0 0 "[ . 1 . 2]" 2
29 1 35 LEU O 1 39 GLU N . . 3.300 2.906 2.736 3.021 . 0 0 "[ . 1 . 2]" 2
30 1 36 GLU O 1 40 SER H . . 2.300 2.115 2.039 2.317 0.017 20 0 "[ . 1 . 2]" 2
31 1 36 GLU O 1 40 SER N . . 3.300 2.742 2.690 2.920 . 0 0 "[ . 1 . 2]" 2
32 1 47 ILE H 1 71 PRO O . . 2.600 2.010 1.925 2.078 . 0 0 "[ . 1 . 2]" 2
33 1 47 ILE N 1 71 PRO O . . 3.500 2.936 2.845 2.995 . 0 0 "[ . 1 . 2]" 2
34 1 3 VAL O 1 48 ILE H . . 2.300 2.056 1.968 2.218 . 0 0 "[ . 1 . 2]" 2
35 1 3 VAL O 1 48 ILE N . . 3.300 2.985 2.898 3.137 . 0 0 "[ . 1 . 2]" 2
36 1 49 LEU H 1 73 LEU O . . 2.300 2.038 1.923 2.152 . 0 0 "[ . 1 . 2]" 2
37 1 49 LEU N 1 73 LEU O . . 3.300 2.986 2.887 3.099 . 0 0 "[ . 1 . 2]" 2
38 1 5 LEU O 1 50 SER H . . 2.300 2.362 2.330 2.388 0.088 20 0 "[ . 1 . 2]" 2
39 1 5 LEU O 1 50 SER N . . 3.300 3.225 3.187 3.313 0.013 2 0 "[ . 1 . 2]" 2
40 1 61 CYS O 1 65 ALA H . . 2.500 2.481 2.234 2.533 0.033 6 0 "[ . 1 . 2]" 2
41 1 61 CYS O 1 65 ALA N . . 3.300 3.275 3.023 3.354 0.054 17 0 "[ . 1 . 2]" 2
42 1 62 ILE O 1 66 LEU H . . 2.600 2.390 2.201 2.494 . 0 0 "[ . 1 . 2]" 2
43 1 62 ILE O 1 66 LEU N . . 3.450 3.260 3.109 3.361 . 0 0 "[ . 1 . 2]" 2
44 1 63 ASP O 1 67 ASN H . . 2.300 2.045 1.983 2.104 . 0 0 "[ . 1 . 2]" 2
45 1 63 ASP O 1 67 ASN N . . 3.300 2.754 2.732 2.820 . 0 0 "[ . 1 . 2]" 2
46 1 47 ILE O 1 73 LEU H . . 2.300 1.800 1.780 1.860 . 0 0 "[ . 1 . 2]" 2
47 1 47 ILE O 1 73 LEU N . . 3.300 2.749 2.729 2.804 . 0 0 "[ . 1 . 2]" 2
48 1 49 LEU O 1 75 ILE H . . 2.300 2.093 1.931 2.333 0.033 9 0 "[ . 1 . 2]" 2
49 1 49 LEU O 1 75 ILE N . . 3.300 3.013 2.823 3.257 . 0 0 "[ . 1 . 2]" 2
50 1 77 LEU O 1 81 LEU H . . 2.300 2.093 1.841 2.262 . 0 0 "[ . 1 . 2]" 2
51 1 77 LEU O 1 81 LEU N . . 3.300 2.872 2.736 3.047 . 0 0 "[ . 1 . 2]" 2
52 1 78 GLY O 1 82 ILE H . . 2.300 2.333 2.241 2.432 0.132 12 0 "[ . 1 . 2]" 2
53 1 78 GLY O 1 82 ILE N . . 3.300 3.198 3.089 3.260 . 0 0 "[ . 1 . 2]" 2
54 1 79 HIS O 1 83 ALA H . . 2.600 2.644 2.576 2.745 0.145 12 0 "[ . 1 . 2]" 2
55 1 79 HIS O 1 83 ALA N . . 3.500 3.501 3.444 3.545 0.045 9 0 "[ . 1 . 2]" 2
56 1 80 GLN O 1 84 LEU H . . 2.300 2.323 2.195 2.410 0.110 12 0 "[ . 1 . 2]" 2
57 1 80 GLN O 1 84 LEU N . . 3.300 3.289 3.161 3.324 0.024 16 0 "[ . 1 . 2]" 2
58 1 81 LEU O 1 85 ALA H . . 3.000 2.546 2.223 2.957 . 0 0 "[ . 1 . 2]" 2
59 1 81 LEU O 1 85 ALA N . . 3.600 3.315 3.001 3.596 . 0 0 "[ . 1 . 2]" 2
60 1 82 ILE O 1 86 TYR H . . 2.300 2.248 2.071 2.320 0.020 17 0 "[ . 1 . 2]" 2
61 1 82 ILE O 1 86 TYR N . . 3.300 3.070 2.938 3.148 . 0 0 "[ . 1 . 2]" 2
62 1 91 GLY H 1 128 GLU O . . 2.300 2.208 1.969 2.313 0.013 6 0 "[ . 1 . 2]" 2
63 1 91 GLY N 1 128 GLU O . . 3.300 3.180 2.945 3.284 . 0 0 "[ . 1 . 2]" 2
64 1 93 ALA H 1 126 LYS O . . 2.300 2.333 2.305 2.364 0.064 10 0 "[ . 1 . 2]" 2
65 1 93 ALA N 1 126 LYS O . . 3.300 3.226 3.202 3.272 . 0 0 "[ . 1 . 2]" 2
66 1 101 THR H 1 121 ALA O . . 2.300 2.233 2.054 2.323 0.023 8 0 "[ . 1 . 2]" 2
67 1 101 THR N 1 121 ALA O . . 3.300 2.885 2.741 3.108 . 0 0 "[ . 1 . 2]" 2
68 1 103 VAL H 1 119 PHE O . . 2.300 1.944 1.860 2.111 . 0 0 "[ . 1 . 2]" 2
69 1 103 VAL N 1 119 PHE O . . 3.300 2.896 2.800 3.058 . 0 0 "[ . 1 . 2]" 2
70 1 105 VAL H 1 117 ARG O . . 4.000 3.935 3.404 4.045 0.045 10 0 "[ . 1 . 2]" 2
71 1 105 VAL N 1 117 ARG O . . 3.500 3.378 2.909 3.499 . 0 0 "[ . 1 . 2]" 2
72 1 103 VAL O 1 119 PHE H . . 2.300 2.294 2.220 2.403 0.103 8 0 "[ . 1 . 2]" 2
73 1 103 VAL O 1 119 PHE N . . 3.300 3.216 3.151 3.314 0.014 8 0 "[ . 1 . 2]" 2
74 1 101 THR O 1 121 ALA H . . 2.300 1.950 1.862 2.117 . 0 0 "[ . 1 . 2]" 2
75 1 101 THR O 1 121 ALA N . . 3.300 2.774 2.727 2.963 . 0 0 "[ . 1 . 2]" 2
76 1 91 GLY O 1 128 GLU H . . 2.300 2.060 1.841 2.213 . 0 0 "[ . 1 . 2]" 2
77 1 91 GLY O 1 128 GLU N . . 3.300 2.912 2.749 3.025 . 0 0 "[ . 1 . 2]" 2
78 1 89 GLU O 1 130 LYS H . . 2.300 1.792 1.769 1.846 . 0 0 "[ . 1 . 2]" 2
79 1 89 GLU O 1 130 LYS N . . 3.300 2.717 2.685 2.742 . 0 0 "[ . 1 . 2]" 2
80 1 137 GLU H 1 151 LYS O . . 2.300 1.850 1.721 2.012 . 0 0 "[ . 1 . 2]" 2
81 1 137 GLU N 1 151 LYS O . . 3.300 2.740 2.690 2.848 . 0 0 "[ . 1 . 2]" 2
82 1 139 LEU H 1 149 ALA O . . 2.300 2.255 2.086 2.333 0.033 20 0 "[ . 1 . 2]" 2
83 1 139 LEU N 1 149 ALA O . . 3.300 3.117 2.973 3.207 . 0 0 "[ . 1 . 2]" 2
84 1 152 HIS H 1 157 ILE O . . 2.300 2.173 1.893 2.320 0.020 16 0 "[ . 1 . 2]" 2
85 1 152 HIS N 1 157 ILE O . . 3.300 3.059 2.807 3.212 . 0 0 "[ . 1 . 2]" 2
86 1 150 MET H 1 159 GLY O . . 2.300 1.802 1.760 1.874 . 0 0 "[ . 1 . 2]" 2
87 1 150 MET N 1 159 GLY O . . 3.300 2.757 2.723 2.818 . 0 0 "[ . 1 . 2]" 2
88 1 137 GLU O 1 151 LYS H . . 2.300 1.782 1.750 1.911 . 0 0 "[ . 1 . 2]" 2
89 1 137 GLU O 1 151 LYS N . . 3.300 2.742 2.693 2.886 . 0 0 "[ . 1 . 2]" 2
90 1 152 HIS O 1 157 ILE H . . 3.300 3.295 3.194 3.390 0.090 4 0 "[ . 1 . 2]" 2
91 1 152 HIS O 1 157 ILE N . . 4.300 4.273 4.173 4.370 0.070 4 0 "[ . 1 . 2]" 2
92 1 150 MET O 1 159 GLY H . . 2.300 2.014 1.864 2.090 . 0 0 "[ . 1 . 2]" 2
93 1 150 MET O 1 159 GLY N . . 3.300 2.706 2.655 2.745 . 0 0 "[ . 1 . 2]" 2
94 1 172 GLY O 1 176 LEU H . . 2.300 2.404 2.340 2.434 0.134 19 0 "[ . 1 . 2]" 2
95 1 172 GLY O 1 176 LEU N . . 3.300 3.327 3.244 3.365 0.065 7 0 "[ . 1 . 2]" 2
96 1 173 ASN O 1 177 LYS H . . 2.300 1.929 1.820 1.992 . 0 0 "[ . 1 . 2]" 2
97 1 173 ASN O 1 177 LYS N . . 3.300 2.723 2.682 2.748 . 0 0 "[ . 1 . 2]" 2
98 1 174 GLU O 1 178 ASN H . . 2.300 1.894 1.802 2.372 0.072 20 0 "[ . 1 . 2]" 2
99 1 174 GLU O 1 178 ASN N . . 3.300 2.779 2.717 3.257 . 0 0 "[ . 1 . 2]" 2
100 1 175 ILE O 1 179 PHE H . . 2.300 2.221 1.834 2.319 0.019 5 0 "[ . 1 . 2]" 2
101 1 175 ILE O 1 179 PHE N . . 3.300 3.115 2.741 3.254 . 0 0 "[ . 1 . 2]" 2
102 1 176 LEU O 1 180 CYS H . . 2.300 2.361 2.337 2.388 0.088 4 0 "[ . 1 . 2]" 2
103 1 176 LEU O 1 180 CYS N . . 3.300 3.242 3.212 3.269 . 0 0 "[ . 1 . 2]" 2
104 1 177 LYS O 1 181 LYS H . . 2.600 2.591 2.399 2.626 0.026 13 0 "[ . 1 . 2]" 2
105 1 177 LYS O 1 181 LYS N . . 3.300 3.261 3.141 3.306 0.006 13 0 "[ . 1 . 2]" 2
106 1 178 ASN O 1 182 VAL H . . 2.300 2.133 2.034 2.243 . 0 0 "[ . 1 . 2]" 2
107 1 178 ASN O 1 182 VAL N . . 3.300 2.980 2.836 3.122 . 0 0 "[ . 1 . 2]" 2
108 1 179 PHE O 1 183 CYS H . . 2.300 2.155 2.123 2.199 . 0 0 "[ . 1 . 2]" 2
109 1 179 PHE O 1 183 CYS N . . 3.300 3.106 3.071 3.153 . 0 0 "[ . 1 . 2]" 2
stop_
save_
Contact the webmaster for help, if required. Saturday, June 1, 2024 4:24:00 AM GMT (wattos1)