NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
376674 |
1fnx   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1fnx
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 1245
_Distance_constraint_stats_list.Viol_count 3101
_Distance_constraint_stats_list.Viol_total 4828.083
_Distance_constraint_stats_list.Viol_max 0.518
_Distance_constraint_stats_list.Viol_rms 0.0343
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0088
_Distance_constraint_stats_list.Viol_average_violations_only 0.0741
_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 A 24.513 0.434 7 0 "[ . 1 . 2 ]"
1 3 U 23.409 0.518 8 1 "[ . + 1 . 2 ]"
1 4 U 4.640 0.220 7 0 "[ . 1 . 2 ]"
1 6 A 10.753 0.455 12 0 "[ . 1 . 2 ]"
1 7 U 4.515 0.197 19 0 "[ . 1 . 2 ]"
1 8 U 5.588 0.256 5 0 "[ . 1 . 2 ]"
1 9 U 15.247 0.362 3 0 "[ . 1 . 2 ]"
2 1 MET 0.154 0.142 15 0 "[ . 1 . 2 ]"
2 2 ASP 0.553 0.142 15 0 "[ . 1 . 2 ]"
2 3 SER 0.617 0.140 10 0 "[ . 1 . 2 ]"
2 4 LYS 0.415 0.072 3 0 "[ . 1 . 2 ]"
2 5 THR 0.910 0.119 6 0 "[ . 1 . 2 ]"
2 6 ASN 0.980 0.145 10 0 "[ . 1 . 2 ]"
2 7 LEU 2.313 0.198 6 0 "[ . 1 . 2 ]"
2 8 ILE 5.763 0.497 12 0 "[ . 1 . 2 ]"
2 9 VAL 0.788 0.108 7 0 "[ . 1 . 2 ]"
2 10 ASN 3.138 0.197 19 0 "[ . 1 . 2 ]"
2 11 TYR 1.603 0.220 7 0 "[ . 1 . 2 ]"
2 12 LEU 1.547 0.249 2 0 "[ . 1 . 2 ]"
2 13 PRO 0.006 0.006 17 0 "[ . 1 . 2 ]"
2 14 GLN 0.173 0.079 4 0 "[ . 1 . 2 ]"
2 15 ASN 0.464 0.214 4 0 "[ . 1 . 2 ]"
2 16 MET 0.094 0.042 4 0 "[ . 1 . 2 ]"
2 17 THR 0.947 0.070 19 0 "[ . 1 . 2 ]"
2 18 GLN 1.970 0.070 19 0 "[ . 1 . 2 ]"
2 19 ASP 1.074 0.066 7 0 "[ . 1 . 2 ]"
2 20 GLU 1.100 0.064 3 0 "[ . 1 . 2 ]"
2 21 PHE 1.512 0.064 3 0 "[ . 1 . 2 ]"
2 22 LYS 1.481 0.105 9 0 "[ . 1 . 2 ]"
2 23 SER 1.515 0.105 9 0 "[ . 1 . 2 ]"
2 24 LEU 0.015 0.015 3 0 "[ . 1 . 2 ]"
2 25 PHE 2.504 0.123 16 0 "[ . 1 . 2 ]"
2 26 GLY 0.202 0.045 10 0 "[ . 1 . 2 ]"
2 27 SER 0.590 0.081 3 0 "[ . 1 . 2 ]"
2 28 ILE 2.027 0.081 5 0 "[ . 1 . 2 ]"
2 29 GLY 1.407 0.081 5 0 "[ . 1 . 2 ]"
2 30 ASP 0.618 0.082 14 0 "[ . 1 . 2 ]"
2 31 ILE 2.212 0.158 2 0 "[ . 1 . 2 ]"
2 32 GLU 1.213 0.082 14 0 "[ . 1 . 2 ]"
2 33 SER 1.883 0.158 2 0 "[ . 1 . 2 ]"
2 34 CYS 1.185 0.134 7 0 "[ . 1 . 2 ]"
2 35 LYS 1.973 0.203 8 0 "[ . 1 . 2 ]"
2 36 LEU 0.496 0.057 1 0 "[ . 1 . 2 ]"
2 37 VAL 12.547 0.362 3 0 "[ . 1 . 2 ]"
2 38 ARG 0.538 0.131 16 0 "[ . 1 . 2 ]"
2 39 ASP 0.442 0.149 16 0 "[ . 1 . 2 ]"
2 40 LYS 0.101 0.040 17 0 "[ . 1 . 2 ]"
2 41 ILE 1.582 0.194 16 0 "[ . 1 . 2 ]"
2 42 THR 5.647 0.222 16 0 "[ . 1 . 2 ]"
2 43 GLY 4.223 0.222 16 0 "[ . 1 . 2 ]"
2 44 GLN 7.956 0.455 12 0 "[ . 1 . 2 ]"
2 45 SER 0.071 0.038 20 0 "[ . 1 . 2 ]"
2 46 LEU 4.905 0.239 12 0 "[ . 1 . 2 ]"
2 47 GLY 0.071 0.038 20 0 "[ . 1 . 2 ]"
2 48 TYR 5.505 0.274 14 0 "[ . 1 . 2 ]"
2 49 GLY 1.034 0.104 1 0 "[ . 1 . 2 ]"
2 50 PHE 5.358 0.497 12 0 "[ . 1 . 2 ]"
2 51 VAL 0.935 0.085 5 0 "[ . 1 . 2 ]"
2 52 ASN 1.167 0.198 6 0 "[ . 1 . 2 ]"
2 53 TYR 0.633 0.119 6 0 "[ . 1 . 2 ]"
2 54 SER 0.323 0.078 2 0 "[ . 1 . 2 ]"
2 55 ASP 0.113 0.034 8 0 "[ . 1 . 2 ]"
2 56 PRO 0.011 0.011 5 0 "[ . 1 . 2 ]"
2 57 ASN 2.482 0.155 19 0 "[ . 1 . 2 ]"
2 58 ASP 1.772 0.095 15 0 "[ . 1 . 2 ]"
2 59 ALA 2.966 0.173 14 0 "[ . 1 . 2 ]"
2 60 ASP 4.672 0.173 14 0 "[ . 1 . 2 ]"
2 61 LYS 1.959 0.095 15 0 "[ . 1 . 2 ]"
2 62 ALA 0.159 0.042 5 0 "[ . 1 . 2 ]"
2 63 ILE 3.064 0.141 7 0 "[ . 1 . 2 ]"
2 64 ASN 0.863 0.102 13 0 "[ . 1 . 2 ]"
2 65 THR 0.332 0.065 11 0 "[ . 1 . 2 ]"
2 66 LEU 1.709 0.123 16 0 "[ . 1 . 2 ]"
2 67 ASN 2.723 0.141 7 0 "[ . 1 . 2 ]"
2 68 GLY 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 69 LEU 0.757 0.144 18 0 "[ . 1 . 2 ]"
2 70 LYS 0.467 0.085 20 0 "[ . 1 . 2 ]"
2 71 LEU 3.138 0.161 13 0 "[ . 1 . 2 ]"
2 72 GLN 0.663 0.095 3 0 "[ . 1 . 2 ]"
2 73 THR 1.358 0.089 15 0 "[ . 1 . 2 ]"
2 74 LYS 7.091 0.176 10 0 "[ . 1 . 2 ]"
2 75 THR 1.967 0.176 10 0 "[ . 1 . 2 ]"
2 76 ILE 0.567 0.085 20 0 "[ . 1 . 2 ]"
2 77 LYS 3.504 0.187 16 0 "[ . 1 . 2 ]"
2 78 VAL 0.333 0.072 17 0 "[ . 1 . 2 ]"
2 79 SER 0.340 0.097 15 0 "[ . 1 . 2 ]"
2 80 TYR 0.431 0.097 15 0 "[ . 1 . 2 ]"
2 81 ALA 3.027 0.256 5 0 "[ . 1 . 2 ]"
2 82 ARG 0.810 0.180 19 0 "[ . 1 . 2 ]"
2 84 SER 0.451 0.197 18 0 "[ . 1 . 2 ]"
2 85 SER 1.389 0.197 18 0 "[ . 1 . 2 ]"
2 86 ALA 0.486 0.073 18 0 "[ . 1 . 2 ]"
2 87 SER 0.034 0.030 3 0 "[ . 1 . 2 ]"
2 88 ILE 1.138 0.148 10 0 "[ . 1 . 2 ]"
2 89 ARG 0.896 0.243 1 0 "[ . 1 . 2 ]"
2 90 ASP 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 91 ALA 0.457 0.096 11 0 "[ . 1 . 2 ]"
2 92 ASN 1.938 0.133 3 0 "[ . 1 . 2 ]"
2 93 LEU 2.302 0.110 7 0 "[ . 1 . 2 ]"
2 94 TYR 17.424 0.434 7 0 "[ . 1 . 2 ]"
2 95 VAL 0.142 0.047 13 0 "[ . 1 . 2 ]"
2 96 SER 1.738 0.088 15 0 "[ . 1 . 2 ]"
2 97 GLY 0.048 0.031 3 0 "[ . 1 . 2 ]"
2 98 LEU 1.649 0.088 15 0 "[ . 1 . 2 ]"
2 99 PRO 0.139 0.027 20 0 "[ . 1 . 2 ]"
2 100 LYS 2.130 0.157 6 0 "[ . 1 . 2 ]"
2 101 THR 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 102 MET 5.707 0.181 1 0 "[ . 1 . 2 ]"
2 103 SER 0.072 0.031 16 0 "[ . 1 . 2 ]"
2 104 GLN 3.712 0.181 1 0 "[ . 1 . 2 ]"
2 105 LYS 2.249 0.161 20 0 "[ . 1 . 2 ]"
2 106 GLU 1.105 0.090 15 0 "[ . 1 . 2 ]"
2 107 MET 0.810 0.099 14 0 "[ . 1 . 2 ]"
2 108 GLU 4.616 0.175 5 0 "[ . 1 . 2 ]"
2 109 GLN 2.300 0.090 15 0 "[ . 1 . 2 ]"
2 110 LEU 6.984 0.219 11 0 "[ . 1 . 2 ]"
2 111 PHE 7.258 0.175 5 0 "[ . 1 . 2 ]"
2 112 SER 6.639 0.252 2 0 "[ . 1 . 2 ]"
2 113 GLN 0.037 0.019 3 0 "[ . 1 . 2 ]"
2 114 TYR 2.286 0.179 2 0 "[ . 1 . 2 ]"
2 115 GLY 0.189 0.050 20 0 "[ . 1 . 2 ]"
2 116 ARG 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 117 ILE 4.356 0.252 2 0 "[ . 1 . 2 ]"
2 118 ILE 3.711 0.177 5 0 "[ . 1 . 2 ]"
2 119 THR 1.060 0.077 15 0 "[ . 1 . 2 ]"
2 120 SER 0.563 0.077 15 0 "[ . 1 . 2 ]"
2 121 ARG 4.071 0.232 18 0 "[ . 1 . 2 ]"
2 122 ILE 2.134 0.170 8 0 "[ . 1 . 2 ]"
2 123 LEU 11.060 0.518 8 1 "[ . + 1 . 2 ]"
2 124 LEU 1.807 0.171 19 0 "[ . 1 . 2 ]"
2 125 ASP 1.370 0.111 15 0 "[ . 1 . 2 ]"
2 126 GLN 0.325 0.111 15 0 "[ . 1 . 2 ]"
2 127 ALA 0.150 0.052 8 0 "[ . 1 . 2 ]"
2 128 THR 0.161 0.053 8 0 "[ . 1 . 2 ]"
2 129 GLY 2.010 0.240 3 0 "[ . 1 . 2 ]"
2 130 VAL 3.754 0.240 3 0 "[ . 1 . 2 ]"
2 131 SER 1.313 0.116 2 0 "[ . 1 . 2 ]"
2 132 ARG 3.600 0.171 19 0 "[ . 1 . 2 ]"
2 133 GLY 0.438 0.070 13 0 "[ . 1 . 2 ]"
2 134 VAL 7.861 0.341 7 0 "[ . 1 . 2 ]"
2 135 GLY 3.837 0.237 11 0 "[ . 1 . 2 ]"
2 136 PHE 18.098 0.294 4 0 "[ . 1 . 2 ]"
2 137 ILE 5.961 0.232 18 0 "[ . 1 . 2 ]"
2 138 ARG 0.685 0.080 17 0 "[ . 1 . 2 ]"
2 139 PHE 6.041 0.179 2 0 "[ . 1 . 2 ]"
2 140 ASP 2.165 0.153 2 0 "[ . 1 . 2 ]"
2 141 LYS 1.158 0.153 2 0 "[ . 1 . 2 ]"
2 142 ARG 0.185 0.075 7 0 "[ . 1 . 2 ]"
2 143 ILE 1.365 0.120 4 0 "[ . 1 . 2 ]"
2 144 GLU 3.133 0.159 16 0 "[ . 1 . 2 ]"
2 145 ALA 4.972 0.159 16 0 "[ . 1 . 2 ]"
2 146 GLU 1.233 0.102 11 0 "[ . 1 . 2 ]"
2 147 GLU 1.365 0.120 4 0 "[ . 1 . 2 ]"
2 148 ALA 0.048 0.021 17 0 "[ . 1 . 2 ]"
2 149 ILE 3.675 0.128 2 0 "[ . 1 . 2 ]"
2 150 LYS 0.289 0.080 7 0 "[ . 1 . 2 ]"
2 151 GLY 0.048 0.021 17 0 "[ . 1 . 2 ]"
2 152 LEU 2.896 0.169 18 0 "[ . 1 . 2 ]"
2 153 ASN 3.517 0.169 18 0 "[ . 1 . 2 ]"
2 154 GLY 2.801 0.394 13 0 "[ . 1 . 2 ]"
2 155 GLN 5.289 0.394 13 0 "[ . 1 . 2 ]"
2 156 LYS 0.614 0.140 9 0 "[ . 1 . 2 ]"
2 157 PRO 0.784 0.139 17 0 "[ . 1 . 2 ]"
2 158 LEU 3.143 0.204 6 0 "[ . 1 . 2 ]"
2 159 GLY 0.106 0.059 8 0 "[ . 1 . 2 ]"
2 160 ALA 2.525 0.204 6 0 "[ . 1 . 2 ]"
2 161 ALA 1.783 0.189 2 0 "[ . 1 . 2 ]"
2 162 GLU 2.173 0.189 2 0 "[ . 1 . 2 ]"
2 163 PRO 1.113 0.135 21 0 "[ . 1 . 2 ]"
2 164 ILE 4.709 0.304 6 0 "[ . 1 . 2 ]"
2 165 THR 3.348 0.297 21 0 "[ . 1 . 2 ]"
2 166 VAL 0.308 0.042 1 0 "[ . 1 . 2 ]"
2 167 LYS 0.426 0.060 1 0 "[ . 1 . 2 ]"
2 168 PHE 0.510 0.060 1 0 "[ . 1 . 2 ]"
2 169 ALA 1.207 0.139 12 0 "[ . 1 . 2 ]"
2 170 ASN 0.816 0.092 20 0 "[ . 1 . 2 ]"
2 171 ASN 0.046 0.028 3 0 "[ . 1 . 2 ]"
2 173 SER 0.157 0.108 15 0 "[ . 1 . 2 ]"
2 174 GLN 0.157 0.108 15 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 2 2 ASP H 2 3 SER H 3.400 . 5.000 4.243 2.774 4.642 . 0 0 "[ . 1 . 2 ]" 1
2 2 4 LYS H 2 5 THR H 2.600 . 3.500 2.613 2.036 3.506 0.006 16 0 "[ . 1 . 2 ]" 1
3 2 5 THR H 2 6 ASN H 2.600 . 3.500 2.821 2.074 3.576 0.076 16 0 "[ . 1 . 2 ]" 1
4 2 11 TYR H 2 12 LEU H 2.600 . 3.500 2.651 2.426 2.895 . 0 0 "[ . 1 . 2 ]" 1
5 2 14 GLN H 2 15 ASN H 2.600 . 3.500 3.015 2.859 3.579 0.079 4 0 "[ . 1 . 2 ]" 1
6 2 15 ASN H 2 16 MET H 2.600 . 3.500 2.526 2.130 2.674 . 0 0 "[ . 1 . 2 ]" 1
7 2 18 GLN H 2 19 ASP H 2.600 . 3.500 2.757 2.576 2.912 . 0 0 "[ . 1 . 2 ]" 1
8 2 19 ASP H 2 20 GLU H 2.600 . 3.500 2.882 2.644 3.090 . 0 0 "[ . 1 . 2 ]" 1
9 2 20 GLU H 2 21 PHE H 2.600 . 3.500 2.762 2.665 2.845 . 0 0 "[ . 1 . 2 ]" 1
10 2 22 LYS H 2 23 SER H 2.600 . 3.500 2.793 2.581 2.960 . 0 0 "[ . 1 . 2 ]" 1
11 2 23 SER H 2 24 LEU H 2.600 . 3.500 2.871 2.615 3.114 . 0 0 "[ . 1 . 2 ]" 1
12 2 24 LEU H 2 25 PHE H 3.400 . 5.000 3.009 2.882 3.175 . 0 0 "[ . 1 . 2 ]" 1
13 2 25 PHE H 2 26 GLY H 2.600 . 3.500 2.527 2.342 2.741 . 0 0 "[ . 1 . 2 ]" 1
14 2 26 GLY H 2 27 SER H 2.600 . 3.500 2.860 2.325 3.144 . 0 0 "[ . 1 . 2 ]" 1
15 2 27 SER H 2 28 ILE H 2.600 . 3.500 3.479 2.700 3.581 0.081 3 0 "[ . 1 . 2 ]" 1
16 2 29 GLY H 2 30 ASP H 3.400 . 5.000 4.264 3.824 4.500 . 0 0 "[ . 1 . 2 ]" 1
17 2 32 GLU H 2 33 SER H 2.600 . 3.500 2.862 2.720 3.026 . 0 0 "[ . 1 . 2 ]" 1
18 2 40 LYS H 2 41 ILE H 2.600 . 3.500 2.430 2.050 3.540 0.040 17 0 "[ . 1 . 2 ]" 1
19 2 41 ILE H 2 42 THR H 2.600 . 3.500 2.209 2.037 2.581 . 0 0 "[ . 1 . 2 ]" 1
20 2 42 THR H 2 43 GLY H 2.600 . 3.500 2.240 1.955 2.821 . 0 0 "[ . 1 . 2 ]" 1
21 2 43 GLY H 2 44 GLN H 2.600 . 3.500 2.362 1.975 3.068 . 0 0 "[ . 1 . 2 ]" 1
22 2 46 LEU H 2 47 GLY H 2.600 . 3.500 2.769 2.222 3.202 . 0 0 "[ . 1 . 2 ]" 1
23 2 47 GLY H 2 48 TYR H 2.600 . 3.500 2.597 2.121 3.289 . 0 0 "[ . 1 . 2 ]" 1
24 2 54 SER H 2 55 ASP H 2.600 . 3.500 2.766 2.417 3.096 . 0 0 "[ . 1 . 2 ]" 1
25 2 57 ASN H 2 58 ASP H 2.600 . 3.500 2.965 2.688 3.229 . 0 0 "[ . 1 . 2 ]" 1
26 2 58 ASP H 2 59 ALA H 2.600 . 3.500 2.618 2.448 2.739 . 0 0 "[ . 1 . 2 ]" 1
27 2 59 ALA H 2 60 ASP H 2.100 . 2.500 2.632 2.587 2.673 0.173 14 0 "[ . 1 . 2 ]" 1
28 2 61 LYS H 2 62 ALA H 2.600 . 3.500 2.733 2.602 2.833 . 0 0 "[ . 1 . 2 ]" 1
29 2 62 ALA H 2 63 ILE H 2.600 . 3.500 2.705 2.486 2.821 . 0 0 "[ . 1 . 2 ]" 1
30 2 63 ILE H 2 64 ASN H 2.600 . 3.500 2.790 2.624 2.928 . 0 0 "[ . 1 . 2 ]" 1
31 2 64 ASN H 2 65 THR H 2.600 . 3.500 2.964 2.778 3.322 . 0 0 "[ . 1 . 2 ]" 1
32 2 65 THR H 2 66 LEU H 2.600 . 3.500 2.176 1.977 2.426 . 0 0 "[ . 1 . 2 ]" 1
33 2 66 LEU H 2 67 ASN H 2.600 . 3.500 2.565 2.345 2.834 . 0 0 "[ . 1 . 2 ]" 1
34 2 68 GLY H 2 69 LEU H 2.600 . 3.500 2.233 1.939 2.600 . 0 0 "[ . 1 . 2 ]" 1
35 2 69 LEU H 2 70 LYS H 3.400 . 5.000 4.260 3.870 4.585 . 0 0 "[ . 1 . 2 ]" 1
36 2 73 THR H 2 74 LYS H 2.600 . 3.500 2.349 2.000 3.141 . 0 0 "[ . 1 . 2 ]" 1
37 2 75 THR H 2 76 ILE H 3.400 . 5.000 4.154 3.178 4.543 . 0 0 "[ . 1 . 2 ]" 1
38 2 1 MET HA 2 2 ASP H 2.100 . 2.500 2.265 2.149 2.642 0.142 15 0 "[ . 1 . 2 ]" 1
39 2 2 ASP HA 2 3 SER H 2.100 . 2.500 2.390 2.143 2.640 0.140 10 0 "[ . 1 . 2 ]" 1
40 2 3 SER HA 2 4 LYS H 2.600 . 3.500 2.891 2.195 3.560 0.060 11 0 "[ . 1 . 2 ]" 1
41 2 4 LYS HA 2 5 THR H 2.600 . 3.500 3.036 2.150 3.572 0.072 3 0 "[ . 1 . 2 ]" 1
42 2 5 THR HA 2 6 ASN H 3.400 . 5.000 2.976 2.460 3.513 . 0 0 "[ . 1 . 2 ]" 1
43 2 6 ASN HA 2 7 LEU H 2.600 . 3.500 2.384 2.192 2.564 . 0 0 "[ . 1 . 2 ]" 1
44 2 7 LEU HA 2 8 ILE H 2.600 . 3.500 2.181 2.151 2.242 . 0 0 "[ . 1 . 2 ]" 1
45 2 8 ILE HA 2 9 VAL H 2.600 . 3.500 2.118 2.085 2.201 . 0 0 "[ . 1 . 2 ]" 1
46 2 9 VAL HA 2 10 ASN H 2.600 . 3.500 2.196 2.154 2.292 . 0 0 "[ . 1 . 2 ]" 1
47 2 10 ASN HA 2 11 TYR H 2.600 . 3.500 2.354 2.206 2.590 . 0 0 "[ . 1 . 2 ]" 1
48 2 11 TYR HA 2 12 LEU H 2.600 . 3.500 2.699 2.411 2.972 . 0 0 "[ . 1 . 2 ]" 1
49 2 13 PRO HA 2 14 GLN H 2.100 . 2.500 2.221 2.182 2.268 . 0 0 "[ . 1 . 2 ]" 1
50 2 15 ASN HA 2 16 MET H 2.600 . 3.500 3.412 3.218 3.542 0.042 4 0 "[ . 1 . 2 ]" 1
51 2 16 MET HA 2 17 THR H 2.600 . 3.500 2.296 2.162 2.490 . 0 0 "[ . 1 . 2 ]" 1
52 2 17 THR HA 2 18 GLN H 2.600 . 3.500 2.475 2.378 2.583 . 0 0 "[ . 1 . 2 ]" 1
53 2 18 GLN HA 2 19 ASP H 2.600 . 3.500 3.551 3.533 3.566 0.066 7 0 "[ . 1 . 2 ]" 1
54 2 19 ASP HA 2 20 GLU H 3.400 . 5.000 3.569 3.533 3.601 . 0 0 "[ . 1 . 2 ]" 1
55 2 20 GLU HA 2 21 PHE H 2.600 . 3.500 3.552 3.542 3.564 0.064 3 0 "[ . 1 . 2 ]" 1
56 2 22 LYS HA 2 23 SER H 3.400 . 5.000 3.554 3.538 3.570 . 0 0 "[ . 1 . 2 ]" 1
57 2 25 PHE HA 2 26 GLY H 3.400 . 5.000 3.438 3.131 3.557 . 0 0 "[ . 1 . 2 ]" 1
58 2 26 GLY HA3 2 27 SER H 2.600 . 3.500 2.844 2.728 3.006 . 0 0 "[ . 1 . 2 ]" 1
59 2 27 SER HA 2 28 ILE H 3.400 . 5.000 2.651 2.563 3.470 . 0 0 "[ . 1 . 2 ]" 1
60 2 28 ILE HA 2 29 GLY H 2.600 . 3.500 3.567 3.556 3.581 0.081 5 0 "[ . 1 . 2 ]" 1
61 2 29 GLY HA2 2 30 ASP H 2.600 . 3.500 2.896 2.240 3.489 . 0 0 "[ . 1 . 2 ]" 1
62 2 29 GLY HA3 2 30 ASP H 2.600 . 3.500 2.346 2.125 2.926 . 0 0 "[ . 1 . 2 ]" 1
63 2 30 ASP HA 2 31 ILE H 2.100 . 2.500 2.200 2.114 2.299 . 0 0 "[ . 1 . 2 ]" 1
64 2 31 ILE HA 2 32 GLU H 2.600 . 3.500 2.230 2.183 2.293 . 0 0 "[ . 1 . 2 ]" 1
65 2 33 SER HA 2 34 CYS H 2.100 . 2.500 2.429 2.265 2.515 0.015 21 0 "[ . 1 . 2 ]" 1
66 2 34 CYS HA 2 35 LYS H 2.100 . 2.500 2.467 2.363 2.565 0.065 4 0 "[ . 1 . 2 ]" 1
67 2 35 LYS HA 2 36 LEU H 2.600 . 3.500 2.410 2.287 2.584 . 0 0 "[ . 1 . 2 ]" 1
68 2 36 LEU HA 2 37 VAL H 2.100 . 2.500 2.224 2.166 2.339 . 0 0 "[ . 1 . 2 ]" 1
69 2 37 VAL HA 2 38 ARG H 2.100 . 2.500 2.183 2.057 2.452 . 0 0 "[ . 1 . 2 ]" 1
70 2 38 ARG HA 2 39 ASP H 2.600 . 3.500 2.200 2.134 2.363 . 0 0 "[ . 1 . 2 ]" 1
71 2 39 ASP HA 2 40 LYS H 2.100 . 2.500 2.275 2.153 2.521 0.021 16 0 "[ . 1 . 2 ]" 1
72 2 40 LYS HA 2 41 ILE H 2.600 . 3.500 3.046 2.597 3.540 0.040 16 0 "[ . 1 . 2 ]" 1
73 2 41 ILE HA 2 42 THR H 2.600 . 3.500 3.558 3.542 3.572 0.072 10 0 "[ . 1 . 2 ]" 1
74 2 43 GLY QA 2 44 GLN H 3.900 . 6.000 2.704 2.579 2.900 . 0 0 "[ . 1 . 2 ]" 1
75 2 45 SER HA 2 46 LEU H 2.600 . 3.500 2.251 2.121 2.865 . 0 0 "[ . 1 . 2 ]" 1
76 2 47 GLY QA 2 48 TYR H 3.100 . 4.500 2.513 2.197 2.752 . 0 0 "[ . 1 . 2 ]" 1
77 2 48 TYR HA 2 49 GLY H 2.600 . 3.500 2.194 2.093 2.327 . 0 0 "[ . 1 . 2 ]" 1
78 2 49 GLY HA3 2 50 PHE H 2.600 . 3.500 2.684 2.444 3.237 . 0 0 "[ . 1 . 2 ]" 1
79 2 49 GLY HA2 2 50 PHE H 2.600 . 3.500 2.494 2.146 2.733 . 0 0 "[ . 1 . 2 ]" 1
80 2 50 PHE HA 2 51 VAL H 2.600 . 3.500 2.226 2.162 2.308 . 0 0 "[ . 1 . 2 ]" 1
81 2 51 VAL HA 2 52 ASN H 2.100 . 2.500 2.166 2.111 2.214 . 0 0 "[ . 1 . 2 ]" 1
82 2 52 ASN HA 2 53 TYR H 2.600 . 3.500 2.184 2.141 2.360 . 0 0 "[ . 1 . 2 ]" 1
83 2 53 TYR HA 2 54 SER H 2.600 . 3.500 2.314 2.128 2.558 . 0 0 "[ . 1 . 2 ]" 1
84 2 57 ASN HA 2 58 ASP H 2.600 . 3.500 3.560 3.533 3.585 0.085 16 0 "[ . 1 . 2 ]" 1
85 2 58 ASP HA 2 59 ALA H 2.600 . 3.500 3.482 3.449 3.510 0.010 6 0 "[ . 1 . 2 ]" 1
86 2 60 ASP HA 2 61 LYS H 2.600 . 3.500 3.528 3.503 3.547 0.047 13 0 "[ . 1 . 2 ]" 1
87 2 63 ILE HA 2 64 ASN H 3.400 . 5.000 3.556 3.521 3.593 . 0 0 "[ . 1 . 2 ]" 1
88 2 64 ASN HA 2 65 THR H 3.400 . 5.000 3.374 2.752 3.567 . 0 0 "[ . 1 . 2 ]" 1
89 2 66 LEU HA 2 67 ASN H 2.600 . 3.500 3.240 2.932 3.423 . 0 0 "[ . 1 . 2 ]" 1
90 2 67 ASN HA 2 68 GLY H 2.600 . 3.500 2.671 2.471 2.938 . 0 0 "[ . 1 . 2 ]" 1
91 2 69 LEU HA 2 70 LYS H 2.100 . 2.500 2.211 2.151 2.335 . 0 0 "[ . 1 . 2 ]" 1
92 2 70 LYS HA 2 71 LEU H 2.100 . 2.500 2.156 2.127 2.194 . 0 0 "[ . 1 . 2 ]" 1
93 2 71 LEU HA 2 72 GLN H 2.100 . 2.500 2.471 2.131 2.595 0.095 3 0 "[ . 1 . 2 ]" 1
94 2 72 GLN HA 2 73 THR H 2.600 . 3.500 3.404 2.478 3.582 0.082 8 0 "[ . 1 . 2 ]" 1
95 2 73 THR HA 2 74 LYS H 2.600 . 3.500 3.498 3.057 3.589 0.089 15 0 "[ . 1 . 2 ]" 1
96 2 74 LYS HA 2 75 THR H 2.100 . 2.500 2.559 2.450 2.676 0.176 10 0 "[ . 1 . 2 ]" 1
97 2 76 ILE HA 2 77 LYS H 2.600 . 3.500 2.191 2.155 2.262 . 0 0 "[ . 1 . 2 ]" 1
98 2 77 LYS HA 2 78 VAL H 2.600 . 3.500 2.143 2.105 2.201 . 0 0 "[ . 1 . 2 ]" 1
99 2 78 VAL HA 2 79 SER H 2.600 . 3.500 2.211 2.152 2.280 . 0 0 "[ . 1 . 2 ]" 1
100 2 79 SER HA 2 80 TYR H 2.100 . 2.500 2.429 2.247 2.597 0.097 15 0 "[ . 1 . 2 ]" 1
101 2 80 TYR HA 2 81 ALA H 2.600 . 3.500 2.291 2.151 2.925 . 0 0 "[ . 1 . 2 ]" 1
102 2 81 ALA HA 2 82 ARG H 2.100 . 2.500 2.248 2.132 2.680 0.180 19 0 "[ . 1 . 2 ]" 1
103 2 85 SER HA 2 86 ALA H 2.600 . 3.500 3.142 2.443 3.573 0.073 18 0 "[ . 1 . 2 ]" 1
104 2 1 MET QB 2 2 ASP H 3.100 . 4.500 3.438 2.247 3.972 . 0 0 "[ . 1 . 2 ]" 1
105 2 6 ASN HB2 2 7 LEU H 3.400 . 5.000 4.600 4.443 4.681 . 0 0 "[ . 1 . 2 ]" 1
106 2 7 LEU MD1 2 8 ILE H 3.100 . 4.500 3.341 3.113 3.679 . 0 0 "[ . 1 . 2 ]" 1
107 2 9 VAL MG2 2 10 ASN H 3.900 . 6.000 4.312 4.239 4.411 . 0 0 "[ . 1 . 2 ]" 1
108 2 9 VAL MG1 2 10 ASN H 3.100 . 4.500 3.086 2.644 3.513 . 0 0 "[ . 1 . 2 ]" 1
109 2 10 ASN QB 2 11 TYR H 3.100 . 4.500 2.630 2.165 3.247 . 0 0 "[ . 1 . 2 ]" 1
110 2 13 PRO QB 2 14 GLN H 3.900 . 6.000 3.731 3.693 3.790 . 0 0 "[ . 1 . 2 ]" 1
111 2 14 GLN QB 2 15 ASN H 3.100 . 4.500 3.064 2.683 3.951 . 0 0 "[ . 1 . 2 ]" 1
112 2 14 GLN QG 2 15 ASN H 3.100 . 4.500 3.778 2.022 4.577 0.077 1 0 "[ . 1 . 2 ]" 1
113 2 15 ASN HB2 2 16 MET H 3.400 . 5.000 4.079 3.370 4.341 . 0 0 "[ . 1 . 2 ]" 1
114 2 16 MET ME 2 17 THR H 3.900 . 6.000 4.400 3.764 5.032 . 0 0 "[ . 1 . 2 ]" 1
115 2 16 MET HB3 2 17 THR H 3.400 . 5.000 3.714 3.249 4.128 . 0 0 "[ . 1 . 2 ]" 1
116 2 16 MET HG2 2 17 THR H 2.600 . 3.500 2.576 2.009 3.289 . 0 0 "[ . 1 . 2 ]" 1
117 2 17 THR HB 2 18 GLN H 2.600 . 3.500 3.528 3.477 3.570 0.070 19 0 "[ . 1 . 2 ]" 1
118 2 18 GLN QB 2 19 ASP H 3.100 . 4.500 3.039 2.341 3.518 . 0 0 "[ . 1 . 2 ]" 1
119 2 20 GLU QB 2 21 PHE H 3.900 . 6.000 2.469 2.316 2.716 . 0 0 "[ . 1 . 2 ]" 1
120 2 21 PHE HB3 2 22 LYS H 2.600 . 3.500 2.562 2.392 2.703 . 0 0 "[ . 1 . 2 ]" 1
121 2 22 LYS HB2 2 23 SER H 2.600 . 3.500 3.570 3.529 3.605 0.105 9 0 "[ . 1 . 2 ]" 1
122 2 22 LYS HB3 2 23 SER H 2.600 . 3.500 2.388 2.269 2.494 . 0 0 "[ . 1 . 2 ]" 1
123 2 23 SER QB 2 24 LEU H 3.100 . 4.500 2.490 2.212 2.669 . 0 0 "[ . 1 . 2 ]" 1
124 2 24 LEU HB2 2 25 PHE H 3.400 . 5.000 3.583 3.436 3.762 . 0 0 "[ . 1 . 2 ]" 1
125 2 24 LEU HB3 2 25 PHE H 2.600 . 3.500 2.267 2.042 2.500 . 0 0 "[ . 1 . 2 ]" 1
126 2 25 PHE HB2 2 26 GLY H 3.400 . 5.000 3.245 2.759 3.973 . 0 0 "[ . 1 . 2 ]" 1
127 2 28 ILE HB 2 29 GLY H 2.600 . 3.500 2.342 2.016 2.587 . 0 0 "[ . 1 . 2 ]" 1
128 2 28 ILE MG 2 29 GLY H 3.900 . 6.000 3.007 2.667 3.482 . 0 0 "[ . 1 . 2 ]" 1
129 2 28 ILE QG 2 29 GLY H 3.100 . 4.500 4.024 3.747 4.266 . 0 0 "[ . 1 . 2 ]" 1
130 2 30 ASP QB 2 31 ILE H 3.100 . 4.500 3.749 3.340 3.990 . 0 0 "[ . 1 . 2 ]" 1
131 2 31 ILE MG 2 32 GLU H 3.100 . 4.500 3.436 3.333 3.625 . 0 0 "[ . 1 . 2 ]" 1
132 2 32 GLU QB 2 33 SER H 3.100 . 4.500 2.702 2.460 2.901 . 0 0 "[ . 1 . 2 ]" 1
133 2 32 GLU QG 2 33 SER H 3.900 . 6.000 4.358 3.531 4.635 . 0 0 "[ . 1 . 2 ]" 1
134 2 33 SER QB 2 34 CYS H 3.100 . 4.500 2.721 2.204 3.202 . 0 0 "[ . 1 . 2 ]" 1
135 2 34 CYS HB3 2 35 LYS H 2.600 . 3.500 2.391 1.971 2.628 . 0 0 "[ . 1 . 2 ]" 1
136 2 36 LEU MD2 2 37 VAL H 3.100 . 4.500 2.752 2.297 3.195 . 0 0 "[ . 1 . 2 ]" 1
137 2 37 VAL MG1 2 38 ARG H 3.100 . 4.500 2.894 2.118 3.749 . 0 0 "[ . 1 . 2 ]" 1
138 2 39 ASP QB 2 40 LYS H 3.100 . 4.500 3.314 2.729 3.655 . 0 0 "[ . 1 . 2 ]" 1
139 2 40 LYS QB 2 41 ILE H 3.100 . 4.500 3.686 2.738 4.054 . 0 0 "[ . 1 . 2 ]" 1
140 2 41 ILE HB 2 42 THR H 2.600 . 3.500 2.369 2.123 2.612 . 0 0 "[ . 1 . 2 ]" 1
141 2 41 ILE MG 2 42 THR H 3.100 . 4.500 3.286 2.766 3.510 . 0 0 "[ . 1 . 2 ]" 1
142 2 41 ILE QG 2 42 THR H 3.100 . 4.500 3.985 3.742 4.235 . 0 0 "[ . 1 . 2 ]" 1
143 2 42 THR HB 2 43 GLY H 2.600 . 3.500 3.670 3.631 3.722 0.222 16 0 "[ . 1 . 2 ]" 1
144 2 42 THR MG 2 43 GLY H 3.900 . 6.000 1.962 1.870 2.060 . 0 0 "[ . 1 . 2 ]" 1
145 2 44 GLN QB 2 45 SER H 3.100 . 4.500 2.612 1.841 3.705 . 0 0 "[ . 1 . 2 ]" 1
146 2 44 GLN QG 2 45 SER H 3.100 . 4.500 3.779 1.898 4.478 . 0 0 "[ . 1 . 2 ]" 1
147 2 45 SER QB 2 46 LEU H 3.900 . 6.000 3.550 2.686 3.980 . 0 0 "[ . 1 . 2 ]" 1
148 2 48 TYR QD 2 49 GLY H 3.600 . 5.500 4.463 4.143 4.870 . 0 0 "[ . 1 . 2 ]" 1
149 2 50 PHE QD 2 51 VAL H 3.600 . 5.500 4.249 3.986 4.512 . 0 0 "[ . 1 . 2 ]" 1
150 2 50 PHE HB3 2 51 VAL H 2.600 . 3.500 2.925 2.592 3.517 0.017 2 0 "[ . 1 . 2 ]" 1
151 2 51 VAL MG1 2 52 ASN H 3.100 . 4.500 2.568 2.157 3.094 . 0 0 "[ . 1 . 2 ]" 1
152 2 53 TYR QD 2 54 SER H 3.600 . 5.500 3.380 2.985 3.754 . 0 0 "[ . 1 . 2 ]" 1
153 2 53 TYR HB3 2 54 SER H 3.400 . 5.000 2.764 2.051 3.785 . 0 0 "[ . 1 . 2 ]" 1
154 2 56 PRO QB 2 57 ASN H 3.100 . 4.500 3.054 2.373 3.270 . 0 0 "[ . 1 . 2 ]" 1
155 2 56 PRO QD 2 57 ASN H 3.100 . 4.500 2.976 2.646 3.295 . 0 0 "[ . 1 . 2 ]" 1
156 2 58 ASP QB 2 59 ALA H 3.100 . 4.500 2.932 2.675 3.087 . 0 0 "[ . 1 . 2 ]" 1
157 2 59 ALA MB 2 60 ASP H 3.100 . 4.500 2.410 2.338 2.523 . 0 0 "[ . 1 . 2 ]" 1
158 2 61 LYS QB 2 62 ALA H 3.100 . 4.500 2.617 2.407 3.417 . 0 0 "[ . 1 . 2 ]" 1
159 2 62 ALA MB 2 63 ILE H 3.100 . 4.500 2.445 2.250 2.601 . 0 0 "[ . 1 . 2 ]" 1
160 2 63 ILE HB 2 64 ASN H 2.600 . 3.500 2.609 2.266 2.856 . 0 0 "[ . 1 . 2 ]" 1
161 2 63 ILE MD 2 64 ASN H 3.900 . 6.000 4.629 4.309 4.823 . 0 0 "[ . 1 . 2 ]" 1
162 2 63 ILE MG 2 64 ASN H 3.100 . 4.500 3.325 2.931 3.712 . 0 0 "[ . 1 . 2 ]" 1
163 2 63 ILE QG 2 64 ASN H 3.900 . 6.000 4.065 3.766 4.274 . 0 0 "[ . 1 . 2 ]" 1
164 2 64 ASN QB 2 65 THR H 3.100 . 4.500 3.121 2.692 3.877 . 0 0 "[ . 1 . 2 ]" 1
165 2 67 ASN QB 2 68 GLY H 3.100 . 4.500 4.001 3.913 4.079 . 0 0 "[ . 1 . 2 ]" 1
166 2 69 LEU MD2 2 70 LYS H 3.100 . 4.500 3.654 3.055 4.188 . 0 0 "[ . 1 . 2 ]" 1
167 2 71 LEU HB3 2 72 GLN H 2.600 . 3.500 2.331 1.980 3.387 . 0 0 "[ . 1 . 2 ]" 1
168 2 71 LEU MD2 2 72 GLN H 3.100 . 4.500 3.107 2.759 3.544 . 0 0 "[ . 1 . 2 ]" 1
169 2 72 GLN QB 2 73 THR H 3.100 . 4.500 3.034 1.984 3.936 . 0 0 "[ . 1 . 2 ]" 1
170 2 74 LYS HB2 2 75 THR H 3.400 . 5.000 3.426 3.228 3.621 . 0 0 "[ . 1 . 2 ]" 1
171 2 74 LYS HB3 2 75 THR H 2.600 . 3.500 1.999 1.796 2.202 0.004 10 0 "[ . 1 . 2 ]" 1
172 2 75 THR MG 2 76 ILE H 3.100 . 4.500 2.918 1.831 3.973 . 0 0 "[ . 1 . 2 ]" 1
173 2 76 ILE MD 2 77 LYS H 3.900 . 6.000 4.829 3.491 5.483 . 0 0 "[ . 1 . 2 ]" 1
174 2 78 VAL MG1 2 79 SER H 3.100 . 4.500 2.505 2.161 3.262 . 0 0 "[ . 1 . 2 ]" 1
175 2 78 VAL MG2 2 79 SER H 3.100 . 4.500 4.091 3.915 4.279 . 0 0 "[ . 1 . 2 ]" 1
176 2 79 SER QB 2 80 TYR H 3.100 . 4.500 2.999 2.367 3.441 . 0 0 "[ . 1 . 2 ]" 1
177 2 80 TYR QD 2 81 ALA H 3.600 . 5.500 4.429 3.627 4.998 . 0 0 "[ . 1 . 2 ]" 1
178 2 80 TYR HB2 2 81 ALA H 3.400 . 5.000 4.204 3.896 4.502 . 0 0 "[ . 1 . 2 ]" 1
179 2 81 ALA MB 2 82 ARG H 3.100 . 4.500 3.012 1.866 3.496 . 0 0 "[ . 1 . 2 ]" 1
180 2 86 ALA MB 2 87 SER H 3.900 . 4.100 2.807 2.079 3.708 . 0 0 "[ . 1 . 2 ]" 1
181 2 8 ILE QG 2 9 VAL HA 3.100 . 4.500 3.749 3.495 4.060 . 0 0 "[ . 1 . 2 ]" 1
182 2 8 ILE HA 2 9 VAL MG2 3.100 . 4.500 3.466 3.293 3.559 . 0 0 "[ . 1 . 2 ]" 1
183 2 12 LEU MD2 2 13 PRO QD 3.600 . 5.500 2.187 1.921 2.739 . 0 0 "[ . 1 . 2 ]" 1
184 2 12 LEU HA 2 13 PRO QD 3.100 . 4.500 2.049 1.859 2.183 . 0 0 "[ . 1 . 2 ]" 1
185 2 41 ILE MG 2 42 THR HA 3.100 . 4.500 3.688 3.123 4.337 . 0 0 "[ . 1 . 2 ]" 1
186 2 41 ILE MG 2 42 THR HB 3.100 . 4.500 3.487 2.709 4.054 . 0 0 "[ . 1 . 2 ]" 1
187 2 41 ILE HB 2 42 THR MG 3.100 . 4.500 3.947 3.423 4.392 . 0 0 "[ . 1 . 2 ]" 1
188 2 50 PHE HA 2 51 VAL MG2 3.900 . 6.000 3.535 3.270 3.891 . 0 0 "[ . 1 . 2 ]" 1
189 2 52 ASN HA 2 53 TYR QD 4.400 . 7.000 4.589 3.506 5.281 . 0 0 "[ . 1 . 2 ]" 1
190 2 55 ASP HA 2 56 PRO QD 3.100 . 4.500 2.042 1.943 2.290 . 0 0 "[ . 1 . 2 ]" 1
191 2 55 ASP HA 2 56 PRO QG 3.900 . 6.000 3.938 3.846 4.210 . 0 0 "[ . 1 . 2 ]" 1
192 2 63 ILE MG 2 64 ASN HA 3.100 . 4.500 3.413 3.111 3.697 . 0 0 "[ . 1 . 2 ]" 1
193 2 65 THR MG 2 66 LEU QD 3.900 . 6.000 2.760 1.965 3.875 . 0 0 "[ . 1 . 2 ]" 1
194 2 77 LYS HA 2 78 VAL MG2 3.900 . 6.000 3.580 3.290 3.773 . 0 0 "[ . 1 . 2 ]" 1
195 2 79 SER HA 2 80 TYR QD 4.400 . 7.000 3.875 2.968 4.421 . 0 0 "[ . 1 . 2 ]" 1
196 2 5 THR MG 2 32 GLU QG 3.600 . 5.500 5.354 4.770 5.557 0.057 7 0 "[ . 1 . 2 ]" 1
197 2 5 THR MG 2 55 ASP HA 3.100 . 4.500 4.262 3.820 4.534 0.034 8 0 "[ . 1 . 2 ]" 1
198 2 7 LEU H 2 51 VAL HB 3.400 . 5.000 4.332 3.576 4.691 . 0 0 "[ . 1 . 2 ]" 1
199 2 7 LEU H 2 51 VAL H 3.400 . 5.000 3.301 2.906 3.551 . 0 0 "[ . 1 . 2 ]" 1
200 2 7 LEU H 2 52 ASN HA 2.600 . 3.500 3.484 3.064 3.698 0.198 6 0 "[ . 1 . 2 ]" 1
201 2 7 LEU MD1 2 59 ALA MB 3.600 . 5.500 2.959 2.159 3.833 . 0 0 "[ . 1 . 2 ]" 1
202 2 7 LEU MD2 2 59 ALA HA 3.100 . 4.500 3.569 2.500 4.354 . 0 0 "[ . 1 . 2 ]" 1
203 2 7 LEU MD2 2 59 ALA MB 3.600 . 5.500 2.069 1.776 2.803 0.024 21 0 "[ . 1 . 2 ]" 1
204 2 7 LEU MD1 2 63 ILE QG 3.600 . 5.500 3.095 2.511 3.968 . 0 0 "[ . 1 . 2 ]" 1
205 2 7 LEU MD1 2 78 VAL MG1 3.600 . 5.500 2.877 1.967 3.815 . 0 0 "[ . 1 . 2 ]" 1
206 2 7 LEU MD1 2 79 SER HA 3.900 . 6.000 4.045 3.313 5.136 . 0 0 "[ . 1 . 2 ]" 1
207 2 8 ILE H 2 79 SER H 3.400 . 5.000 3.230 2.818 3.739 . 0 0 "[ . 1 . 2 ]" 1
208 2 8 ILE MG 2 79 SER QB 3.600 . 5.500 2.606 2.110 3.150 . 0 0 "[ . 1 . 2 ]" 1
209 2 8 ILE H 2 80 TYR HA 3.400 . 5.000 3.326 3.044 4.107 . 0 0 "[ . 1 . 2 ]" 1
210 2 8 ILE H 2 81 ALA H 2.600 . 3.500 3.224 2.331 3.595 0.095 8 0 "[ . 1 . 2 ]" 1
211 2 8 ILE H 2 81 ALA MB 3.100 . 4.500 3.667 2.878 4.192 . 0 0 "[ . 1 . 2 ]" 1
212 2 8 ILE MD 2 81 ALA HA 3.900 . 6.000 4.183 3.801 4.698 . 0 0 "[ . 1 . 2 ]" 1
213 2 8 ILE MD 2 81 ALA MB 3.600 . 5.500 3.162 2.395 5.195 . 0 0 "[ . 1 . 2 ]" 1
214 2 8 ILE MG 2 81 ALA HA 3.100 . 4.500 2.720 1.995 3.320 . 0 0 "[ . 1 . 2 ]" 1
215 2 8 ILE MG 2 81 ALA MB 3.600 . 5.500 2.243 1.785 3.545 0.015 1 0 "[ . 1 . 2 ]" 1
216 2 9 VAL H 2 49 GLY H 2.600 . 3.500 3.008 2.718 3.265 . 0 0 "[ . 1 . 2 ]" 1
217 2 10 ASN H 2 77 LYS H 2.600 . 3.500 3.509 3.063 3.617 0.117 10 0 "[ . 1 . 2 ]" 1
218 2 10 ASN H 2 78 VAL HA 3.400 . 5.000 3.434 2.950 3.932 . 0 0 "[ . 1 . 2 ]" 1
219 2 11 TYR QD 2 77 LYS QB 3.200 . 5.500 3.429 2.425 4.434 . 0 0 "[ . 1 . 2 ]" 1
220 2 11 TYR QE 2 77 LYS QB 3.200 . 5.500 4.081 2.346 5.560 0.060 7 0 "[ . 1 . 2 ]" 1
221 2 11 TYR QE 2 77 LYS QE 3.900 . 7.000 5.884 4.196 7.044 0.044 1 0 "[ . 1 . 2 ]" 1
222 2 10 ASN HA 2 12 LEU H 3.400 . 5.000 3.719 3.213 4.505 . 0 0 "[ . 1 . 2 ]" 1
223 2 12 LEU MD1 2 16 MET ME 4.400 . 7.000 5.093 3.210 6.266 . 0 0 "[ . 1 . 2 ]" 1
224 2 12 LEU MD2 2 16 MET ME 3.600 . 5.500 4.378 2.883 5.479 . 0 0 "[ . 1 . 2 ]" 1
225 2 12 LEU MD1 2 36 LEU MD2 3.600 . 5.500 3.760 2.579 4.616 . 0 0 "[ . 1 . 2 ]" 1
226 2 12 LEU MD1 2 47 GLY QA 3.600 . 5.500 3.993 2.697 4.751 . 0 0 "[ . 1 . 2 ]" 1
227 2 12 LEU H 2 48 TYR QB 3.100 . 4.500 4.270 3.609 4.749 0.249 2 0 "[ . 1 . 2 ]" 1
228 2 12 LEU MD1 2 48 TYR HA 3.100 . 4.500 2.990 2.405 3.718 . 0 0 "[ . 1 . 2 ]" 1
229 2 13 PRO QB 2 15 ASN H 3.100 . 4.500 3.205 3.054 3.353 . 0 0 "[ . 1 . 2 ]" 1
230 2 16 MET ME 2 21 PHE HA 3.100 . 4.500 2.409 1.798 4.188 0.002 9 0 "[ . 1 . 2 ]" 1
231 2 17 THR H 2 20 GLU QB 3.900 . 6.000 2.825 2.188 3.607 . 0 0 "[ . 1 . 2 ]" 1
232 2 18 GLN H 2 36 LEU MD1 3.100 . 4.500 4.078 3.441 4.522 0.022 10 0 "[ . 1 . 2 ]" 1
233 2 9 VAL HB 2 21 PHE QE 3.600 . 5.500 3.437 2.425 3.983 . 0 0 "[ . 1 . 2 ]" 1
234 2 9 VAL MG2 2 21 PHE QE 4.200 . 6.500 3.260 2.423 3.905 . 0 0 "[ . 1 . 2 ]" 1
235 2 9 VAL MG1 2 21 PHE QE 4.200 . 6.500 2.939 2.175 3.717 . 0 0 "[ . 1 . 2 ]" 1
236 2 9 VAL HB 2 21 PHE HZ 2.600 . 3.500 2.789 2.143 3.514 0.014 20 0 "[ . 1 . 2 ]" 1
237 2 9 VAL MG2 2 21 PHE HZ 3.100 . 4.500 2.417 1.898 3.048 . 0 0 "[ . 1 . 2 ]" 1
238 2 9 VAL MG1 2 21 PHE HZ 3.100 . 4.500 3.351 2.373 4.312 . 0 0 "[ . 1 . 2 ]" 1
239 2 12 LEU MD2 2 21 PHE QD 4.200 . 6.500 3.020 2.387 3.854 . 0 0 "[ . 1 . 2 ]" 1
240 2 12 LEU MD1 2 21 PHE QE 4.200 . 6.500 2.971 2.427 4.601 . 0 0 "[ . 1 . 2 ]" 1
241 2 12 LEU MD2 2 21 PHE QE 4.200 . 6.500 2.300 1.872 2.991 . 0 0 "[ . 1 . 2 ]" 1
242 2 16 MET HG2 2 21 PHE H 3.400 . 5.000 3.114 2.761 3.462 . 0 0 "[ . 1 . 2 ]" 1
243 2 18 GLN HA 2 21 PHE QD 3.600 . 5.500 3.626 2.961 4.625 . 0 0 "[ . 1 . 2 ]" 1
244 2 18 GLN HA 2 21 PHE HB2 2.600 . 3.500 3.396 3.107 3.536 0.036 3 0 "[ . 1 . 2 ]" 1
245 2 18 GLN HA 2 21 PHE HB3 2.600 . 3.500 2.520 2.208 3.093 . 0 0 "[ . 1 . 2 ]" 1
246 2 21 PHE QD 2 36 LEU MD2 4.200 . 6.500 5.878 5.130 6.450 . 0 0 "[ . 1 . 2 ]" 1
247 2 21 PHE QE 2 49 GLY HA3 4.400 . 7.000 3.167 2.676 3.723 . 0 0 "[ . 1 . 2 ]" 1
248 2 21 PHE QE 2 49 GLY HA2 3.600 . 5.500 4.264 3.366 4.839 . 0 0 "[ . 1 . 2 ]" 1
249 2 21 PHE HZ 2 49 GLY HA3 2.600 . 3.500 3.181 2.489 3.509 0.009 20 0 "[ . 1 . 2 ]" 1
250 2 21 PHE HZ 2 49 GLY HA2 3.400 . 5.000 4.793 3.915 5.056 0.056 6 0 "[ . 1 . 2 ]" 1
251 2 21 PHE HZ 2 51 VAL MG2 3.100 . 4.500 3.162 2.362 3.592 . 0 0 "[ . 1 . 2 ]" 1
252 2 21 PHE HZ 2 51 VAL MG1 3.900 . 6.000 5.668 4.952 6.023 0.023 3 0 "[ . 1 . 2 ]" 1
253 2 19 ASP HA 2 22 LYS QD 3.100 . 4.500 3.736 3.268 4.501 0.001 3 0 "[ . 1 . 2 ]" 1
254 2 16 MET ME 2 24 LEU MD1 3.600 . 5.500 4.525 3.460 5.515 0.015 3 0 "[ . 1 . 2 ]" 1
255 2 16 MET ME 2 24 LEU MD2 3.600 . 5.500 3.812 2.367 5.104 . 0 0 "[ . 1 . 2 ]" 1
256 2 9 VAL HB 2 25 PHE QE 3.600 . 5.500 4.513 4.136 4.986 . 0 0 "[ . 1 . 2 ]" 1
257 2 9 VAL MG2 2 25 PHE QE 4.900 . 8.000 2.754 2.446 3.164 . 0 0 "[ . 1 . 2 ]" 1
258 2 9 VAL MG1 2 25 PHE QE 4.200 . 6.500 2.921 2.426 3.304 . 0 0 "[ . 1 . 2 ]" 1
259 2 9 VAL HA 2 25 PHE HZ 3.400 . 5.000 4.996 4.567 5.108 0.108 7 0 "[ . 1 . 2 ]" 1
260 2 9 VAL MG2 2 25 PHE HZ 2.600 . 3.500 2.287 1.971 2.915 . 0 0 "[ . 1 . 2 ]" 1
261 2 9 VAL MG1 2 25 PHE HZ 2.600 . 3.500 2.329 2.048 2.983 . 0 0 "[ . 1 . 2 ]" 1
262 2 21 PHE QE 2 25 PHE QD 4.700 . 7.500 3.583 2.723 4.346 . 0 0 "[ . 1 . 2 ]" 1
263 2 22 LYS HA 2 25 PHE H 3.400 . 5.000 3.809 3.533 4.235 . 0 0 "[ . 1 . 2 ]" 1
264 2 25 PHE QD 2 31 ILE MD 4.200 . 6.500 4.413 3.507 5.597 . 0 0 "[ . 1 . 2 ]" 1
265 2 25 PHE QE 2 51 VAL MG2 4.200 . 6.500 3.133 2.369 4.096 . 0 0 "[ . 1 . 2 ]" 1
266 2 25 PHE QE 2 51 VAL MG1 4.200 . 6.500 4.187 3.514 4.973 . 0 0 "[ . 1 . 2 ]" 1
267 2 25 PHE QD 2 53 TYR QE 4.700 . 7.500 3.708 2.863 4.320 . 0 0 "[ . 1 . 2 ]" 1
268 2 25 PHE HZ 2 66 LEU HB2 2.600 . 3.500 3.565 3.457 3.623 0.123 16 0 "[ . 1 . 2 ]" 1
269 2 25 PHE HZ 2 66 LEU QD 3.900 . 6.000 2.867 2.389 4.156 . 0 0 "[ . 1 . 2 ]" 1
270 2 25 PHE QE 2 78 VAL MG1 4.200 . 6.500 3.041 1.996 3.760 . 0 0 "[ . 1 . 2 ]" 1
271 2 25 PHE HZ 2 78 VAL MG1 3.100 . 4.500 3.789 2.787 4.390 . 0 0 "[ . 1 . 2 ]" 1
272 2 25 PHE HZ 2 78 VAL MG2 2.600 . 3.500 2.026 1.743 2.265 0.057 7 0 "[ . 1 . 2 ]" 1
273 2 23 SER HA 2 26 GLY H 2.600 . 3.500 3.384 3.232 3.526 0.026 20 0 "[ . 1 . 2 ]" 1
274 2 26 GLY H 2 31 ILE MD 3.100 . 4.500 3.362 2.053 3.913 . 0 0 "[ . 1 . 2 ]" 1
275 2 24 LEU HA 2 27 SER H 3.400 . 5.000 4.449 3.841 4.876 . 0 0 "[ . 1 . 2 ]" 1
276 2 28 ILE MG 2 58 ASP QB 4.400 . 7.000 4.224 3.173 5.030 . 0 0 "[ . 1 . 2 ]" 1
277 2 28 ILE MG 2 61 LYS QB 3.600 . 5.500 4.427 3.132 5.526 0.026 10 0 "[ . 1 . 2 ]" 1
278 2 28 ILE MG 2 62 ALA HA 3.100 . 4.500 3.237 2.222 4.241 . 0 0 "[ . 1 . 2 ]" 1
279 2 25 PHE HB2 2 31 ILE MD 3.100 . 4.500 3.568 1.891 4.502 0.002 17 0 "[ . 1 . 2 ]" 1
280 2 25 PHE HB3 2 31 ILE MD 3.100 . 4.500 2.989 2.151 4.288 . 0 0 "[ . 1 . 2 ]" 1
281 2 26 GLY HA3 2 31 ILE MD 3.100 . 4.500 3.198 2.510 3.605 . 0 0 "[ . 1 . 2 ]" 1
282 2 26 GLY HA2 2 31 ILE MD 3.100 . 4.500 1.906 1.755 2.964 0.045 10 0 "[ . 1 . 2 ]" 1
283 2 31 ILE MG 2 33 SER HA 3.100 . 4.500 3.291 2.863 3.704 . 0 0 "[ . 1 . 2 ]" 1
284 2 31 ILE MG 2 34 CYS HB2 3.100 . 4.500 4.199 3.261 4.467 . 0 0 "[ . 1 . 2 ]" 1
285 2 31 ILE MG 2 34 CYS HB3 3.100 . 4.500 4.221 3.749 4.524 0.024 3 0 "[ . 1 . 2 ]" 1
286 2 31 ILE HA 2 53 TYR HA 2.600 . 3.500 3.176 2.643 3.538 0.038 18 0 "[ . 1 . 2 ]" 1
287 2 31 ILE MG 2 53 TYR HA 3.100 . 4.500 4.223 3.521 4.544 0.044 3 0 "[ . 1 . 2 ]" 1
288 2 32 GLU H 2 53 TYR HA 2.600 . 3.500 2.633 2.316 3.171 . 0 0 "[ . 1 . 2 ]" 1
289 2 32 GLU H 2 54 SER H 3.400 . 5.000 3.458 3.019 4.213 . 0 0 "[ . 1 . 2 ]" 1
290 2 32 GLU QB 2 54 SER HA 3.100 . 4.500 3.705 2.780 4.539 0.039 11 0 "[ . 1 . 2 ]" 1
291 2 32 GLU QB 2 54 SER QB 4.400 . 7.000 3.811 2.845 4.836 . 0 0 "[ . 1 . 2 ]" 1
292 2 32 GLU QG 2 54 SER HA 3.100 . 4.500 3.194 2.254 4.075 . 0 0 "[ . 1 . 2 ]" 1
293 2 31 ILE HA 2 33 SER H 2.600 . 3.500 3.585 3.527 3.658 0.158 2 0 "[ . 1 . 2 ]" 1
294 2 31 ILE MG 2 33 SER H 3.100 . 4.500 2.640 2.382 2.910 . 0 0 "[ . 1 . 2 ]" 1
295 2 33 SER H 2 53 TYR HA 3.400 . 5.000 4.263 3.863 4.904 . 0 0 "[ . 1 . 2 ]" 1
296 2 31 ILE MG 2 34 CYS H 3.100 . 4.500 4.168 3.791 4.518 0.018 20 0 "[ . 1 . 2 ]" 1
297 2 34 CYS HB3 2 51 VAL HA 3.400 . 5.000 3.406 2.965 4.019 . 0 0 "[ . 1 . 2 ]" 1
298 2 21 PHE QD 2 35 LYS H 4.400 . 7.000 5.080 4.133 5.787 . 0 0 "[ . 1 . 2 ]" 1
299 2 21 PHE QE 2 35 LYS H 3.600 . 5.500 3.819 2.682 4.539 . 0 0 "[ . 1 . 2 ]" 1
300 2 35 LYS H 2 50 PHE H 2.600 . 3.500 2.570 2.320 2.918 . 0 0 "[ . 1 . 2 ]" 1
301 2 35 LYS H 2 51 VAL HA 3.000 . 4.000 3.811 3.357 4.085 0.085 5 0 "[ . 1 . 2 ]" 1
302 2 17 THR HA 2 36 LEU MD1 3.100 . 4.500 4.344 3.706 4.557 0.057 1 0 "[ . 1 . 2 ]" 1
303 2 18 GLN QB 2 36 LEU H 3.900 . 6.000 5.658 4.634 6.032 0.032 14 0 "[ . 1 . 2 ]" 1
304 2 18 GLN QB 2 36 LEU HB3 3.100 . 4.500 4.118 3.541 4.528 0.028 7 0 "[ . 1 . 2 ]" 1
305 2 18 GLN HA 2 36 LEU MD1 3.100 . 4.500 3.058 2.577 3.602 . 0 0 "[ . 1 . 2 ]" 1
306 2 36 LEU MD1 2 38 ARG QD 4.400 . 7.000 5.078 3.611 6.893 . 0 0 "[ . 1 . 2 ]" 1
307 2 37 VAL MG1 2 46 LEU HG 3.100 . 4.500 4.473 4.193 4.623 0.123 9 0 "[ . 1 . 2 ]" 1
308 2 37 VAL MG1 2 46 LEU HB2 3.100 . 4.500 3.163 2.540 3.645 . 0 0 "[ . 1 . 2 ]" 1
309 2 37 VAL MG1 2 46 LEU HB3 3.100 . 4.500 4.294 3.079 4.655 0.155 5 0 "[ . 1 . 2 ]" 1
310 2 37 VAL MG1 2 46 LEU QD 3.900 . 6.000 2.443 1.865 4.309 0.035 1 0 "[ . 1 . 2 ]" 1
311 2 37 VAL H 2 48 TYR H 3.400 . 5.000 3.616 2.407 4.365 . 0 0 "[ . 1 . 2 ]" 1
312 2 38 ARG HE 2 43 GLY QA 3.900 . 6.000 5.321 3.165 6.097 0.097 14 0 "[ . 1 . 2 ]" 1
313 2 39 ASP QB 2 43 GLY QA 3.600 . 5.500 3.765 1.651 5.062 0.149 16 0 "[ . 1 . 2 ]" 1
314 2 39 ASP H 2 44 GLN H 3.400 . 5.000 4.658 3.188 5.106 0.106 11 0 "[ . 1 . 2 ]" 1
315 2 39 ASP H 2 46 LEU QD 3.900 . 6.000 4.625 3.241 6.043 0.043 3 0 "[ . 1 . 2 ]" 1
316 2 41 ILE H 2 43 GLY H 2.600 . 3.500 3.240 2.836 3.694 0.194 16 0 "[ . 1 . 2 ]" 1
317 2 39 ASP QB 2 42 THR H 3.900 . 6.000 3.721 3.074 4.385 . 0 0 "[ . 1 . 2 ]" 1
318 2 42 THR MG 2 44 GLN QG 3.600 . 5.500 2.954 1.754 4.252 0.046 14 0 "[ . 1 . 2 ]" 1
319 2 39 ASP QB 2 43 GLY H 3.900 . 6.000 3.208 2.002 4.139 . 0 0 "[ . 1 . 2 ]" 1
320 2 39 ASP QB 2 44 GLN H 3.100 . 4.500 3.131 1.998 4.520 0.020 16 0 "[ . 1 . 2 ]" 1
321 2 42 THR HB 2 44 GLN H 3.400 . 5.000 4.811 4.433 5.065 0.065 14 0 "[ . 1 . 2 ]" 1
322 2 42 THR H 2 44 GLN H 3.400 . 5.000 4.243 3.766 4.755 . 0 0 "[ . 1 . 2 ]" 1
323 2 39 ASP QB 2 46 LEU QD 4.400 . 6.900 4.240 2.813 5.891 . 0 0 "[ . 1 . 2 ]" 1
324 2 45 SER HA 2 47 GLY H 3.400 . 5.000 4.543 3.738 5.038 0.038 20 0 "[ . 1 . 2 ]" 1
325 2 8 ILE MD 2 48 TYR QD 4.200 . 6.500 2.519 1.775 3.742 0.025 8 0 "[ . 1 . 2 ]" 1
326 2 8 ILE QG 2 48 TYR QD 4.200 . 6.500 3.395 2.237 4.549 . 0 0 "[ . 1 . 2 ]" 1
327 2 8 ILE MD 2 48 TYR QE 4.200 . 6.500 3.661 2.616 4.940 . 0 0 "[ . 1 . 2 ]" 1
328 2 10 ASN HA 2 48 TYR QD 4.400 . 7.000 3.666 2.302 4.929 . 0 0 "[ . 1 . 2 ]" 1
329 2 10 ASN QB 2 48 TYR QD 4.200 . 6.500 3.590 2.068 5.313 . 0 0 "[ . 1 . 2 ]" 1
330 2 10 ASN HA 2 48 TYR QB 3.100 . 4.500 2.077 1.749 3.520 0.051 18 0 "[ . 1 . 2 ]" 1
331 2 12 LEU HB2 2 48 TYR H 2.600 . 3.500 3.510 3.094 3.635 0.135 4 0 "[ . 1 . 2 ]" 1
332 2 12 LEU MD1 2 48 TYR H 3.100 . 4.500 3.411 2.013 4.154 . 0 0 "[ . 1 . 2 ]" 1
333 2 36 LEU MD2 2 48 TYR H 3.100 . 4.500 3.687 2.945 4.502 0.002 4 0 "[ . 1 . 2 ]" 1
334 2 37 VAL MG2 2 48 TYR QD 4.200 . 6.500 3.030 1.788 4.356 0.012 20 0 "[ . 1 . 2 ]" 1
335 2 37 VAL MG1 2 48 TYR QD 4.200 . 6.500 3.526 2.669 4.532 . 0 0 "[ . 1 . 2 ]" 1
336 2 37 VAL HB 2 48 TYR QE 3.100 . 4.500 2.849 1.787 4.633 0.133 11 0 "[ . 1 . 2 ]" 1
337 2 37 VAL MG2 2 48 TYR QE 4.200 . 6.500 3.114 1.856 5.115 . 0 0 "[ . 1 . 2 ]" 1
338 2 37 VAL MG1 2 48 TYR QE 4.200 . 6.500 2.323 1.748 3.417 0.052 7 0 "[ . 1 . 2 ]" 1
339 2 37 VAL MG2 2 48 TYR H 3.100 . 4.500 4.576 4.239 4.774 0.274 14 0 "[ . 1 . 2 ]" 1
340 2 9 VAL MG1 2 49 GLY H 3.100 . 4.500 3.876 3.537 4.110 . 0 0 "[ . 1 . 2 ]" 1
341 2 10 ASN HA 2 49 GLY H 2.600 . 3.500 3.508 3.153 3.604 0.104 1 0 "[ . 1 . 2 ]" 1
342 2 8 ILE HA 2 50 PHE HD1 3.600 . 5.500 3.817 1.766 5.247 0.034 19 0 "[ . 1 . 2 ]" 1
343 2 8 ILE HB 2 50 PHE HD1 3.600 . 5.500 4.175 2.123 5.997 0.497 12 0 "[ . 1 . 2 ]" 1
344 2 8 ILE MD 2 50 PHE HD1 4.200 . 6.500 4.469 2.700 5.780 . 0 0 "[ . 1 . 2 ]" 1
345 2 8 ILE QG 2 50 PHE HD1 4.900 . 8.000 3.759 2.101 5.078 . 0 0 "[ . 1 . 2 ]" 1
346 2 8 ILE HB 2 50 PHE QE 3.600 . 5.500 2.802 1.862 4.267 . 0 0 "[ . 1 . 2 ]" 1
347 2 8 ILE MD 2 50 PHE QE 4.200 . 6.500 2.058 1.797 2.511 0.003 4 0 "[ . 1 . 2 ]" 1
348 2 8 ILE MG 2 50 PHE QE 4.200 . 6.500 3.858 3.270 4.961 . 0 0 "[ . 1 . 2 ]" 1
349 2 8 ILE QG 2 50 PHE QE 4.900 . 8.000 2.637 1.949 3.299 . 0 0 "[ . 1 . 2 ]" 1
350 2 21 PHE QE 2 50 PHE H 3.600 . 5.500 3.292 2.518 4.104 . 0 0 "[ . 1 . 2 ]" 1
351 2 21 PHE HZ 2 50 PHE H 3.400 . 5.000 4.291 3.284 5.035 0.035 11 0 "[ . 1 . 2 ]" 1
352 2 37 VAL MG2 2 50 PHE QE 3.200 . 5.500 1.805 1.688 2.018 0.112 4 0 "[ . 1 . 2 ]" 1
353 2 48 TYR QD 2 50 PHE QE 4.700 . 7.500 3.535 1.950 4.557 . 0 0 "[ . 1 . 2 ]" 1
354 2 48 TYR QE 2 50 PHE QE 4.700 . 7.500 4.419 2.223 6.057 . 0 0 "[ . 1 . 2 ]" 1
355 2 48 TYR QD 2 50 PHE HZ 4.400 . 7.000 3.428 2.340 4.694 . 0 0 "[ . 1 . 2 ]" 1
356 2 48 TYR QE 2 50 PHE HZ 3.600 . 5.500 3.869 2.197 5.566 0.066 9 0 "[ . 1 . 2 ]" 1
357 2 50 PHE QE 2 81 ALA MB 4.200 . 6.500 4.023 2.677 6.582 0.082 3 0 "[ . 1 . 2 ]" 1
358 2 7 LEU HG 2 51 VAL MG1 3.100 . 4.500 4.382 3.956 4.533 0.033 6 0 "[ . 1 . 2 ]" 1
359 2 7 LEU HB3 2 51 VAL MG1 3.100 . 4.500 4.512 4.386 4.550 0.050 13 0 "[ . 1 . 2 ]" 1
360 2 7 LEU MD2 2 51 VAL MG1 3.600 . 5.500 3.753 2.555 4.478 . 0 0 "[ . 1 . 2 ]" 1
361 2 25 PHE HB2 2 51 VAL MG2 3.900 . 6.000 3.583 2.926 4.184 . 0 0 "[ . 1 . 2 ]" 1
362 2 25 PHE HB3 2 51 VAL MG2 3.100 . 4.500 3.395 2.690 3.839 . 0 0 "[ . 1 . 2 ]" 1
363 2 25 PHE HB2 2 51 VAL MG1 3.900 . 6.000 4.399 3.656 5.025 . 0 0 "[ . 1 . 2 ]" 1
364 2 25 PHE HB3 2 51 VAL MG1 3.100 . 4.500 3.517 2.852 3.870 . 0 0 "[ . 1 . 2 ]" 1
365 2 31 ILE MD 2 51 VAL MG2 3.600 . 5.500 4.542 2.052 5.482 . 0 0 "[ . 1 . 2 ]" 1
366 2 31 ILE MG 2 51 VAL MG2 3.100 . 4.500 3.451 2.612 4.155 . 0 0 "[ . 1 . 2 ]" 1
367 2 31 ILE MD 2 51 VAL MG1 3.600 . 5.500 3.917 1.972 4.967 . 0 0 "[ . 1 . 2 ]" 1
368 2 31 ILE MG 2 51 VAL MG1 3.600 . 5.500 2.202 1.771 3.277 0.029 5 0 "[ . 1 . 2 ]" 1
369 2 34 CYS HA 2 51 VAL MG2 3.100 . 4.500 3.663 3.033 4.209 . 0 0 "[ . 1 . 2 ]" 1
370 2 34 CYS HB3 2 51 VAL MG2 3.100 . 4.500 3.156 2.394 3.707 . 0 0 "[ . 1 . 2 ]" 1
371 2 34 CYS HB3 2 51 VAL MG1 3.900 . 6.000 4.387 3.749 4.943 . 0 0 "[ . 1 . 2 ]" 1
372 2 31 ILE MG 2 52 ASN H 3.900 . 6.000 3.266 2.412 3.996 . 0 0 "[ . 1 . 2 ]" 1
373 2 33 SER H 2 52 ASN H 2.600 . 3.500 3.133 2.659 3.533 0.033 6 0 "[ . 1 . 2 ]" 1
374 2 34 CYS HA 2 52 ASN H 2.600 . 3.500 2.983 2.525 3.503 0.003 11 0 "[ . 1 . 2 ]" 1
375 2 5 THR HB 2 53 TYR H 2.600 . 3.500 2.716 1.976 3.619 0.119 6 0 "[ . 1 . 2 ]" 1
376 2 7 LEU HG 2 53 TYR QD 3.600 . 5.500 3.234 2.341 4.451 . 0 0 "[ . 1 . 2 ]" 1
377 2 7 LEU HG 2 53 TYR QE 4.400 . 7.000 3.789 2.727 5.318 . 0 0 "[ . 1 . 2 ]" 1
378 2 7 LEU MD2 2 53 TYR QE 3.600 . 5.500 4.197 3.164 5.303 . 0 0 "[ . 1 . 2 ]" 1
379 2 25 PHE QD 2 53 TYR HH 3.600 . 5.500 3.017 2.572 3.637 . 0 0 "[ . 1 . 2 ]" 1
380 2 25 PHE HB3 2 53 TYR HH 2.600 . 3.500 3.354 2.533 3.548 0.048 1 0 "[ . 1 . 2 ]" 1
381 2 28 ILE HB 2 53 TYR QE 3.600 . 5.500 3.903 3.026 4.619 . 0 0 "[ . 1 . 2 ]" 1
382 2 28 ILE MD 2 53 TYR QE 4.200 . 6.500 4.069 3.420 5.040 . 0 0 "[ . 1 . 2 ]" 1
383 2 28 ILE MG 2 53 TYR QE 4.200 . 6.500 3.476 2.748 4.226 . 0 0 "[ . 1 . 2 ]" 1
384 2 28 ILE MD 2 53 TYR HH 3.900 . 6.000 2.777 2.013 4.167 . 0 0 "[ . 1 . 2 ]" 1
385 2 28 ILE MG 2 53 TYR HH 3.100 . 4.500 2.929 2.149 3.743 . 0 0 "[ . 1 . 2 ]" 1
386 2 31 ILE MD 2 53 TYR QD 4.200 . 6.500 5.026 4.499 5.552 . 0 0 "[ . 1 . 2 ]" 1
387 2 31 ILE HA 2 53 TYR QE 3.600 . 5.500 3.073 2.391 4.222 . 0 0 "[ . 1 . 2 ]" 1
388 2 31 ILE MD 2 53 TYR QE 4.200 . 6.500 3.533 3.066 4.224 . 0 0 "[ . 1 . 2 ]" 1
389 2 31 ILE MD 2 53 TYR HH 3.100 . 4.500 3.658 2.492 4.515 0.015 17 0 "[ . 1 . 2 ]" 1
390 2 51 VAL MG2 2 53 TYR QE 4.200 . 6.500 3.809 3.333 4.203 . 0 0 "[ . 1 . 2 ]" 1
391 2 51 VAL MG1 2 53 TYR QE 4.200 . 6.500 2.456 1.778 2.605 0.022 7 0 "[ . 1 . 2 ]" 1
392 2 51 VAL MG1 2 53 TYR HH 3.100 . 4.500 3.212 2.588 4.192 . 0 0 "[ . 1 . 2 ]" 1
393 2 53 TYR QD 2 58 ASP QB 4.200 . 6.500 3.381 1.796 4.884 0.004 7 0 "[ . 1 . 2 ]" 1
394 2 53 TYR QD 2 59 ALA MB 4.200 . 6.500 2.728 1.916 3.714 . 0 0 "[ . 1 . 2 ]" 1
395 2 53 TYR H 2 59 ALA MB 3.100 . 4.500 4.001 3.527 4.479 . 0 0 "[ . 1 . 2 ]" 1
396 2 53 TYR QE 2 62 ALA MB 3.600 . 5.500 2.631 1.924 3.522 . 0 0 "[ . 1 . 2 ]" 1
397 2 32 GLU QG 2 54 SER H 3.100 . 4.500 3.788 2.494 4.578 0.078 2 0 "[ . 1 . 2 ]" 1
398 2 53 TYR HB3 2 55 ASP H 2.600 . 3.500 3.090 2.529 3.386 . 0 0 "[ . 1 . 2 ]" 1
399 2 5 THR HA 2 59 ALA MB 3.100 . 4.500 4.036 3.281 4.566 0.066 17 0 "[ . 1 . 2 ]" 1
400 2 53 TYR HB3 2 59 ALA H 3.400 . 5.000 3.894 3.056 4.445 . 0 0 "[ . 1 . 2 ]" 1
401 2 59 ALA H 2 61 LYS QB 3.900 . 6.000 4.522 4.245 4.936 . 0 0 "[ . 1 . 2 ]" 1
402 2 57 ASN HA 2 60 ASP H 2.600 . 3.500 3.555 3.452 3.655 0.155 19 0 "[ . 1 . 2 ]" 1
403 2 57 ASN HA 2 60 ASP QB 3.100 . 4.500 4.062 3.683 4.339 . 0 0 "[ . 1 . 2 ]" 1
404 2 58 ASP HA 2 61 LYS H 2.600 . 3.500 3.448 3.108 3.595 0.095 15 0 "[ . 1 . 2 ]" 1
405 2 61 LYS QE 2 65 THR HB 3.100 . 4.500 4.238 2.814 4.565 0.065 11 0 "[ . 1 . 2 ]" 1
406 2 58 ASP HA 2 62 ALA H 3.400 . 5.000 3.746 3.321 4.476 . 0 0 "[ . 1 . 2 ]" 1
407 2 59 ALA HA 2 62 ALA H 3.400 . 5.000 3.781 3.474 4.090 . 0 0 "[ . 1 . 2 ]" 1
408 2 59 ALA HA 2 62 ALA MB 3.100 . 4.500 3.052 2.375 3.516 . 0 0 "[ . 1 . 2 ]" 1
409 2 7 LEU MD2 2 63 ILE MD 3.600 . 5.500 4.091 3.141 4.859 . 0 0 "[ . 1 . 2 ]" 1
410 2 60 ASP HA 2 63 ILE H 2.600 . 3.500 3.242 3.040 3.546 0.046 6 0 "[ . 1 . 2 ]" 1
411 2 60 ASP HA 2 63 ILE MD 3.100 . 4.500 3.023 1.848 4.511 0.011 19 0 "[ . 1 . 2 ]" 1
412 2 60 ASP QB 2 63 ILE MG 4.400 . 7.000 4.515 3.752 4.901 . 0 0 "[ . 1 . 2 ]" 1
413 2 63 ILE MG 2 67 ASN QB 3.600 . 5.500 1.967 1.755 2.288 0.045 12 0 "[ . 1 . 2 ]" 1
414 2 63 ILE MD 2 78 VAL MG1 3.600 . 5.500 2.722 1.798 4.155 0.002 19 0 "[ . 1 . 2 ]" 1
415 2 63 ILE QG 2 78 VAL MG1 3.600 . 5.500 2.681 1.788 3.546 0.012 8 0 "[ . 1 . 2 ]" 1
416 2 63 ILE QG 2 78 VAL HB 3.100 . 4.500 3.179 2.001 4.474 . 0 0 "[ . 1 . 2 ]" 1
417 2 61 LYS HA 2 64 ASN H 2.600 . 3.500 3.503 3.242 3.578 0.078 7 0 "[ . 1 . 2 ]" 1
418 2 61 LYS HA 2 64 ASN QB 3.100 . 4.500 2.626 1.796 3.269 0.004 13 0 "[ . 1 . 2 ]" 1
419 2 24 LEU HG 2 66 LEU QD 3.900 . 6.000 4.657 3.864 5.468 . 0 0 "[ . 1 . 2 ]" 1
420 2 24 LEU MD1 2 66 LEU QD 4.400 . 6.900 2.571 1.894 3.292 . 0 0 "[ . 1 . 2 ]" 1
421 2 62 ALA HA 2 66 LEU HG 3.400 . 5.000 4.576 3.681 5.042 0.042 5 0 "[ . 1 . 2 ]" 1
422 2 62 ALA MB 2 66 LEU QD 4.400 . 6.900 2.136 1.771 2.537 0.029 14 0 "[ . 1 . 2 ]" 1
423 2 62 ALA HA 2 66 LEU QD 3.900 . 6.000 2.782 1.920 3.514 . 0 0 "[ . 1 . 2 ]" 1
424 2 66 LEU QD 2 69 LEU MD1 3.900 . 6.000 2.012 1.858 2.479 0.042 6 0 "[ . 1 . 2 ]" 1
425 2 66 LEU QD 2 78 VAL MG1 4.400 . 6.900 3.573 2.786 4.659 . 0 0 "[ . 1 . 2 ]" 1
426 2 63 ILE HA 2 67 ASN H 2.600 . 3.500 3.517 3.177 3.609 0.109 17 0 "[ . 1 . 2 ]" 1
427 2 63 ILE HA 2 67 ASN QB 3.100 . 4.500 3.194 2.151 4.033 . 0 0 "[ . 1 . 2 ]" 1
428 2 68 GLY H 2 77 LYS HA 2.600 . 3.500 2.566 1.858 3.117 . 0 0 "[ . 1 . 2 ]" 1
429 2 66 LEU HA 2 69 LEU MD1 3.100 . 4.500 2.306 1.828 3.378 . 0 0 "[ . 1 . 2 ]" 1
430 2 69 LEU H 2 76 ILE HB 3.400 . 5.000 3.594 2.687 5.056 0.056 18 0 "[ . 1 . 2 ]" 1
431 2 69 LEU MD1 2 76 ILE MG 3.100 . 4.500 2.877 2.058 3.545 . 0 0 "[ . 1 . 2 ]" 1
432 2 13 PRO QB 2 71 LEU MD1 3.600 . 5.500 3.614 2.312 5.506 0.006 17 0 "[ . 1 . 2 ]" 1
433 2 13 PRO QD 2 71 LEU MD1 3.600 . 5.500 3.168 1.905 4.288 . 0 0 "[ . 1 . 2 ]" 1
434 2 71 LEU H 2 74 LYS H 2.600 . 3.500 3.532 3.166 3.621 0.121 5 0 "[ . 1 . 2 ]" 1
435 2 71 LEU HB2 2 74 LYS HB2 3.400 . 5.000 4.053 2.742 4.492 . 0 0 "[ . 1 . 2 ]" 1
436 2 71 LEU HB2 2 74 LYS HB3 3.400 . 5.000 4.927 3.606 5.161 0.161 13 0 "[ . 1 . 2 ]" 1
437 2 71 LEU H 2 75 THR HA 2.600 . 3.500 2.602 2.414 3.228 . 0 0 "[ . 1 . 2 ]" 1
438 2 71 LEU H 2 75 THR MG 3.900 . 6.000 4.683 4.449 5.132 . 0 0 "[ . 1 . 2 ]" 1
439 2 68 GLY HA2 2 75 THR MG 3.100 . 4.500 2.692 1.999 3.340 . 0 0 "[ . 1 . 2 ]" 1
440 2 11 TYR QB 2 75 THR H 2.600 . 4.000 3.458 2.561 4.123 0.123 2 0 "[ . 1 . 2 ]" 1
441 2 70 LYS HA 2 75 THR MG 3.100 . 4.500 3.321 2.827 3.792 . 0 0 "[ . 1 . 2 ]" 1
442 2 13 PRO QD 2 76 ILE MD 3.600 . 5.500 2.877 1.801 4.229 . 0 0 "[ . 1 . 2 ]" 1
443 2 70 LYS HA 2 76 ILE H 2.600 . 3.500 3.478 3.210 3.585 0.085 20 0 "[ . 1 . 2 ]" 1
444 2 11 TYR QD 2 77 LYS H 3.600 . 5.500 3.462 2.024 4.668 . 0 0 "[ . 1 . 2 ]" 1
445 2 11 TYR HB2 2 77 LYS H 2.600 . 3.500 3.287 2.629 3.583 0.083 14 0 "[ . 1 . 2 ]" 1
446 2 69 LEU MD1 2 77 LYS H 3.900 . 6.000 5.852 5.234 6.078 0.078 18 0 "[ . 1 . 2 ]" 1
447 2 69 LEU HA 2 77 LYS QG 3.900 . 6.000 5.840 5.494 6.144 0.144 18 0 "[ . 1 . 2 ]" 1
448 2 63 ILE HA 2 78 VAL HB 2.600 . 3.500 2.989 2.240 3.501 0.001 7 0 "[ . 1 . 2 ]" 1
449 2 63 ILE HA 2 78 VAL MG1 3.100 . 4.500 3.705 3.142 4.291 . 0 0 "[ . 1 . 2 ]" 1
450 2 63 ILE HA 2 78 VAL MG2 3.900 . 6.000 3.731 2.877 4.523 . 0 0 "[ . 1 . 2 ]" 1
451 2 67 ASN QB 2 78 VAL HB 3.100 . 4.500 4.179 3.168 4.538 0.038 9 0 "[ . 1 . 2 ]" 1
452 2 67 ASN HA 2 78 VAL H 2.600 . 3.500 2.279 1.844 2.651 . 0 0 "[ . 1 . 2 ]" 1
453 2 67 ASN QB 2 78 VAL H 3.100 . 4.500 4.151 3.440 4.572 0.072 17 0 "[ . 1 . 2 ]" 1
454 2 67 ASN QB 2 78 VAL MG1 4.400 . 7.000 5.168 4.104 5.587 . 0 0 "[ . 1 . 2 ]" 1
455 2 67 ASN HA 2 78 VAL MG2 3.100 . 4.500 3.744 3.294 4.431 . 0 0 "[ . 1 . 2 ]" 1
456 2 67 ASN QB 2 78 VAL MG2 3.600 . 5.500 4.731 4.265 5.160 . 0 0 "[ . 1 . 2 ]" 1
457 2 8 ILE MG 2 79 SER H 3.100 . 4.500 3.029 2.447 3.637 . 0 0 "[ . 1 . 2 ]" 1
458 2 9 VAL HA 2 79 SER H 2.600 . 3.500 3.184 2.666 3.558 0.058 7 0 "[ . 1 . 2 ]" 1
459 2 63 ILE QG 2 79 SER H 3.900 . 6.000 5.105 4.029 5.999 . 0 0 "[ . 1 . 2 ]" 1
460 2 7 LEU HA 2 80 TYR QD 4.400 . 7.000 4.303 3.575 4.953 . 0 0 "[ . 1 . 2 ]" 1
461 2 7 LEU MD1 2 80 TYR QE 4.200 . 6.500 2.849 2.040 3.601 . 0 0 "[ . 1 . 2 ]" 1
462 2 59 ALA MB 2 80 TYR QD 4.200 . 6.500 4.651 3.418 5.574 . 0 0 "[ . 1 . 2 ]" 1
463 2 59 ALA MB 2 80 TYR QE 4.200 . 6.500 3.606 1.951 5.338 . 0 0 "[ . 1 . 2 ]" 1
464 2 60 ASP HA 2 80 TYR QE 3.600 . 5.500 3.812 1.772 4.870 0.028 3 0 "[ . 1 . 2 ]" 1
465 2 63 ILE MD 2 80 TYR QD 4.200 . 6.500 3.410 2.690 4.558 . 0 0 "[ . 1 . 2 ]" 1
466 2 63 ILE QG 2 80 TYR QD 4.200 . 6.500 4.724 3.350 5.373 . 0 0 "[ . 1 . 2 ]" 1
467 2 63 ILE MD 2 80 TYR QE 4.200 . 6.500 2.740 1.907 4.230 . 0 0 "[ . 1 . 2 ]" 1
468 2 63 ILE MD 2 80 TYR H 3.100 . 4.500 4.124 3.266 4.586 0.086 8 0 "[ . 1 . 2 ]" 1
469 2 6 ASN HB2 2 81 ALA MB 3.100 . 4.500 4.492 4.163 4.645 0.145 10 0 "[ . 1 . 2 ]" 1
470 2 7 LEU HA 2 81 ALA H 2.600 . 3.500 3.389 2.848 3.578 0.078 3 0 "[ . 1 . 2 ]" 1
471 2 7 LEU MD1 2 81 ALA H 3.100 . 4.500 3.985 3.440 4.385 . 0 0 "[ . 1 . 2 ]" 1
472 2 7 LEU HA 2 81 ALA MB 3.900 . 6.000 4.145 3.395 4.537 . 0 0 "[ . 1 . 2 ]" 1
473 2 8 ILE MG 2 81 ALA H 3.900 . 6.000 2.612 1.981 3.206 . 0 0 "[ . 1 . 2 ]" 1
474 2 8 ILE HB 2 81 ALA MB 3.100 . 4.500 2.819 1.960 4.518 0.018 5 0 "[ . 1 . 2 ]" 1
475 2 7 LEU HA 2 80 TYR HA 2.100 . 5.000 2.806 2.493 3.178 . 0 0 "[ . 1 . 2 ]" 1
476 2 67 ASN HA 2 77 LYS HA 2.100 . 5.000 2.897 2.276 3.545 . 0 0 "[ . 1 . 2 ]" 1
477 2 11 TYR HB3 2 76 ILE HA 3.100 . 4.500 3.877 3.352 4.278 . 0 0 "[ . 1 . 2 ]" 1
478 2 11 TYR HB2 2 76 ILE HA 3.100 . 4.500 2.651 2.140 3.249 . 0 0 "[ . 1 . 2 ]" 1
479 2 38 ARG HA 2 46 LEU H 3.100 . 4.500 3.904 2.466 4.631 0.131 16 0 "[ . 1 . 2 ]" 1
480 2 38 ARG HA 2 45 SER HA 2.600 . 5.000 3.565 2.190 4.780 . 0 0 "[ . 1 . 2 ]" 1
481 2 6 ASN H 2 6 ASN HB3 2.600 . 3.500 2.564 2.310 3.538 0.038 17 0 "[ . 1 . 2 ]" 1
482 2 6 ASN HA 2 6 ASN HB3 2.600 . 3.500 3.028 3.023 3.035 . 0 0 "[ . 1 . 2 ]" 1
483 2 7 LEU H 2 7 LEU MD2 2.100 . 2.100 2.072 1.914 2.164 0.064 7 0 "[ . 1 . 2 ]" 1
484 2 7 LEU HA 2 7 LEU MD1 3.100 . 4.500 2.030 1.888 2.300 . 0 0 "[ . 1 . 2 ]" 1
485 2 7 LEU HB3 2 7 LEU MD1 3.100 . 4.500 2.418 2.173 2.648 . 0 0 "[ . 1 . 2 ]" 1
486 2 8 ILE HA 2 8 ILE HB 2.600 . 3.500 2.381 2.296 2.453 . 0 0 "[ . 1 . 2 ]" 1
487 2 8 ILE H 2 8 ILE HB 2.600 . 3.500 3.119 2.787 3.449 . 0 0 "[ . 1 . 2 ]" 1
488 2 8 ILE HB 2 8 ILE MD 3.100 . 4.500 2.439 2.195 2.578 . 0 0 "[ . 1 . 2 ]" 1
489 2 8 ILE HA 2 8 ILE QG 2.900 . 4.000 2.479 2.361 2.640 . 0 0 "[ . 1 . 2 ]" 1
490 2 9 VAL H 2 9 VAL HB 2.600 . 3.500 2.729 2.646 2.815 . 0 0 "[ . 1 . 2 ]" 1
491 2 9 VAL H 2 9 VAL MG2 3.100 . 4.500 2.405 2.147 2.712 . 0 0 "[ . 1 . 2 ]" 1
492 2 9 VAL HA 2 9 VAL MG2 2.900 . 4.000 2.491 2.397 2.582 . 0 0 "[ . 1 . 2 ]" 1
493 2 9 VAL HA 2 9 VAL MG1 2.900 . 4.000 2.219 2.165 2.297 . 0 0 "[ . 1 . 2 ]" 1
494 2 12 LEU H 2 12 LEU HG 2.600 . 3.500 2.822 2.507 3.030 . 0 0 "[ . 1 . 2 ]" 1
495 2 12 LEU HA 2 12 LEU MD2 3.100 . 4.500 1.919 1.797 2.118 0.003 10 0 "[ . 1 . 2 ]" 1
496 2 12 LEU HA 2 12 LEU HG 2.600 . 3.500 3.110 2.876 3.390 . 0 0 "[ . 1 . 2 ]" 1
497 2 15 ASN H 2 15 ASN HB3 2.600 . 3.500 2.815 2.483 3.714 0.214 4 0 "[ . 1 . 2 ]" 1
498 2 15 ASN HA 2 15 ASN HB3 2.600 . 3.500 2.408 2.306 2.540 . 0 0 "[ . 1 . 2 ]" 1
499 2 15 ASN HA 2 15 ASN HB2 2.600 . 3.500 2.502 2.371 2.607 . 0 0 "[ . 1 . 2 ]" 1
500 2 16 MET H 2 16 MET HB2 2.600 . 3.500 2.528 2.325 2.760 . 0 0 "[ . 1 . 2 ]" 1
501 2 16 MET H 2 16 MET HB3 2.600 . 3.500 2.638 2.464 2.730 . 0 0 "[ . 1 . 2 ]" 1
502 2 16 MET HA 2 16 MET HB2 2.600 . 3.500 2.545 2.450 2.585 . 0 0 "[ . 1 . 2 ]" 1
503 2 19 ASP H 2 19 ASP HB3 2.600 . 3.500 2.803 2.731 2.858 . 0 0 "[ . 1 . 2 ]" 1
504 2 19 ASP HA 2 19 ASP HB3 2.600 . 3.500 2.338 2.318 2.359 . 0 0 "[ . 1 . 2 ]" 1
505 2 19 ASP HA 2 19 ASP HB2 2.600 . 3.500 2.595 2.567 2.611 . 0 0 "[ . 1 . 2 ]" 1
506 2 21 PHE HA 2 21 PHE QD 2.600 . 3.500 2.517 2.247 2.871 . 0 0 "[ . 1 . 2 ]" 1
507 2 21 PHE HB2 2 21 PHE QD 3.100 . 4.500 2.578 2.422 2.716 . 0 0 "[ . 1 . 2 ]" 1
508 2 21 PHE HB3 2 21 PHE QD 3.100 . 4.500 2.282 2.258 2.361 . 0 0 "[ . 1 . 2 ]" 1
509 2 21 PHE H 2 21 PHE HB2 2.600 . 3.500 2.546 2.282 2.733 . 0 0 "[ . 1 . 2 ]" 1
510 2 21 PHE H 2 21 PHE HB3 2.600 . 3.500 2.528 2.349 2.816 . 0 0 "[ . 1 . 2 ]" 1
511 2 21 PHE HA 2 21 PHE HB2 2.600 . 3.500 2.441 2.356 2.583 . 0 0 "[ . 1 . 2 ]" 1
512 2 22 LYS H 2 22 LYS HA 2.600 . 3.500 2.793 2.748 2.846 . 0 0 "[ . 1 . 2 ]" 1
513 2 22 LYS H 2 22 LYS HB2 2.600 . 3.500 2.277 2.238 2.343 . 0 0 "[ . 1 . 2 ]" 1
514 2 22 LYS H 2 22 LYS HB3 2.600 . 3.500 2.793 2.706 2.841 . 0 0 "[ . 1 . 2 ]" 1
515 2 22 LYS HA 2 22 LYS HB2 2.600 . 3.500 2.587 2.580 2.594 . 0 0 "[ . 1 . 2 ]" 1
516 2 22 LYS HA 2 22 LYS QG 2.900 . 4.000 2.312 2.197 2.404 . 0 0 "[ . 1 . 2 ]" 1
517 2 23 SER H 2 23 SER QB 2.500 . 3.100 2.241 2.062 2.590 . 0 0 "[ . 1 . 2 ]" 1
518 2 24 LEU H 2 24 LEU HB2 2.600 . 3.500 2.283 2.209 2.442 . 0 0 "[ . 1 . 2 ]" 1
519 2 24 LEU HB3 2 24 LEU MD1 3.100 . 4.500 2.232 2.089 2.514 . 0 0 "[ . 1 . 2 ]" 1
520 2 24 LEU HA 2 24 LEU MD2 3.900 . 6.000 2.043 1.921 2.440 . 0 0 "[ . 1 . 2 ]" 1
521 2 25 PHE HA 2 25 PHE QD 3.100 . 4.500 3.019 2.927 3.077 . 0 0 "[ . 1 . 2 ]" 1
522 2 25 PHE HB2 2 25 PHE QD 3.100 . 4.500 2.551 2.385 2.670 . 0 0 "[ . 1 . 2 ]" 1
523 2 25 PHE HB3 2 25 PHE QD 3.100 . 4.500 2.287 2.235 2.392 . 0 0 "[ . 1 . 2 ]" 1
524 2 25 PHE H 2 25 PHE HB2 2.600 . 3.500 2.291 2.263 2.323 . 0 0 "[ . 1 . 2 ]" 1
525 2 25 PHE HA 2 25 PHE HB3 2.600 . 3.500 2.613 2.608 2.626 . 0 0 "[ . 1 . 2 ]" 1
526 2 26 GLY H 2 26 GLY HA3 2.600 . 3.500 2.309 2.295 2.350 . 0 0 "[ . 1 . 2 ]" 1
527 2 28 ILE H 2 28 ILE HB 2.600 . 3.500 2.778 2.478 2.969 . 0 0 "[ . 1 . 2 ]" 1
528 2 28 ILE H 2 28 ILE QG 3.100 . 4.500 3.102 2.709 3.499 . 0 0 "[ . 1 . 2 ]" 1
529 2 28 ILE HB 2 28 ILE MD 3.100 . 4.500 2.355 2.053 2.496 . 0 0 "[ . 1 . 2 ]" 1
530 2 28 ILE HA 2 28 ILE MG 3.100 . 4.500 2.410 2.240 2.580 . 0 0 "[ . 1 . 2 ]" 1
531 2 31 ILE H 2 31 ILE HB 2.600 . 3.500 2.651 2.362 3.016 . 0 0 "[ . 1 . 2 ]" 1
532 2 31 ILE H 2 31 ILE QG 3.100 . 4.500 2.427 2.060 3.110 . 0 0 "[ . 1 . 2 ]" 1
533 2 31 ILE H 2 31 ILE MD 3.100 . 6.000 3.211 2.786 4.234 . 0 0 "[ . 1 . 2 ]" 1
534 2 31 ILE HA 2 31 ILE MG 2.900 . 4.000 2.265 2.167 2.463 . 0 0 "[ . 1 . 2 ]" 1
535 2 31 ILE HA 2 31 ILE QG 2.900 . 4.000 2.495 2.262 2.645 . 0 0 "[ . 1 . 2 ]" 1
536 2 32 GLU H 2 32 GLU HA 2.600 . 3.500 2.751 2.692 2.809 . 0 0 "[ . 1 . 2 ]" 1
537 2 32 GLU H 2 32 GLU QB 2.900 . 4.000 2.164 2.027 2.680 . 0 0 "[ . 1 . 2 ]" 1
538 2 32 GLU H 2 32 GLU QG 3.900 . 6.000 3.274 1.837 4.064 . 0 0 "[ . 1 . 2 ]" 1
539 2 34 CYS HB2 2 34 CYS HG 2.600 . 3.500 2.985 2.474 3.109 . 0 0 "[ . 1 . 2 ]" 1
540 2 34 CYS H 2 34 CYS HG 3.400 . 5.000 4.087 3.088 4.882 . 0 0 "[ . 1 . 2 ]" 1
541 2 34 CYS HA 2 34 CYS HB3 2.600 . 3.500 2.399 2.346 2.603 . 0 0 "[ . 1 . 2 ]" 1
542 2 36 LEU HA 2 36 LEU HG 2.600 . 3.500 2.383 2.284 2.612 . 0 0 "[ . 1 . 2 ]" 1
543 2 36 LEU H 2 36 LEU HG 3.400 . 5.000 4.687 4.625 4.747 . 0 0 "[ . 1 . 2 ]" 1
544 2 36 LEU H 2 36 LEU HB2 2.600 . 3.500 3.172 2.992 3.328 . 0 0 "[ . 1 . 2 ]" 1
545 2 36 LEU H 2 36 LEU HB3 2.600 . 3.500 2.934 2.676 3.167 . 0 0 "[ . 1 . 2 ]" 1
546 2 36 LEU HA 2 36 LEU HB2 2.600 . 3.500 2.534 2.409 2.587 . 0 0 "[ . 1 . 2 ]" 1
547 2 36 LEU HA 2 36 LEU MD2 3.100 . 4.500 3.303 3.079 3.463 . 0 0 "[ . 1 . 2 ]" 1
548 2 36 LEU HB2 2 36 LEU MD1 3.100 . 4.500 2.122 1.989 2.243 . 0 0 "[ . 1 . 2 ]" 1
549 2 36 LEU HB3 2 36 LEU MD1 3.100 . 4.500 2.660 2.523 2.763 . 0 0 "[ . 1 . 2 ]" 1
550 2 37 VAL H 2 37 VAL HB 2.600 . 3.500 2.524 2.260 2.827 . 0 0 "[ . 1 . 2 ]" 1
551 2 37 VAL H 2 37 VAL MG2 3.100 . 4.500 2.680 2.275 3.263 . 0 0 "[ . 1 . 2 ]" 1
552 2 37 VAL HA 2 37 VAL MG2 2.500 . 3.100 2.247 2.029 2.429 . 0 0 "[ . 1 . 2 ]" 1
553 2 37 VAL HA 2 37 VAL MG1 2.500 . 3.100 2.467 2.281 2.650 . 0 0 "[ . 1 . 2 ]" 1
554 2 50 PHE HA 2 50 PHE HB3 2.600 . 3.500 2.366 2.346 2.437 . 0 0 "[ . 1 . 2 ]" 1
555 2 50 PHE H 2 50 PHE HB2 2.600 . 3.500 2.917 2.773 3.045 . 0 0 "[ . 1 . 2 ]" 1
556 2 50 PHE H 2 50 PHE QD 3.600 . 5.500 2.867 2.493 3.420 . 0 0 "[ . 1 . 2 ]" 1
557 2 51 VAL H 2 51 VAL HB 2.600 . 3.500 2.728 2.595 2.837 . 0 0 "[ . 1 . 2 ]" 1
558 2 51 VAL H 2 51 VAL MG2 3.100 . 4.500 2.920 2.623 3.260 . 0 0 "[ . 1 . 2 ]" 1
559 2 53 TYR H 2 53 TYR HB2 2.600 . 3.500 2.403 2.278 2.626 . 0 0 "[ . 1 . 2 ]" 1
560 2 53 TYR HA 2 53 TYR HB3 2.600 . 3.500 2.573 2.514 2.614 . 0 0 "[ . 1 . 2 ]" 1
561 2 59 ALA H 2 59 ALA MB 2.500 . 3.100 2.229 2.163 2.253 . 0 0 "[ . 1 . 2 ]" 1
562 2 62 ALA H 2 62 ALA MB 2.500 . 3.100 2.200 2.045 2.242 . 0 0 "[ . 1 . 2 ]" 1
563 2 63 ILE H 2 63 ILE HB 2.600 . 3.500 2.521 2.294 2.730 . 0 0 "[ . 1 . 2 ]" 1
564 2 63 ILE H 2 63 ILE QG 3.100 . 4.500 2.164 1.901 2.518 . 0 0 "[ . 1 . 2 ]" 1
565 2 63 ILE HB 2 63 ILE MD 3.100 . 4.500 2.619 2.164 3.233 . 0 0 "[ . 1 . 2 ]" 1
566 2 71 LEU H 2 71 LEU MD1 3.100 . 4.500 3.882 3.450 4.245 . 0 0 "[ . 1 . 2 ]" 1
567 2 73 THR H 2 73 THR HA 2.600 . 3.500 2.890 2.255 2.946 . 0 0 "[ . 1 . 2 ]" 1
568 2 73 THR H 2 73 THR MG 3.100 . 4.500 2.885 2.435 3.688 . 0 0 "[ . 1 . 2 ]" 1
569 2 75 THR H 2 75 THR HB 2.600 . 3.500 2.372 2.218 2.657 . 0 0 "[ . 1 . 2 ]" 1
570 2 75 THR HA 2 75 THR MG 2.900 . 4.000 2.619 2.406 2.700 . 0 0 "[ . 1 . 2 ]" 1
571 2 76 ILE H 2 76 ILE HB 2.600 . 3.500 2.695 2.413 2.960 . 0 0 "[ . 1 . 2 ]" 1
572 2 78 VAL H 2 78 VAL HB 2.600 . 3.500 2.610 2.509 2.688 . 0 0 "[ . 1 . 2 ]" 1
573 2 78 VAL HA 2 78 VAL MG1 2.900 . 4.000 2.287 2.172 2.416 . 0 0 "[ . 1 . 2 ]" 1
574 2 78 VAL HA 2 78 VAL MG2 2.900 . 4.000 2.427 2.324 2.559 . 0 0 "[ . 1 . 2 ]" 1
575 2 78 VAL H 2 78 VAL MG2 3.100 . 4.500 2.302 2.140 2.564 . 0 0 "[ . 1 . 2 ]" 1
576 2 80 TYR H 2 80 TYR HB2 2.600 . 3.500 2.553 2.260 2.755 . 0 0 "[ . 1 . 2 ]" 1
577 2 14 GLN HA 2 15 ASN H 2.600 . 5.000 3.474 2.604 3.551 . 0 0 "[ . 1 . 2 ]" 1
578 2 30 ASP HA 2 32 GLU H 3.100 . 5.000 5.011 4.788 5.082 0.082 14 0 "[ . 1 . 2 ]" 1
579 2 35 LYS H 2 36 LEU H 3.100 . 5.000 4.392 4.260 4.424 . 0 0 "[ . 1 . 2 ]" 1
580 2 34 CYS HB2 2 35 LYS H 3.300 . 3.300 3.333 3.192 3.434 0.134 7 0 "[ . 1 . 2 ]" 1
581 2 6 ASN QD 2 8 ILE HB 2.600 . 4.100 3.575 2.702 4.109 0.009 9 0 "[ . 1 . 2 ]" 1
582 2 42 THR MG 2 44 GLN HE21 2.600 . 4.100 3.788 2.569 4.264 0.164 3 0 "[ . 1 . 2 ]" 1
583 2 32 GLU QB 2 52 ASN QD 2.600 . 4.100 2.296 1.787 3.389 0.013 12 0 "[ . 1 . 2 ]" 1
584 2 32 GLU QG 2 52 ASN QD 2.600 . 4.100 3.250 1.869 4.162 0.062 14 0 "[ . 1 . 2 ]" 1
585 2 57 ASN H 2 57 ASN QD 2.600 . 4.100 2.438 2.172 3.081 . 0 0 "[ . 1 . 2 ]" 1
586 2 56 PRO QD 2 57 ASN QD 2.600 . 4.100 3.532 2.800 4.111 0.011 5 0 "[ . 1 . 2 ]" 1
587 2 63 ILE MG 2 64 ASN QD 2.600 . 4.100 3.949 3.444 4.167 0.067 8 0 "[ . 1 . 2 ]" 1
588 2 63 ILE HB 2 64 ASN QD 2.600 . 4.100 3.765 3.223 4.202 0.102 13 0 "[ . 1 . 2 ]" 1
589 2 63 ILE MG 2 67 ASN QD 2.600 . 4.100 1.979 1.795 2.687 0.005 21 0 "[ . 1 . 2 ]" 1
590 2 63 ILE HB 2 67 ASN QD 2.600 . 4.100 4.127 3.594 4.241 0.141 7 0 "[ . 1 . 2 ]" 1
591 2 91 ALA H 2 92 ASN H 2.100 . 3.000 2.800 2.155 3.096 0.096 11 0 "[ . 1 . 2 ]" 1
592 2 97 GLY H 2 98 LEU H 2.600 . 3.500 2.350 2.092 2.604 . 0 0 "[ . 1 . 2 ]" 1
593 2 100 LYS H 2 101 THR H 2.600 . 3.500 2.734 2.600 3.048 . 0 0 "[ . 1 . 2 ]" 1
594 2 101 THR H 2 102 MET H 2.600 . 3.500 3.170 2.306 3.414 . 0 0 "[ . 1 . 2 ]" 1
595 2 102 MET H 2 103 SER H 3.400 . 5.000 4.415 4.272 4.518 . 0 0 "[ . 1 . 2 ]" 1
596 2 104 GLN H 2 105 LYS H 2.600 . 3.500 2.994 2.782 3.198 . 0 0 "[ . 1 . 2 ]" 1
597 2 105 LYS H 2 106 GLU H 2.600 . 3.500 2.818 2.641 2.955 . 0 0 "[ . 1 . 2 ]" 1
598 2 106 GLU H 2 107 MET H 2.600 . 3.500 2.700 2.566 2.789 . 0 0 "[ . 1 . 2 ]" 1
599 2 107 MET H 2 108 GLU H 2.600 . 3.500 2.633 2.515 2.720 . 0 0 "[ . 1 . 2 ]" 1
600 2 108 GLU H 2 109 GLN H 2.600 . 3.500 2.804 2.608 2.937 . 0 0 "[ . 1 . 2 ]" 1
601 2 109 GLN H 2 110 LEU H 2.600 . 3.500 2.674 2.589 2.874 . 0 0 "[ . 1 . 2 ]" 1
602 2 110 LEU H 2 111 PHE H 2.600 . 3.500 2.710 2.636 2.824 . 0 0 "[ . 1 . 2 ]" 1
603 2 111 PHE H 2 112 SER H 2.100 . 2.500 2.437 2.302 2.520 0.020 12 0 "[ . 1 . 2 ]" 1
604 2 112 SER H 2 113 GLN H 2.600 . 3.500 2.851 2.727 3.001 . 0 0 "[ . 1 . 2 ]" 1
605 2 113 GLN H 2 114 TYR H 2.600 . 3.500 2.679 2.579 2.787 . 0 0 "[ . 1 . 2 ]" 1
606 2 114 TYR H 2 115 GLY H 2.600 . 3.500 2.490 2.370 2.614 . 0 0 "[ . 1 . 2 ]" 1
607 2 118 ILE H 2 119 THR H 2.600 . 3.500 2.352 2.228 2.512 . 0 0 "[ . 1 . 2 ]" 1
608 2 126 GLN H 2 127 ALA H 2.600 . 3.500 2.326 1.962 3.510 0.010 14 0 "[ . 1 . 2 ]" 1
609 2 127 ALA H 2 128 THR H 2.100 . 2.500 2.207 1.968 2.398 . 0 0 "[ . 1 . 2 ]" 1
610 2 128 THR H 2 129 GLY H 2.100 . 2.500 2.233 1.941 2.516 0.016 8 0 "[ . 1 . 2 ]" 1
611 2 129 GLY H 2 130 VAL H 2.600 . 3.500 3.586 3.449 3.740 0.240 3 0 "[ . 1 . 2 ]" 1
612 2 132 ARG H 2 133 GLY H 2.600 . 3.500 2.666 2.351 2.916 . 0 0 "[ . 1 . 2 ]" 1
613 2 133 GLY H 2 134 VAL H 2.600 . 3.500 2.350 2.147 2.705 . 0 0 "[ . 1 . 2 ]" 1
614 2 140 ASP H 2 141 LYS H 2.600 . 3.500 2.648 2.387 2.986 . 0 0 "[ . 1 . 2 ]" 1
615 2 142 ARG H 2 143 ILE H 2.600 . 3.500 2.837 2.599 2.978 . 0 0 "[ . 1 . 2 ]" 1
616 2 143 ILE H 2 144 GLU H 2.600 . 3.500 2.828 2.678 2.982 . 0 0 "[ . 1 . 2 ]" 1
617 2 144 GLU H 2 145 ALA H 2.100 . 2.500 2.611 2.570 2.659 0.159 16 0 "[ . 1 . 2 ]" 1
618 2 145 ALA H 2 146 GLU H 2.600 . 3.500 2.635 2.511 2.741 . 0 0 "[ . 1 . 2 ]" 1
619 2 146 GLU H 2 147 GLU H 2.600 . 3.500 2.889 2.743 3.138 . 0 0 "[ . 1 . 2 ]" 1
620 2 147 GLU H 2 148 ALA H 2.600 . 3.500 2.767 2.674 2.876 . 0 0 "[ . 1 . 2 ]" 1
621 2 149 ILE H 2 150 LYS H 2.600 . 3.500 2.968 2.805 3.183 . 0 0 "[ . 1 . 2 ]" 1
622 2 150 LYS H 2 151 GLY H 2.600 . 3.500 2.771 2.611 2.923 . 0 0 "[ . 1 . 2 ]" 1
623 2 151 GLY H 2 152 LEU H 2.600 . 3.500 2.634 2.465 2.807 . 0 0 "[ . 1 . 2 ]" 1
624 2 152 LEU H 2 153 ASN H 2.100 . 2.500 2.175 1.967 2.531 0.031 4 0 "[ . 1 . 2 ]" 1
625 2 154 GLY H 2 155 GLN H 2.600 . 3.500 3.611 3.146 3.894 0.394 13 0 "[ . 1 . 2 ]" 1
626 2 159 GLY H 2 160 ALA H 2.600 . 3.500 3.096 2.377 3.527 0.027 3 0 "[ . 1 . 2 ]" 1
627 2 161 ALA H 2 162 GLU H 2.100 . 2.500 2.556 2.194 2.689 0.189 2 0 "[ . 1 . 2 ]" 1
628 2 170 ASN H 2 171 ASN H 2.600 . 4.600 3.609 2.521 4.628 0.028 3 0 "[ . 1 . 2 ]" 1
629 2 173 SER H 2 174 GLN H 2.600 . 3.500 2.632 2.128 3.608 0.108 15 0 "[ . 1 . 2 ]" 1
630 2 92 ASN HA 2 93 LEU H 2.100 . 2.500 2.223 2.141 2.463 . 0 0 "[ . 1 . 2 ]" 1
631 2 93 LEU HA 2 94 TYR H 2.600 . 3.500 2.208 2.124 2.286 . 0 0 "[ . 1 . 2 ]" 1
632 2 94 TYR HA 2 95 VAL H 2.600 . 3.500 2.149 2.116 2.175 . 0 0 "[ . 1 . 2 ]" 1
633 2 95 VAL HA 2 96 SER H 2.100 . 2.500 2.155 2.114 2.187 . 0 0 "[ . 1 . 2 ]" 1
634 2 96 SER HA 2 97 GLY H 2.600 . 3.500 2.449 2.281 2.593 . 0 0 "[ . 1 . 2 ]" 1
635 2 99 PRO HA 2 100 LYS H 2.100 . 2.500 2.375 2.248 2.527 0.027 20 0 "[ . 1 . 2 ]" 1
636 2 100 LYS HA 2 101 THR H 3.400 . 5.000 3.488 2.885 3.552 . 0 0 "[ . 1 . 2 ]" 1
637 2 102 MET HA 2 103 SER H 2.100 . 2.500 2.120 2.091 2.176 . 0 0 "[ . 1 . 2 ]" 1
638 2 103 SER HA 2 104 GLN H 2.100 . 2.500 2.123 2.088 2.153 . 0 0 "[ . 1 . 2 ]" 1
639 2 104 GLN HA 2 105 LYS H 3.400 . 5.000 3.572 3.534 3.599 . 0 0 "[ . 1 . 2 ]" 1
640 2 115 GLY QA 2 116 ARG H 3.100 . 4.500 2.406 2.151 2.915 . 0 0 "[ . 1 . 2 ]" 1
641 2 116 ARG HA 2 117 ILE H 2.100 . 2.500 2.199 2.154 2.246 . 0 0 "[ . 1 . 2 ]" 1
642 2 117 ILE HA 2 118 ILE H 2.100 . 2.500 2.233 2.156 2.328 . 0 0 "[ . 1 . 2 ]" 1
643 2 119 THR HA 2 120 SER H 2.100 . 2.500 2.173 2.111 2.389 . 0 0 "[ . 1 . 2 ]" 1
644 2 120 SER HA 2 121 ARG H 2.100 . 2.500 2.271 2.190 2.429 . 0 0 "[ . 1 . 2 ]" 1
645 2 121 ARG HA 2 122 ILE H 2.100 . 2.500 2.470 2.285 2.598 0.098 16 0 "[ . 1 . 2 ]" 1
646 2 122 ILE HA 2 123 LEU H 2.100 . 2.500 2.261 2.168 2.394 . 0 0 "[ . 1 . 2 ]" 1
647 2 123 LEU HA 2 124 LEU H 2.100 . 2.500 2.130 2.076 2.290 . 0 0 "[ . 1 . 2 ]" 1
648 2 124 LEU HA 2 125 ASP H 2.100 . 2.500 2.334 2.173 2.515 0.015 7 0 "[ . 1 . 2 ]" 1
649 2 125 ASP HA 2 126 GLN H 2.100 . 2.500 2.339 2.115 2.611 0.111 15 0 "[ . 1 . 2 ]" 1
650 2 126 GLN HA 2 127 ALA H 2.600 . 3.500 3.031 2.523 3.552 0.052 8 0 "[ . 1 . 2 ]" 1
651 2 128 THR HA 2 129 GLY H 2.600 . 3.500 3.398 3.192 3.553 0.053 8 0 "[ . 1 . 2 ]" 1
652 2 130 VAL HA 2 131 SER H 2.100 . 2.500 2.297 2.231 2.349 . 0 0 "[ . 1 . 2 ]" 1
653 2 131 SER HA 2 132 ARG H 2.600 . 3.500 2.245 2.157 2.420 . 0 0 "[ . 1 . 2 ]" 1
654 2 134 VAL HA 2 135 GLY H 2.100 . 2.500 2.284 2.191 2.382 . 0 0 "[ . 1 . 2 ]" 1
655 2 135 GLY HA3 2 136 PHE H 2.600 . 3.500 2.852 2.704 2.967 . 0 0 "[ . 1 . 2 ]" 1
656 2 135 GLY HA2 2 136 PHE H 2.600 . 3.500 2.298 2.230 2.412 . 0 0 "[ . 1 . 2 ]" 1
657 2 136 PHE HA 2 137 ILE H 2.100 . 2.500 2.242 2.176 2.294 . 0 0 "[ . 1 . 2 ]" 1
658 2 137 ILE HA 2 138 ARG H 2.100 . 2.500 2.207 2.153 2.285 . 0 0 "[ . 1 . 2 ]" 1
659 2 138 ARG HA 2 139 PHE H 2.100 . 2.500 2.211 2.135 2.274 . 0 0 "[ . 1 . 2 ]" 1
660 2 139 PHE HA 2 140 ASP H 2.100 . 2.500 2.471 2.333 2.560 0.060 17 0 "[ . 1 . 2 ]" 1
661 2 141 LYS HA 2 142 ARG H 2.100 . 2.500 2.247 2.123 2.456 . 0 0 "[ . 1 . 2 ]" 1
662 2 144 GLU HA 2 145 ALA H 2.600 . 3.500 3.526 3.512 3.541 0.041 10 0 "[ . 1 . 2 ]" 1
663 2 153 ASN HA 2 154 GLY H 2.100 . 2.500 2.253 2.114 2.535 0.035 6 0 "[ . 1 . 2 ]" 1
664 2 154 GLY HA3 2 155 GLN H 3.400 . 5.000 2.844 2.112 3.541 . 0 0 "[ . 1 . 2 ]" 1
665 2 155 GLN HA 2 156 LYS H 2.100 . 2.500 2.297 2.117 2.562 0.062 6 0 "[ . 1 . 2 ]" 1
666 2 157 PRO HA 2 158 LEU H 2.100 . 2.500 2.463 2.217 2.639 0.139 17 0 "[ . 1 . 2 ]" 1
667 2 163 PRO HA 2 164 ILE H 2.100 . 2.500 2.405 2.120 2.635 0.135 21 0 "[ . 1 . 2 ]" 1
668 2 165 THR HA 2 166 VAL H 2.100 . 2.500 2.150 2.082 2.224 . 0 0 "[ . 1 . 2 ]" 1
669 2 167 LYS HA 2 168 PHE H 2.100 . 2.500 2.493 2.329 2.560 0.060 1 0 "[ . 1 . 2 ]" 1
670 2 168 PHE HA 2 169 ALA H 2.600 . 3.500 2.294 2.135 2.538 . 0 0 "[ . 1 . 2 ]" 1
671 2 169 ALA HA 2 170 ASN H 2.100 . 2.500 2.161 2.096 2.283 . 0 0 "[ . 1 . 2 ]" 1
672 2 90 ASP QB 2 91 ALA H 3.100 . 4.500 3.869 3.516 4.091 . 0 0 "[ . 1 . 2 ]" 1
673 2 91 ALA MB 2 92 ASN H 3.100 . 4.500 3.698 3.598 3.754 . 0 0 "[ . 1 . 2 ]" 1
674 2 92 ASN HB3 2 93 LEU H 3.400 . 5.000 4.288 3.829 4.528 . 0 0 "[ . 1 . 2 ]" 1
675 2 93 LEU HB3 2 94 TYR H 2.600 . 3.500 2.728 2.313 3.093 . 0 0 "[ . 1 . 2 ]" 1
676 2 93 LEU MD2 2 94 TYR H 3.100 . 4.500 3.046 2.535 3.582 . 0 0 "[ . 1 . 2 ]" 1
677 2 94 TYR QD 2 95 VAL H 3.600 . 5.500 3.213 2.836 3.683 . 0 0 "[ . 1 . 2 ]" 1
678 2 94 TYR HB3 2 95 VAL H 3.400 . 5.000 4.479 4.363 4.563 . 0 0 "[ . 1 . 2 ]" 1
679 2 95 VAL MG1 2 96 SER H 3.100 . 4.500 2.825 2.504 3.155 . 0 0 "[ . 1 . 2 ]" 1
680 2 96 SER HB2 2 97 GLY H 2.600 . 3.500 2.378 2.076 2.731 . 0 0 "[ . 1 . 2 ]" 1
681 2 99 PRO QB 2 100 LYS H 3.100 . 4.500 2.651 2.290 2.949 . 0 0 "[ . 1 . 2 ]" 1
682 2 100 LYS QB 2 101 THR H 3.100 . 4.500 3.011 2.581 3.808 . 0 0 "[ . 1 . 2 ]" 1
683 2 102 MET QB 2 103 SER H 3.100 . 4.500 3.801 3.628 3.930 . 0 0 "[ . 1 . 2 ]" 1
684 2 102 MET QG 2 103 SER H 3.100 . 4.500 3.547 3.051 4.129 . 0 0 "[ . 1 . 2 ]" 1
685 2 103 SER QB 2 104 GLN H 3.100 . 4.500 3.761 3.534 3.901 . 0 0 "[ . 1 . 2 ]" 1
686 2 104 GLN QB 2 105 LYS H 3.100 . 4.500 2.531 2.116 3.509 . 0 0 "[ . 1 . 2 ]" 1
687 2 104 GLN QG 2 105 LYS H 3.100 . 4.500 3.776 1.906 4.390 . 0 0 "[ . 1 . 2 ]" 1
688 2 105 LYS QB 2 106 GLU H 3.100 . 4.500 2.926 2.421 3.527 . 0 0 "[ . 1 . 2 ]" 1
689 2 106 GLU QB 2 107 MET H 2.600 . 3.500 2.574 2.377 2.811 . 0 0 "[ . 1 . 2 ]" 1
690 2 107 MET QB 2 108 GLU H 2.600 . 3.500 2.668 2.507 2.841 . 0 0 "[ . 1 . 2 ]" 1
691 2 109 GLN QB 2 110 LEU H 3.100 . 4.500 3.124 2.727 3.641 . 0 0 "[ . 1 . 2 ]" 1
692 2 110 LEU HB2 2 111 PHE H 2.600 . 3.500 3.555 3.532 3.580 0.080 15 0 "[ . 1 . 2 ]" 1
693 2 110 LEU HB3 2 111 PHE H 2.600 . 3.500 2.310 2.208 2.408 . 0 0 "[ . 1 . 2 ]" 1
694 2 110 LEU MD2 2 111 PHE H 3.900 . 6.000 3.719 3.552 4.105 . 0 0 "[ . 1 . 2 ]" 1
695 2 111 PHE HB2 2 112 SER H 2.600 . 3.500 3.105 3.020 3.204 . 0 0 "[ . 1 . 2 ]" 1
696 2 113 GLN QB 2 114 TYR H 3.900 . 6.000 3.441 2.765 3.698 . 0 0 "[ . 1 . 2 ]" 1
697 2 113 GLN QG 2 114 TYR H 3.100 . 4.500 2.652 2.166 4.339 . 0 0 "[ . 1 . 2 ]" 1
698 2 114 TYR HB3 2 115 GLY H 3.400 . 5.000 3.501 3.099 3.965 . 0 0 "[ . 1 . 2 ]" 1
699 2 116 ARG QB 2 117 ILE H 3.100 . 4.500 3.804 3.583 4.007 . 0 0 "[ . 1 . 2 ]" 1
700 2 117 ILE MG 2 118 ILE H 3.100 . 4.500 2.227 1.884 2.532 . 0 0 "[ . 1 . 2 ]" 1
701 2 118 ILE HB 2 119 THR H 2.600 . 3.500 2.437 2.130 2.630 . 0 0 "[ . 1 . 2 ]" 1
702 2 118 ILE MG 2 119 THR H 2.600 . 3.500 3.489 3.078 3.565 0.065 15 0 "[ . 1 . 2 ]" 1
703 2 119 THR HB 2 120 SER H 2.600 . 3.500 3.324 2.450 3.577 0.077 15 0 "[ . 1 . 2 ]" 1
704 2 124 LEU QB 2 125 ASP H 3.100 . 4.500 3.830 2.879 4.071 . 0 0 "[ . 1 . 2 ]" 1
705 2 124 LEU QD 2 125 ASP H 3.900 . 6.000 3.680 2.366 4.192 . 0 0 "[ . 1 . 2 ]" 1
706 2 126 GLN QB 2 127 ALA H 3.100 . 4.500 3.696 2.645 4.048 . 0 0 "[ . 1 . 2 ]" 1
707 2 127 ALA MB 2 128 THR H 3.100 . 4.500 2.488 2.214 3.726 . 0 0 "[ . 1 . 2 ]" 1
708 2 128 THR MG 2 129 GLY H 3.900 . 6.000 4.177 3.431 4.474 . 0 0 "[ . 1 . 2 ]" 1
709 2 130 VAL HB 2 131 SER H 2.600 . 3.500 3.558 3.503 3.616 0.116 2 0 "[ . 1 . 2 ]" 1
710 2 130 VAL MG2 2 131 SER H 3.100 . 4.500 3.992 3.897 4.045 . 0 0 "[ . 1 . 2 ]" 1
711 2 130 VAL MG1 2 131 SER H 2.600 . 3.500 2.064 1.939 2.151 . 0 0 "[ . 1 . 2 ]" 1
712 2 131 SER QB 2 132 ARG H 3.100 . 4.500 3.482 2.812 4.034 . 0 0 "[ . 1 . 2 ]" 1
713 2 132 ARG QB 2 133 GLY H 3.100 . 4.500 2.171 1.889 2.314 . 0 0 "[ . 1 . 2 ]" 1
714 2 132 ARG QG 2 133 GLY H 3.900 . 6.000 3.977 3.260 4.267 . 0 0 "[ . 1 . 2 ]" 1
715 2 134 VAL HB 2 135 GLY H 2.600 . 3.500 3.675 3.617 3.737 0.237 11 0 "[ . 1 . 2 ]" 1
716 2 134 VAL MG1 2 135 GLY H 3.100 . 4.500 1.893 1.793 2.041 0.007 14 0 "[ . 1 . 2 ]" 1
717 2 136 PHE QD 2 137 ILE H 3.600 . 5.500 3.971 3.772 4.221 . 0 0 "[ . 1 . 2 ]" 1
718 2 136 PHE HB2 2 137 ILE H 2.600 . 3.500 3.609 3.554 3.690 0.190 7 0 "[ . 1 . 2 ]" 1
719 2 136 PHE HB3 2 137 ILE H 2.600 . 3.500 2.653 2.524 2.773 . 0 0 "[ . 1 . 2 ]" 1
720 2 137 ILE MG 2 138 ARG H 3.100 . 4.500 3.060 2.404 3.487 . 0 0 "[ . 1 . 2 ]" 1
721 2 138 ARG QB 2 139 PHE H 3.100 . 4.500 3.839 3.600 4.010 . 0 0 "[ . 1 . 2 ]" 1
722 2 139 PHE QD 2 140 ASP H 3.600 . 5.500 3.077 2.911 3.609 . 0 0 "[ . 1 . 2 ]" 1
723 2 139 PHE HB3 2 140 ASP H 2.600 . 3.500 2.194 1.960 2.546 . 0 0 "[ . 1 . 2 ]" 1
724 2 140 ASP HB2 2 141 LYS H 2.600 . 3.500 3.545 3.421 3.653 0.153 2 0 "[ . 1 . 2 ]" 1
725 2 140 ASP HB3 2 141 LYS H 2.100 . 2.500 2.244 2.031 2.449 . 0 0 "[ . 1 . 2 ]" 1
726 2 141 LYS QB 2 142 ARG H 3.100 . 4.500 3.169 2.510 3.553 . 0 0 "[ . 1 . 2 ]" 1
727 2 142 ARG QB 2 143 ILE H 3.100 . 4.500 2.806 2.237 3.524 . 0 0 "[ . 1 . 2 ]" 1
728 2 142 ARG QG 2 143 ILE H 3.100 . 4.500 3.162 1.813 4.400 . 0 0 "[ . 1 . 2 ]" 1
729 2 143 ILE HB 2 144 GLU H 3.400 . 5.000 2.702 2.504 2.843 . 0 0 "[ . 1 . 2 ]" 1
730 2 143 ILE MG 2 144 GLU H 3.100 . 4.500 3.470 3.046 3.727 . 0 0 "[ . 1 . 2 ]" 1
731 2 143 ILE QG 2 144 GLU H 3.900 . 6.000 4.066 3.920 4.276 . 0 0 "[ . 1 . 2 ]" 1
732 2 144 GLU HB3 2 145 ALA H 2.600 . 3.500 2.451 2.343 2.554 . 0 0 "[ . 1 . 2 ]" 1
733 2 145 ALA MB 2 146 GLU H 3.100 . 4.500 2.487 2.334 2.599 . 0 0 "[ . 1 . 2 ]" 1
734 2 148 ALA MB 2 149 ILE H 2.600 . 3.500 2.413 2.323 2.512 . 0 0 "[ . 1 . 2 ]" 1
735 2 149 ILE MG 2 150 LYS H 3.100 . 4.500 2.861 2.483 3.133 . 0 0 "[ . 1 . 2 ]" 1
736 2 150 LYS QB 2 151 GLY H 3.100 . 4.500 2.920 2.485 3.635 . 0 0 "[ . 1 . 2 ]" 1
737 2 152 LEU HB2 2 153 ASN H 2.100 . 2.500 2.594 2.539 2.669 0.169 18 0 "[ . 1 . 2 ]" 1
738 2 155 GLN QB 2 156 LYS H 3.100 . 4.500 3.041 2.230 3.914 . 0 0 "[ . 1 . 2 ]" 1
739 2 157 PRO QB 2 158 LEU H 3.100 . 4.500 2.439 2.017 3.047 . 0 0 "[ . 1 . 2 ]" 1
740 2 157 PRO QG 2 158 LEU H 3.100 . 4.500 4.023 3.617 4.507 0.007 9 0 "[ . 1 . 2 ]" 1
741 2 158 LEU QB 2 159 GLY H 2.600 . 3.500 2.927 2.529 3.559 0.059 8 0 "[ . 1 . 2 ]" 1
742 2 158 LEU QD 2 159 GLY H 3.900 . 6.000 3.848 2.768 4.323 . 0 0 "[ . 1 . 2 ]" 1
743 2 161 ALA MB 2 162 GLU H 2.600 . 3.500 2.456 1.979 3.605 0.105 11 0 "[ . 1 . 2 ]" 1
744 2 163 PRO QB 2 164 ILE H 3.100 . 4.500 2.848 1.892 3.948 . 0 0 "[ . 1 . 2 ]" 1
745 2 164 ILE MD 2 165 THR H 3.100 . 4.500 4.405 3.053 4.797 0.297 21 0 "[ . 1 . 2 ]" 1
746 2 165 THR MG 2 166 VAL H 3.100 . 4.500 3.160 2.563 3.460 . 0 0 "[ . 1 . 2 ]" 1
747 2 166 VAL MG2 2 167 LYS H 3.100 . 4.500 2.614 2.197 3.122 . 0 0 "[ . 1 . 2 ]" 1
748 2 168 PHE QD 2 169 ALA H 3.600 . 5.500 3.309 2.925 3.749 . 0 0 "[ . 1 . 2 ]" 1
749 2 168 PHE HB3 2 169 ALA H 2.600 . 3.500 2.780 2.178 3.329 . 0 0 "[ . 1 . 2 ]" 1
750 2 169 ALA MB 2 170 ASN H 3.100 . 4.500 3.239 2.733 3.575 . 0 0 "[ . 1 . 2 ]" 1
751 2 94 TYR QD 2 95 VAL MG2 4.900 . 8.000 4.866 4.697 5.059 . 0 0 "[ . 1 . 2 ]" 1
752 2 96 SER HA 2 97 GLY HA2 3.400 . 5.000 4.639 4.553 4.741 . 0 0 "[ . 1 . 2 ]" 1
753 2 98 LEU QB 2 99 PRO QD 4.400 . 7.000 2.234 1.792 2.887 0.008 6 0 "[ . 1 . 2 ]" 1
754 2 98 LEU MD1 2 99 PRO QD 4.400 . 7.000 4.138 3.602 4.775 . 0 0 "[ . 1 . 2 ]" 1
755 2 98 LEU MD2 2 99 PRO QD 3.600 . 5.500 2.983 2.690 3.355 . 0 0 "[ . 1 . 2 ]" 1
756 2 98 LEU HA 2 99 PRO QD 3.100 . 4.500 2.024 1.839 2.226 . 0 0 "[ . 1 . 2 ]" 1
757 2 110 LEU HB2 2 111 PHE QD 3.600 . 5.500 4.033 3.780 4.455 . 0 0 "[ . 1 . 2 ]" 1
758 2 110 LEU HB3 2 111 PHE QD 3.600 . 5.500 2.365 2.084 2.874 . 0 0 "[ . 1 . 2 ]" 1
759 2 110 LEU MD2 2 111 PHE QD 4.200 . 6.500 2.743 2.144 3.223 . 0 0 "[ . 1 . 2 ]" 1
760 2 110 LEU HB3 2 111 PHE QE 4.400 . 7.000 3.719 3.394 4.029 . 0 0 "[ . 1 . 2 ]" 1
761 2 110 LEU MD2 2 111 PHE QE 4.200 . 6.500 2.490 2.004 3.024 . 0 0 "[ . 1 . 2 ]" 1
762 2 117 ILE MG 2 118 ILE HA 3.900 . 6.000 4.013 3.745 4.158 . 0 0 "[ . 1 . 2 ]" 1
763 2 143 ILE MG 2 144 GLU HA 3.100 . 4.500 3.491 3.111 3.789 . 0 0 "[ . 1 . 2 ]" 1
764 2 156 LYS HA 2 157 PRO QD 3.100 . 4.500 2.079 1.945 2.237 . 0 0 "[ . 1 . 2 ]" 1
765 2 162 GLU HA 2 163 PRO QD 2.600 . 3.500 2.264 1.797 3.536 0.036 11 0 "[ . 1 . 2 ]" 1
766 2 162 GLU HA 2 163 PRO QG 3.900 . 6.000 4.151 3.762 5.140 . 0 0 "[ . 1 . 2 ]" 1
767 2 91 ALA MB 2 139 PHE HB3 3.100 . 4.500 3.138 2.673 4.400 . 0 0 "[ . 1 . 2 ]" 1
768 2 91 ALA MB 2 141 LYS HA 3.900 . 6.000 3.150 2.506 3.906 . 0 0 "[ . 1 . 2 ]" 1
769 2 91 ALA MB 2 142 ARG HA 2.600 . 3.500 2.545 1.920 3.150 . 0 0 "[ . 1 . 2 ]" 1
770 2 92 ASN HB3 2 138 ARG HA 3.400 . 5.000 4.936 3.324 5.080 0.080 17 0 "[ . 1 . 2 ]" 1
771 2 93 LEU H 2 137 ILE HB 3.400 . 5.000 3.964 3.461 4.445 . 0 0 "[ . 1 . 2 ]" 1
772 2 93 LEU H 2 137 ILE H 2.600 . 3.500 2.668 2.358 2.967 . 0 0 "[ . 1 . 2 ]" 1
773 2 93 LEU H 2 137 ILE MG 3.900 . 6.000 4.737 4.360 5.079 . 0 0 "[ . 1 . 2 ]" 1
774 2 93 LEU HB3 2 137 ILE HB 2.600 . 3.500 3.481 3.223 3.564 0.064 10 0 "[ . 1 . 2 ]" 1
775 2 93 LEU H 2 138 ARG HA 2.600 . 3.500 3.136 2.640 3.497 . 0 0 "[ . 1 . 2 ]" 1
776 2 93 LEU MD2 2 145 ALA HA 3.100 . 4.500 4.141 3.588 4.528 0.028 5 0 "[ . 1 . 2 ]" 1
777 2 93 LEU MD2 2 145 ALA MB 3.600 . 5.500 2.149 1.771 2.831 0.029 4 0 "[ . 1 . 2 ]" 1
778 2 93 LEU MD2 2 148 ALA MB 4.400 . 7.000 4.823 4.305 5.438 . 0 0 "[ . 1 . 2 ]" 1
779 2 93 LEU MD2 2 166 VAL MG2 3.100 . 4.500 3.340 2.324 3.966 . 0 0 "[ . 1 . 2 ]" 1
780 2 93 LEU MD2 2 167 LYS HA 3.900 . 6.000 3.572 2.571 4.419 . 0 0 "[ . 1 . 2 ]" 1
781 2 93 LEU MD2 2 168 PHE HA 3.100 . 4.500 2.348 1.916 2.814 . 0 0 "[ . 1 . 2 ]" 1
782 2 93 LEU MD2 2 168 PHE HB2 3.900 . 6.000 4.300 3.879 4.897 . 0 0 "[ . 1 . 2 ]" 1
783 2 93 LEU MD2 2 168 PHE HB3 3.900 . 6.000 4.103 3.603 4.722 . 0 0 "[ . 1 . 2 ]" 1
784 2 94 TYR QE 2 96 SER HA 4.400 . 7.000 4.178 3.639 4.653 . 0 0 "[ . 1 . 2 ]" 1
785 2 94 TYR QE 2 96 SER HB3 3.600 . 5.500 2.682 1.974 3.385 . 0 0 "[ . 1 . 2 ]" 1
786 2 94 TYR QE 2 96 SER HB2 3.600 . 5.500 4.075 3.661 4.419 . 0 0 "[ . 1 . 2 ]" 1
787 2 94 TYR QD 2 134 VAL HB 3.600 . 5.500 3.965 3.794 4.295 . 0 0 "[ . 1 . 2 ]" 1
788 2 94 TYR QD 2 134 VAL MG1 4.200 . 6.500 1.837 1.711 2.030 0.089 7 0 "[ . 1 . 2 ]" 1
789 2 94 TYR QD 2 136 PHE HA 4.400 . 7.000 5.061 4.829 5.300 . 0 0 "[ . 1 . 2 ]" 1
790 2 94 TYR H 2 166 VAL MG2 3.900 . 6.000 3.659 3.379 3.996 . 0 0 "[ . 1 . 2 ]" 1
791 2 94 TYR QD 2 167 LYS QB 4.900 . 8.000 3.470 2.868 5.351 . 0 0 "[ . 1 . 2 ]" 1
792 2 94 TYR QD 2 169 ALA HA 4.400 . 7.000 3.883 2.866 4.285 . 0 0 "[ . 1 . 2 ]" 1
793 2 94 TYR HD2 2 169 ALA MB 3.400 . 5.700 5.250 4.238 5.709 0.009 12 0 "[ . 1 . 2 ]" 1
794 2 94 TYR H 2 169 ALA HA 3.400 . 5.000 4.437 3.889 4.836 . 0 0 "[ . 1 . 2 ]" 1
795 2 94 TYR H 2 169 ALA H 3.400 . 5.000 4.023 3.302 4.638 . 0 0 "[ . 1 . 2 ]" 1
796 2 94 TYR HB3 2 169 ALA HA 2.600 . 3.500 2.919 2.361 3.274 . 0 0 "[ . 1 . 2 ]" 1
797 2 95 VAL H 2 136 PHE HA 2.600 . 3.500 2.997 2.558 3.343 . 0 0 "[ . 1 . 2 ]" 1
798 2 95 VAL MG1 2 164 ILE HB 3.100 . 4.500 3.755 2.909 4.547 0.047 13 0 "[ . 1 . 2 ]" 1
799 2 95 VAL MG2 2 166 VAL MG1 2.600 . 3.500 3.391 3.166 3.525 0.025 17 0 "[ . 1 . 2 ]" 1
800 2 95 VAL MG1 2 166 VAL HB 3.100 . 4.500 1.942 1.774 2.790 0.026 13 0 "[ . 1 . 2 ]" 1
801 2 95 VAL MG2 2 166 VAL HB 3.100 . 4.500 2.227 1.944 2.791 . 0 0 "[ . 1 . 2 ]" 1
802 2 96 SER HB3 2 134 VAL HA 3.400 . 5.000 4.261 3.436 5.036 0.036 17 0 "[ . 1 . 2 ]" 1
803 2 96 SER HB2 2 134 VAL HA 3.400 . 5.000 4.565 3.830 5.032 0.032 16 0 "[ . 1 . 2 ]" 1
804 2 96 SER H 2 165 THR HB 2.600 . 3.500 3.252 2.916 3.585 0.085 11 0 "[ . 1 . 2 ]" 1
805 2 96 SER H 2 165 THR H 2.600 . 3.500 3.301 2.854 3.566 0.066 15 0 "[ . 1 . 2 ]" 1
806 2 96 SER H 2 165 THR MG 3.900 . 6.000 3.622 2.969 4.217 . 0 0 "[ . 1 . 2 ]" 1
807 2 97 GLY H 2 134 VAL MG1 3.900 . 6.000 4.410 3.864 5.376 . 0 0 "[ . 1 . 2 ]" 1
808 2 97 GLY H 2 134 VAL MG2 3.100 . 4.500 3.968 3.257 4.531 0.031 3 0 "[ . 1 . 2 ]" 1
809 2 96 SER HA 2 98 LEU H 2.600 . 3.500 3.557 3.513 3.588 0.088 15 0 "[ . 1 . 2 ]" 1
810 2 98 LEU HG 2 133 GLY QA 3.900 . 6.000 5.924 5.400 6.070 0.070 13 0 "[ . 1 . 2 ]" 1
811 2 98 LEU H 2 133 GLY QA 3.900 . 6.000 4.826 4.103 5.530 . 0 0 "[ . 1 . 2 ]" 1
812 2 98 LEU QB 2 133 GLY QA 3.600 . 5.500 4.300 3.570 4.958 . 0 0 "[ . 1 . 2 ]" 1
813 2 98 LEU H 2 134 VAL HA 3.400 . 5.000 4.208 3.572 4.789 . 0 0 "[ . 1 . 2 ]" 1
814 2 98 LEU MD1 2 134 VAL HA 3.100 . 4.500 3.170 2.552 4.104 . 0 0 "[ . 1 . 2 ]" 1
815 2 99 PRO QB 2 101 THR H 3.100 . 4.500 2.545 2.312 2.779 . 0 0 "[ . 1 . 2 ]" 1
816 2 99 PRO QB 2 102 MET H 3.100 . 4.500 4.326 3.640 4.527 0.027 13 0 "[ . 1 . 2 ]" 1
817 2 99 PRO QD 2 102 MET ME 3.600 . 5.500 3.462 2.264 3.796 . 0 0 "[ . 1 . 2 ]" 1
818 2 100 LYS HA 2 102 MET H 2.600 . 3.500 3.599 3.543 3.657 0.157 6 0 "[ . 1 . 2 ]" 1
819 2 102 MET ME 2 107 MET HA 3.100 . 4.500 3.862 3.056 4.361 . 0 0 "[ . 1 . 2 ]" 1
820 2 103 SER H 2 106 GLU H 3.400 . 5.000 4.835 4.614 5.031 0.031 16 0 "[ . 1 . 2 ]" 1
821 2 103 SER H 2 106 GLU QB 3.100 . 4.500 3.477 3.149 3.736 . 0 0 "[ . 1 . 2 ]" 1
822 2 102 MET HA 2 104 GLN H 3.500 . 5.500 5.589 5.503 5.681 0.181 1 0 "[ . 1 . 2 ]" 1
823 2 104 GLN H 2 107 MET QB 3.900 . 6.000 4.936 4.601 5.444 . 0 0 "[ . 1 . 2 ]" 1
824 2 104 GLN QG 2 121 ARG HA 3.100 . 4.500 2.480 1.766 3.698 0.034 21 0 "[ . 1 . 2 ]" 1
825 2 102 MET QG 2 107 MET H 3.900 . 6.000 5.014 4.405 5.983 . 0 0 "[ . 1 . 2 ]" 1
826 2 102 MET QG 2 107 MET QB 4.400 . 7.000 4.151 3.012 5.202 . 0 0 "[ . 1 . 2 ]" 1
827 2 104 GLN HA 2 107 MET H 2.600 . 3.500 3.532 3.415 3.599 0.099 14 0 "[ . 1 . 2 ]" 1
828 2 107 MET H 2 122 ILE MD 3.100 . 4.500 4.083 3.732 4.443 . 0 0 "[ . 1 . 2 ]" 1
829 2 107 MET ME 2 135 GLY HA3 2.600 . 3.500 2.270 1.847 3.132 . 0 0 "[ . 1 . 2 ]" 1
830 2 107 MET ME 2 135 GLY HA2 3.100 . 4.500 3.383 2.403 4.505 0.005 10 0 "[ . 1 . 2 ]" 1
831 2 105 LYS HA 2 108 GLU H 2.100 . 3.100 3.207 3.139 3.261 0.161 20 0 "[ . 1 . 2 ]" 1
832 2 106 GLU HA 2 109 GLN H 2.600 . 3.500 3.545 3.459 3.590 0.090 15 0 "[ . 1 . 2 ]" 1
833 2 106 GLU HA 2 109 GLN QB 3.100 . 4.500 3.169 2.529 4.027 . 0 0 "[ . 1 . 2 ]" 1
834 2 93 LEU MD2 2 111 PHE QE 4.900 . 8.000 4.872 3.827 5.750 . 0 0 "[ . 1 . 2 ]" 1
835 2 95 VAL MG2 2 111 PHE QD 4.200 . 6.500 4.308 3.964 4.767 . 0 0 "[ . 1 . 2 ]" 1
836 2 95 VAL HB 2 111 PHE QE 3.600 . 5.500 4.887 4.376 5.504 0.004 15 0 "[ . 1 . 2 ]" 1
837 2 95 VAL MG2 2 111 PHE QE 3.600 . 5.500 2.948 2.735 3.418 . 0 0 "[ . 1 . 2 ]" 1
838 2 107 MET HA 2 111 PHE QD 3.600 . 5.500 3.415 2.859 4.667 . 0 0 "[ . 1 . 2 ]" 1
839 2 107 MET QB 2 111 PHE QD 4.200 . 6.500 3.897 3.274 5.333 . 0 0 "[ . 1 . 2 ]" 1
840 2 107 MET QG 2 111 PHE QD 4.200 . 6.500 4.279 2.322 5.393 . 0 0 "[ . 1 . 2 ]" 1
841 2 107 MET QB 2 111 PHE QE 4.200 . 6.500 4.329 3.735 5.670 . 0 0 "[ . 1 . 2 ]" 1
842 2 107 MET QG 2 111 PHE QE 4.200 . 6.500 4.028 2.394 5.296 . 0 0 "[ . 1 . 2 ]" 1
843 2 108 GLU HA 2 111 PHE QD 3.600 . 5.500 4.498 4.229 5.125 . 0 0 "[ . 1 . 2 ]" 1
844 2 108 GLU HA 2 111 PHE H 2.600 . 3.500 3.613 3.544 3.675 0.175 5 0 "[ . 1 . 2 ]" 1
845 2 108 GLU HA 2 111 PHE HB2 3.400 . 5.000 3.396 3.230 3.631 . 0 0 "[ . 1 . 2 ]" 1
846 2 111 PHE H 2 117 ILE MD 3.100 . 4.500 2.890 2.469 3.183 . 0 0 "[ . 1 . 2 ]" 1
847 2 111 PHE QD 2 137 ILE MD 4.200 . 6.500 2.727 2.258 3.436 . 0 0 "[ . 1 . 2 ]" 1
848 2 111 PHE QD 2 137 ILE QG 4.200 . 6.500 2.780 2.300 3.002 . 0 0 "[ . 1 . 2 ]" 1
849 2 111 PHE QE 2 137 ILE MD 4.200 . 6.500 3.330 2.800 4.322 . 0 0 "[ . 1 . 2 ]" 1
850 2 111 PHE QE 2 137 ILE QG 4.900 . 8.000 2.913 2.562 3.244 . 0 0 "[ . 1 . 2 ]" 1
851 2 111 PHE H 2 137 ILE MD 3.900 . 6.000 3.925 3.521 4.334 . 0 0 "[ . 1 . 2 ]" 1
852 2 111 PHE QD 2 139 PHE QE 4.700 . 7.500 2.057 1.787 2.787 0.013 18 0 "[ . 1 . 2 ]" 1
853 2 111 PHE H 2 139 PHE HZ 3.400 . 5.000 5.058 5.004 5.122 0.122 19 0 "[ . 1 . 2 ]" 1
854 2 111 PHE QD 2 148 ALA MB 3.600 . 5.500 3.663 3.110 4.648 . 0 0 "[ . 1 . 2 ]" 1
855 2 111 PHE QE 2 148 ALA MB 4.200 . 6.500 4.195 3.666 4.891 . 0 0 "[ . 1 . 2 ]" 1
856 2 111 PHE QD 2 152 LEU MD1 4.200 . 6.500 2.724 2.265 3.317 . 0 0 "[ . 1 . 2 ]" 1
857 2 111 PHE QD 2 152 LEU MD2 4.900 . 8.000 4.355 3.752 4.839 . 0 0 "[ . 1 . 2 ]" 1
858 2 111 PHE QE 2 152 LEU HB3 4.400 . 7.000 3.825 3.232 4.243 . 0 0 "[ . 1 . 2 ]" 1
859 2 111 PHE QE 2 152 LEU HB2 3.600 . 5.500 3.966 3.367 4.840 . 0 0 "[ . 1 . 2 ]" 1
860 2 111 PHE QE 2 152 LEU MD1 3.600 . 5.500 2.356 2.026 2.694 . 0 0 "[ . 1 . 2 ]" 1
861 2 111 PHE QE 2 152 LEU MD2 3.600 . 5.500 3.977 3.486 4.359 . 0 0 "[ . 1 . 2 ]" 1
862 2 111 PHE QE 2 166 VAL HA 3.600 . 5.500 5.404 5.110 5.542 0.042 1 0 "[ . 1 . 2 ]" 1
863 2 111 PHE QE 2 166 VAL HB 4.400 . 7.000 3.842 3.469 4.188 . 0 0 "[ . 1 . 2 ]" 1
864 2 111 PHE QE 2 166 VAL MG2 3.600 . 5.500 2.110 1.848 2.499 . 0 0 "[ . 1 . 2 ]" 1
865 2 111 PHE QE 2 166 VAL MG1 3.600 . 5.500 3.175 2.292 3.798 . 0 0 "[ . 1 . 2 ]" 1
866 2 109 GLN HA 2 112 SER H 2.600 . 3.500 3.450 3.052 3.530 0.030 1 0 "[ . 1 . 2 ]" 1
867 2 110 LEU H 2 112 SER H 2.600 . 3.500 3.684 3.614 3.719 0.219 11 0 "[ . 1 . 2 ]" 1
868 2 112 SER H 2 117 ILE MD 3.100 . 4.500 2.128 1.907 2.415 . 0 0 "[ . 1 . 2 ]" 1
869 2 109 GLN HA 2 113 GLN H 3.400 . 5.000 3.990 3.671 4.223 . 0 0 "[ . 1 . 2 ]" 1
870 2 111 PHE HA 2 113 GLN H 3.400 . 5.000 4.300 4.113 4.490 . 0 0 "[ . 1 . 2 ]" 1
871 2 110 LEU MD2 2 114 TYR QE 4.200 . 6.500 4.184 3.687 4.752 . 0 0 "[ . 1 . 2 ]" 1
872 2 111 PHE HA 2 114 TYR QD 3.600 . 5.500 2.585 2.119 2.987 . 0 0 "[ . 1 . 2 ]" 1
873 2 111 PHE HA 2 114 TYR H 3.400 . 5.000 3.233 3.103 3.377 . 0 0 "[ . 1 . 2 ]" 1
874 2 111 PHE HA 2 114 TYR HB2 3.400 . 5.000 2.520 2.342 2.836 . 0 0 "[ . 1 . 2 ]" 1
875 2 112 SER HA 2 114 TYR H 3.400 . 5.000 4.005 3.826 4.194 . 0 0 "[ . 1 . 2 ]" 1
876 2 114 TYR QD 2 147 GLU QB 4.200 . 6.500 5.533 5.036 5.967 . 0 0 "[ . 1 . 2 ]" 1
877 2 114 TYR QD 2 148 ALA HA 3.600 . 5.500 2.751 2.133 3.358 . 0 0 "[ . 1 . 2 ]" 1
878 2 114 TYR QE 2 148 ALA HA 3.600 . 5.500 3.977 3.464 4.790 . 0 0 "[ . 1 . 2 ]" 1
879 2 114 TYR QE 2 151 GLY QA 3.600 . 5.500 3.407 2.109 4.363 . 0 0 "[ . 1 . 2 ]" 1
880 2 114 TYR QD 2 152 LEU MD1 4.200 . 6.500 3.052 2.744 3.306 . 0 0 "[ . 1 . 2 ]" 1
881 2 114 TYR QD 2 152 LEU MD2 4.900 . 8.000 3.269 2.772 3.716 . 0 0 "[ . 1 . 2 ]" 1
882 2 114 TYR QE 2 152 LEU HG 3.600 . 5.500 3.068 2.610 3.523 . 0 0 "[ . 1 . 2 ]" 1
883 2 114 TYR QE 2 152 LEU HB2 3.600 . 5.500 5.152 4.721 5.528 0.028 11 0 "[ . 1 . 2 ]" 1
884 2 114 TYR QE 2 152 LEU MD1 3.600 . 5.500 3.525 3.232 3.905 . 0 0 "[ . 1 . 2 ]" 1
885 2 114 TYR QE 2 152 LEU MD2 4.200 . 6.500 2.462 2.180 2.626 . 0 0 "[ . 1 . 2 ]" 1
886 2 111 PHE HA 2 115 GLY H 3.400 . 5.000 4.387 3.845 5.003 0.003 4 0 "[ . 1 . 2 ]" 1
887 2 112 SER HA 2 115 GLY H 2.600 . 3.500 3.366 3.134 3.514 0.014 9 0 "[ . 1 . 2 ]" 1
888 2 113 GLN HA 2 115 GLY H 3.400 . 5.000 4.484 3.868 5.010 0.010 3 0 "[ . 1 . 2 ]" 1
889 2 115 GLY H 2 139 PHE QE 3.600 . 5.500 2.560 2.295 2.924 . 0 0 "[ . 1 . 2 ]" 1
890 2 115 GLY H 2 144 GLU QG 3.100 . 4.500 4.396 4.216 4.550 0.050 20 0 "[ . 1 . 2 ]" 1
891 2 111 PHE HB2 2 117 ILE MD 3.100 . 4.500 1.756 1.672 1.820 0.128 7 0 "[ . 1 . 2 ]" 1
892 2 111 PHE HB3 2 117 ILE MD 3.900 . 6.000 2.308 2.022 2.714 . 0 0 "[ . 1 . 2 ]" 1
893 2 112 SER HA 2 117 ILE H 2.100 . 2.500 2.548 2.034 2.752 0.252 2 0 "[ . 1 . 2 ]" 1
894 2 112 SER HA 2 117 ILE MD 3.100 . 4.500 2.692 2.399 2.928 . 0 0 "[ . 1 . 2 ]" 1
895 2 117 ILE MG 2 119 THR HA 3.100 . 4.500 3.502 3.049 3.817 . 0 0 "[ . 1 . 2 ]" 1
896 2 117 ILE MG 2 120 SER HA 3.900 . 6.000 3.398 3.108 3.858 . 0 0 "[ . 1 . 2 ]" 1
897 2 117 ILE MG 2 120 SER QB 3.600 . 5.500 2.325 1.778 3.412 0.022 16 0 "[ . 1 . 2 ]" 1
898 2 117 ILE MG 2 137 ILE HA 3.900 . 6.000 2.877 2.486 3.595 . 0 0 "[ . 1 . 2 ]" 1
899 2 117 ILE HA 2 139 PHE HA 2.600 . 3.500 1.963 1.798 2.152 0.002 11 0 "[ . 1 . 2 ]" 1
900 2 117 ILE MG 2 139 PHE HA 3.900 . 6.000 2.704 2.280 3.648 . 0 0 "[ . 1 . 2 ]" 1
901 2 118 ILE H 2 139 PHE HA 2.600 . 3.500 2.631 2.398 3.014 . 0 0 "[ . 1 . 2 ]" 1
902 2 118 ILE H 2 140 ASP H 3.400 . 5.000 4.206 3.880 4.420 . 0 0 "[ . 1 . 2 ]" 1
903 2 118 ILE MD 2 140 ASP HA 3.100 . 4.500 2.714 2.076 3.359 . 0 0 "[ . 1 . 2 ]" 1
904 2 118 ILE MD 2 140 ASP HB2 3.100 . 4.500 2.844 2.054 3.305 . 0 0 "[ . 1 . 2 ]" 1
905 2 118 ILE MD 2 140 ASP HB3 3.100 . 4.500 4.169 3.607 4.570 0.070 3 0 "[ . 1 . 2 ]" 1
906 2 118 ILE QG 2 140 ASP HA 3.100 . 4.500 2.558 2.193 2.851 . 0 0 "[ . 1 . 2 ]" 1
907 2 117 ILE MG 2 119 THR H 3.100 . 4.500 2.113 1.875 2.461 . 0 0 "[ . 1 . 2 ]" 1
908 2 119 THR MG 2 138 ARG QD 3.600 . 5.500 4.417 2.976 5.499 . 0 0 "[ . 1 . 2 ]" 1
909 2 120 SER QB 2 137 ILE HA 2.600 . 3.500 2.668 1.772 3.472 0.028 4 0 "[ . 1 . 2 ]" 1
910 2 121 ARG H 2 136 PHE HB2 3.400 . 5.000 3.414 3.082 3.737 . 0 0 "[ . 1 . 2 ]" 1
911 2 102 MET HA 2 122 ILE MD 2.600 . 3.500 3.579 3.508 3.670 0.170 8 0 "[ . 1 . 2 ]" 1
912 2 103 SER HA 2 122 ILE MD 3.100 . 4.500 3.650 3.285 3.878 . 0 0 "[ . 1 . 2 ]" 1
913 2 104 GLN QG 2 122 ILE H 3.100 . 4.500 3.108 2.034 4.522 0.022 20 0 "[ . 1 . 2 ]" 1
914 2 104 GLN HA 2 122 ILE MD 3.100 . 4.500 2.116 1.781 2.468 0.019 20 0 "[ . 1 . 2 ]" 1
915 2 122 ILE QG 2 135 GLY HA3 3.900 . 6.000 2.627 2.190 3.434 . 0 0 "[ . 1 . 2 ]" 1
916 2 123 LEU H 2 134 VAL H 3.400 . 5.000 3.145 2.799 3.395 . 0 0 "[ . 1 . 2 ]" 1
917 2 123 LEU H 2 135 GLY HA3 3.400 . 5.000 4.807 4.432 5.060 0.060 17 0 "[ . 1 . 2 ]" 1
918 2 124 LEU QD 2 131 SER QB 4.400 . 6.900 3.076 2.294 4.721 . 0 0 "[ . 1 . 2 ]" 1
919 2 124 LEU H 2 132 ARG QB 3.100 . 4.500 4.582 4.514 4.671 0.171 19 0 "[ . 1 . 2 ]" 1
920 2 125 ASP H 2 130 VAL H 2.600 . 3.500 3.404 2.791 3.602 0.102 4 0 "[ . 1 . 2 ]" 1
921 2 125 ASP H 2 131 SER HA 2.600 . 3.500 2.728 2.324 3.144 . 0 0 "[ . 1 . 2 ]" 1
922 2 125 ASP H 2 132 ARG QB 3.100 . 4.500 4.333 3.124 4.577 0.077 3 0 "[ . 1 . 2 ]" 1
923 2 125 ASP HB3 2 128 THR H 3.400 . 5.000 4.320 3.967 4.658 . 0 0 "[ . 1 . 2 ]" 1
924 2 125 ASP HB3 2 129 GLY H 3.400 . 5.000 2.925 2.451 3.633 . 0 0 "[ . 1 . 2 ]" 1
925 2 125 ASP HB2 2 130 VAL H 2.600 . 3.500 3.124 2.400 3.528 0.028 14 0 "[ . 1 . 2 ]" 1
926 2 125 ASP HB3 2 130 VAL H 2.600 . 3.500 1.928 1.784 2.178 0.016 15 0 "[ . 1 . 2 ]" 1
927 2 124 LEU QD 2 131 SER H 3.900 . 6.000 5.043 4.139 6.002 0.002 10 0 "[ . 1 . 2 ]" 1
928 2 125 ASP HA 2 131 SER HA 2.600 . 5.000 4.785 4.542 5.061 0.061 10 0 "[ . 1 . 2 ]" 1
929 2 124 LEU HA 2 132 ARG HA 2.600 . 5.000 4.864 4.431 5.023 0.023 7 0 "[ . 1 . 2 ]" 1
930 2 124 LEU HA 2 132 ARG H 2.600 . 3.500 2.198 1.873 2.441 . 0 0 "[ . 1 . 2 ]" 1
931 2 124 LEU QD 2 132 ARG H 3.900 . 6.000 2.963 1.932 4.145 . 0 0 "[ . 1 . 2 ]" 1
932 2 132 ARG H 2 134 VAL H 3.400 . 5.000 4.873 4.492 5.106 0.106 15 0 "[ . 1 . 2 ]" 1
933 2 122 ILE MG 2 133 GLY H 3.100 . 4.500 3.876 3.491 4.194 . 0 0 "[ . 1 . 2 ]" 1
934 2 96 SER HA 2 134 VAL MG1 3.100 . 4.500 2.494 1.876 3.451 . 0 0 "[ . 1 . 2 ]" 1
935 2 96 SER HB3 2 134 VAL MG1 3.100 . 4.500 2.448 1.779 3.706 0.021 18 0 "[ . 1 . 2 ]" 1
936 2 96 SER HB2 2 134 VAL MG1 3.900 . 6.000 3.564 2.865 4.559 . 0 0 "[ . 1 . 2 ]" 1
937 2 96 SER HA 2 134 VAL MG2 3.100 . 4.500 3.199 2.659 3.574 . 0 0 "[ . 1 . 2 ]" 1
938 2 96 SER HB2 2 134 VAL MG2 3.100 . 4.500 3.389 2.456 4.080 . 0 0 "[ . 1 . 2 ]" 1
939 2 123 LEU QD 2 134 VAL H 3.900 . 6.000 2.019 1.827 2.842 0.073 17 0 "[ . 1 . 2 ]" 1
940 2 95 VAL HB 2 135 GLY H 2.600 . 3.500 3.114 2.758 3.363 . 0 0 "[ . 1 . 2 ]" 1
941 2 95 VAL H 2 135 GLY H 2.600 . 3.500 3.272 3.030 3.497 . 0 0 "[ . 1 . 2 ]" 1
942 2 96 SER HA 2 135 GLY H 2.600 . 3.500 3.293 3.028 3.561 0.061 7 0 "[ . 1 . 2 ]" 1
943 2 98 LEU MD1 2 135 GLY H 3.100 . 4.500 2.515 2.083 3.435 . 0 0 "[ . 1 . 2 ]" 1
944 2 122 ILE QG 2 135 GLY H 3.900 . 6.000 4.263 3.672 5.348 . 0 0 "[ . 1 . 2 ]" 1
945 2 94 TYR HD1 2 136 PHE QD 2.700 . 4.000 3.320 3.072 3.466 . 0 0 "[ . 1 . 2 ]" 1
946 2 94 TYR QE 2 136 PHE QD 3.100 . 6.000 5.420 5.237 5.528 . 0 0 "[ . 1 . 2 ]" 1
947 2 94 TYR HD1 2 136 PHE QE 2.700 . 4.000 1.850 1.712 2.062 0.088 7 0 "[ . 1 . 2 ]" 1
948 2 94 TYR QE 2 136 PHE QE 2.700 . 4.000 3.888 3.690 3.993 . 0 0 "[ . 1 . 2 ]" 1
949 2 94 TYR HB2 2 136 PHE QE 2.600 . 4.000 2.650 2.110 3.113 . 0 0 "[ . 1 . 2 ]" 1
950 2 123 LEU QD 2 136 PHE QD 3.900 . 5.900 3.545 2.975 4.217 . 0 0 "[ . 1 . 2 ]" 1
951 2 123 LEU QD 2 136 PHE QE 3.900 . 5.900 2.077 1.738 2.737 0.062 5 0 "[ . 1 . 2 ]" 1
952 2 134 VAL MG1 2 136 PHE QE 4.200 . 6.500 2.770 2.048 3.225 . 0 0 "[ . 1 . 2 ]" 1
953 2 136 PHE QD 2 169 ALA MB 3.200 . 5.500 4.900 4.004 5.422 . 0 0 "[ . 1 . 2 ]" 1
954 2 136 PHE QE 2 169 ALA MB 3.200 . 5.500 5.027 4.187 5.484 . 0 0 "[ . 1 . 2 ]" 1
955 2 93 LEU HB3 2 137 ILE H 2.600 . 3.500 3.506 3.371 3.610 0.110 7 0 "[ . 1 . 2 ]" 1
956 2 93 LEU HB2 2 137 ILE H 2.600 . 3.500 2.349 1.958 2.697 . 0 0 "[ . 1 . 2 ]" 1
957 2 107 MET ME 2 137 ILE MD 3.600 . 5.500 2.319 1.802 3.255 . 0 0 "[ . 1 . 2 ]" 1
958 2 107 MET QB 2 137 ILE MD 3.600 . 5.500 2.467 1.874 3.459 . 0 0 "[ . 1 . 2 ]" 1
959 2 107 MET QG 2 137 ILE MD 3.600 . 5.500 3.298 1.809 4.157 . 0 0 "[ . 1 . 2 ]" 1
960 2 107 MET ME 2 137 ILE MG 3.600 . 5.500 4.620 4.035 5.492 . 0 0 "[ . 1 . 2 ]" 1
961 2 111 PHE HB2 2 137 ILE MD 3.100 . 4.500 2.738 2.126 3.149 . 0 0 "[ . 1 . 2 ]" 1
962 2 111 PHE HB3 2 137 ILE MD 3.100 . 4.500 3.675 3.018 4.196 . 0 0 "[ . 1 . 2 ]" 1
963 2 111 PHE HB2 2 137 ILE MG 3.900 . 6.000 2.353 1.911 2.836 . 0 0 "[ . 1 . 2 ]" 1
964 2 111 PHE HB3 2 137 ILE MG 3.900 . 6.000 2.153 1.774 2.596 0.026 16 0 "[ . 1 . 2 ]" 1
965 2 117 ILE QG 2 137 ILE MG 4.400 . 7.000 2.038 1.803 2.455 . 0 0 "[ . 1 . 2 ]" 1
966 2 117 ILE MD 2 137 ILE QG 3.100 . 4.500 3.879 3.339 4.192 . 0 0 "[ . 1 . 2 ]" 1
967 2 120 SER HA 2 137 ILE HA 2.600 . 3.500 2.294 2.088 2.508 . 0 0 "[ . 1 . 2 ]" 1
968 2 120 SER HA 2 137 ILE MD 3.900 . 6.000 3.059 2.420 3.625 . 0 0 "[ . 1 . 2 ]" 1
969 2 120 SER QB 2 137 ILE MD 3.600 . 5.500 1.912 1.792 2.498 0.008 9 0 "[ . 1 . 2 ]" 1
970 2 120 SER HA 2 137 ILE MG 3.900 . 6.000 3.637 3.305 4.184 . 0 0 "[ . 1 . 2 ]" 1
971 2 120 SER QB 2 137 ILE MG 3.600 . 5.500 2.452 1.949 3.168 . 0 0 "[ . 1 . 2 ]" 1
972 2 120 SER QB 2 137 ILE QG 4.400 . 7.000 3.755 3.378 4.472 . 0 0 "[ . 1 . 2 ]" 1
973 2 92 ASN HA 2 138 ARG QB 3.900 . 6.000 3.645 3.069 4.213 . 0 0 "[ . 1 . 2 ]" 1
974 2 117 ILE MG 2 138 ARG H 3.100 . 4.500 2.567 2.042 3.129 . 0 0 "[ . 1 . 2 ]" 1
975 2 119 THR H 2 138 ARG H 2.600 . 3.500 3.187 2.902 3.459 . 0 0 "[ . 1 . 2 ]" 1
976 2 120 SER HA 2 138 ARG H 2.600 . 3.500 2.917 2.524 3.291 . 0 0 "[ . 1 . 2 ]" 1
977 2 120 SER QB 2 138 ARG H 3.900 . 6.000 3.699 2.794 4.371 . 0 0 "[ . 1 . 2 ]" 1
978 2 91 ALA MB 2 139 PHE QD 4.200 . 6.500 4.009 3.447 5.061 . 0 0 "[ . 1 . 2 ]" 1
979 2 91 ALA MB 2 139 PHE H 3.100 . 4.500 2.729 2.116 4.211 . 0 0 "[ . 1 . 2 ]" 1
980 2 92 ASN HA 2 139 PHE H 2.600 . 3.500 3.509 2.865 3.633 0.133 3 0 "[ . 1 . 2 ]" 1
981 2 93 LEU MD2 2 139 PHE QE 4.900 . 8.000 4.570 4.095 5.174 . 0 0 "[ . 1 . 2 ]" 1
982 2 93 LEU MD1 2 139 PHE HZ 3.900 . 6.000 4.055 3.893 4.312 . 0 0 "[ . 1 . 2 ]" 1
983 2 111 PHE HB3 2 139 PHE QE 4.400 . 7.000 2.748 2.198 2.972 . 0 0 "[ . 1 . 2 ]" 1
984 2 111 PHE HA 2 139 PHE HZ 2.600 . 3.500 3.044 2.846 3.358 . 0 0 "[ . 1 . 2 ]" 1
985 2 111 PHE QD 2 139 PHE HZ 3.600 . 5.500 2.171 1.778 2.761 0.022 14 0 "[ . 1 . 2 ]" 1
986 2 111 PHE HB2 2 139 PHE HZ 2.600 . 3.500 3.556 3.495 3.608 0.108 5 0 "[ . 1 . 2 ]" 1
987 2 111 PHE HB3 2 139 PHE HZ 2.600 . 3.500 1.824 1.740 1.902 0.060 19 0 "[ . 1 . 2 ]" 1
988 2 112 SER HA 2 139 PHE QE 4.400 . 7.000 3.632 3.014 5.133 . 0 0 "[ . 1 . 2 ]" 1
989 2 114 TYR HB2 2 139 PHE HZ 2.600 . 3.500 2.873 2.619 3.041 . 0 0 "[ . 1 . 2 ]" 1
990 2 114 TYR HB3 2 139 PHE HZ 2.600 . 3.500 3.607 3.548 3.679 0.179 2 0 "[ . 1 . 2 ]" 1
991 2 115 GLY QA 2 139 PHE QD 4.200 . 6.500 3.037 1.993 3.788 . 0 0 "[ . 1 . 2 ]" 1
992 2 115 GLY QA 2 139 PHE QE 4.200 . 6.500 2.705 1.881 3.677 . 0 0 "[ . 1 . 2 ]" 1
993 2 117 ILE HA 2 139 PHE QD 4.400 . 7.000 2.870 2.183 4.084 . 0 0 "[ . 1 . 2 ]" 1
994 2 117 ILE MD 2 139 PHE QD 4.900 . 8.000 4.423 4.049 4.755 . 0 0 "[ . 1 . 2 ]" 1
995 2 117 ILE MG 2 139 PHE QD 4.900 . 8.000 3.483 2.956 4.168 . 0 0 "[ . 1 . 2 ]" 1
996 2 117 ILE MG 2 139 PHE QE 4.200 . 6.500 3.981 3.539 4.594 . 0 0 "[ . 1 . 2 ]" 1
997 2 117 ILE QG 2 139 PHE QE 4.900 . 8.000 2.429 1.883 3.187 . 0 0 "[ . 1 . 2 ]" 1
998 2 117 ILE MD 2 139 PHE HZ 3.100 . 4.500 3.619 3.289 3.953 . 0 0 "[ . 1 . 2 ]" 1
999 2 137 ILE MG 2 139 PHE QD 4.200 . 6.500 2.958 2.083 3.389 . 0 0 "[ . 1 . 2 ]" 1
1000 2 137 ILE MG 2 139 PHE QE 4.200 . 6.500 2.495 1.800 2.994 . 0 0 "[ . 1 . 2 ]" 1
1001 2 137 ILE MG 2 139 PHE H 3.900 . 6.000 3.697 3.365 4.171 . 0 0 "[ . 1 . 2 ]" 1
1002 2 139 PHE QD 2 144 GLU HB3 4.400 . 7.000 3.902 2.512 4.749 . 0 0 "[ . 1 . 2 ]" 1
1003 2 139 PHE QD 2 144 GLU HB2 4.400 . 7.000 5.281 4.064 6.159 . 0 0 "[ . 1 . 2 ]" 1
1004 2 139 PHE QD 2 145 ALA HA 3.600 . 5.500 3.169 2.222 3.910 . 0 0 "[ . 1 . 2 ]" 1
1005 2 139 PHE QE 2 145 ALA HA 3.600 . 5.500 3.414 2.805 3.982 . 0 0 "[ . 1 . 2 ]" 1
1006 2 139 PHE QD 2 148 ALA MB 4.200 . 6.500 4.180 3.567 4.961 . 0 0 "[ . 1 . 2 ]" 1
1007 2 139 PHE QE 2 148 ALA MB 4.200 . 6.500 3.172 2.479 3.993 . 0 0 "[ . 1 . 2 ]" 1
1008 2 139 PHE HZ 2 148 ALA MB 3.100 . 4.500 3.415 3.055 3.913 . 0 0 "[ . 1 . 2 ]" 1
1009 2 117 ILE HA 2 140 ASP H 2.600 . 3.500 3.520 3.353 3.616 0.116 2 0 "[ . 1 . 2 ]" 1
1010 2 118 ILE MD 2 141 LYS H 3.900 . 6.000 5.392 5.034 5.714 . 0 0 "[ . 1 . 2 ]" 1
1011 2 139 PHE HA 2 141 LYS H 3.400 . 5.000 4.785 4.535 4.965 . 0 0 "[ . 1 . 2 ]" 1
1012 2 139 PHE HB3 2 141 LYS H 2.600 . 3.500 2.968 2.634 3.270 . 0 0 "[ . 1 . 2 ]" 1
1013 2 91 ALA HA 2 142 ARG HA 2.600 . 3.500 2.988 2.411 3.575 0.075 7 0 "[ . 1 . 2 ]" 1
1014 2 115 GLY QA 2 144 GLU QG 3.600 . 5.500 2.013 1.773 2.231 0.027 6 0 "[ . 1 . 2 ]" 1
1015 2 141 LYS QG 2 144 GLU H 3.100 . 4.500 3.760 1.949 4.563 0.063 9 0 "[ . 1 . 2 ]" 1
1016 2 91 ALA MB 2 145 ALA H 3.100 . 4.500 4.209 3.351 4.541 0.041 10 0 "[ . 1 . 2 ]" 1
1017 2 142 ARG HA 2 145 ALA H 2.600 . 3.500 3.411 3.278 3.547 0.047 10 0 "[ . 1 . 2 ]" 1
1018 2 143 ILE HA 2 145 ALA H 3.400 . 5.000 4.460 4.315 4.565 . 0 0 "[ . 1 . 2 ]" 1
1019 2 143 ILE HA 2 146 GLU H 2.600 . 3.500 3.279 3.075 3.496 . 0 0 "[ . 1 . 2 ]" 1
1020 2 143 ILE HA 2 146 GLU QB 3.100 . 4.500 2.266 1.800 2.689 0.000 13 0 "[ . 1 . 2 ]" 1
1021 2 143 ILE HA 2 146 GLU QG 3.900 . 6.000 4.117 3.521 4.698 . 0 0 "[ . 1 . 2 ]" 1
1022 2 144 GLU H 2 146 GLU H 3.400 . 5.000 3.984 3.746 4.173 . 0 0 "[ . 1 . 2 ]" 1
1023 2 146 GLU H 2 168 PHE HZ 2.600 . 3.500 2.468 2.086 3.241 . 0 0 "[ . 1 . 2 ]" 1
1024 2 143 ILE HA 2 147 GLU H 2.600 . 3.500 3.565 3.517 3.620 0.120 4 0 "[ . 1 . 2 ]" 1
1025 2 145 ALA H 2 147 GLU H 3.400 . 5.000 4.352 4.148 4.595 . 0 0 "[ . 1 . 2 ]" 1
1026 2 114 TYR HB2 2 148 ALA MB 3.100 . 4.500 3.276 3.027 3.590 . 0 0 "[ . 1 . 2 ]" 1
1027 2 114 TYR HB3 2 148 ALA MB 3.100 . 4.500 2.242 1.878 2.553 . 0 0 "[ . 1 . 2 ]" 1
1028 2 145 ALA HA 2 148 ALA MB 3.100 . 4.500 2.347 2.086 2.634 . 0 0 "[ . 1 . 2 ]" 1
1029 2 93 LEU MD2 2 149 ILE MD 3.100 . 4.500 1.797 1.727 2.025 0.073 14 0 "[ . 1 . 2 ]" 1
1030 2 145 ALA HA 2 149 ILE H 2.600 . 3.500 3.583 3.513 3.628 0.128 2 0 "[ . 1 . 2 ]" 1
1031 2 146 GLU HA 2 149 ILE H 2.600 . 3.500 3.557 3.505 3.602 0.102 11 0 "[ . 1 . 2 ]" 1
1032 2 146 GLU HA 2 149 ILE MD 3.100 . 4.500 2.515 1.939 3.057 . 0 0 "[ . 1 . 2 ]" 1
1033 2 149 ILE MG 2 153 ASN QB 3.600 . 5.500 2.435 1.957 3.230 . 0 0 "[ . 1 . 2 ]" 1
1034 2 149 ILE QG 2 166 VAL MG2 3.600 . 5.500 2.394 1.794 3.351 0.006 19 0 "[ . 1 . 2 ]" 1
1035 2 149 ILE MD 2 167 LYS HA 3.100 . 4.500 2.386 1.836 3.513 . 0 0 "[ . 1 . 2 ]" 1
1036 2 149 ILE QG 2 167 LYS HA 3.900 . 6.000 2.804 2.195 3.952 . 0 0 "[ . 1 . 2 ]" 1
1037 2 148 ALA HA 2 151 GLY H 2.600 . 3.500 3.385 3.207 3.521 0.021 17 0 "[ . 1 . 2 ]" 1
1038 2 149 ILE H 2 151 GLY H 3.400 . 5.000 4.216 4.023 4.409 . 0 0 "[ . 1 . 2 ]" 1
1039 2 110 LEU HG 2 152 LEU MD1 3.100 . 4.500 4.540 4.520 4.580 0.080 6 0 "[ . 1 . 2 ]" 1
1040 2 110 LEU MD2 2 152 LEU MD1 3.600 . 5.500 3.383 3.167 4.101 . 0 0 "[ . 1 . 2 ]" 1
1041 2 110 LEU MD1 2 152 LEU MD1 3.600 . 5.500 5.338 5.226 5.458 . 0 0 "[ . 1 . 2 ]" 1
1042 2 110 LEU HG 2 152 LEU MD2 3.100 . 4.500 3.693 2.861 4.267 . 0 0 "[ . 1 . 2 ]" 1
1043 2 148 ALA HA 2 152 LEU H 3.400 . 5.000 4.673 3.665 4.948 . 0 0 "[ . 1 . 2 ]" 1
1044 2 148 ALA HA 2 152 LEU MD1 3.900 . 6.000 3.795 3.272 4.371 . 0 0 "[ . 1 . 2 ]" 1
1045 2 148 ALA MB 2 152 LEU MD1 3.600 . 5.500 2.337 1.908 2.782 . 0 0 "[ . 1 . 2 ]" 1
1046 2 149 ILE HA 2 152 LEU H 3.400 . 5.000 3.569 3.293 3.830 . 0 0 "[ . 1 . 2 ]" 1
1047 2 152 LEU MD1 2 166 VAL MG1 3.600 . 5.500 3.158 2.674 3.457 . 0 0 "[ . 1 . 2 ]" 1
1048 2 149 ILE HA 2 153 ASN H 2.600 . 3.500 3.205 2.860 3.551 0.051 12 0 "[ . 1 . 2 ]" 1
1049 2 153 ASN H 2 164 ILE MD 3.900 . 6.000 4.609 3.295 5.464 . 0 0 "[ . 1 . 2 ]" 1
1050 2 153 ASN HA 2 165 THR HA 2.600 . 3.500 3.498 3.021 3.650 0.150 20 0 "[ . 1 . 2 ]" 1
1051 2 153 ASN H 2 166 VAL MG1 3.100 . 4.500 2.651 2.386 2.894 . 0 0 "[ . 1 . 2 ]" 1
1052 2 154 GLY H 2 164 ILE HB 3.400 . 5.000 4.511 3.802 5.045 0.045 6 0 "[ . 1 . 2 ]" 1
1053 2 154 GLY H 2 164 ILE MG 3.900 . 6.000 5.323 4.732 5.714 . 0 0 "[ . 1 . 2 ]" 1
1054 2 154 GLY H 2 164 ILE QG 3.900 . 6.000 2.963 2.081 3.494 . 0 0 "[ . 1 . 2 ]" 1
1055 2 154 GLY H 2 165 THR HA 2.600 . 3.500 2.920 1.965 3.545 0.045 12 0 "[ . 1 . 2 ]" 1
1056 2 154 GLY H 2 165 THR MG 3.900 . 6.000 4.564 3.775 5.405 . 0 0 "[ . 1 . 2 ]" 1
1057 2 154 GLY H 2 166 VAL H 3.400 . 5.000 3.453 2.313 4.364 . 0 0 "[ . 1 . 2 ]" 1
1058 2 154 GLY H 2 166 VAL MG1 3.900 . 6.000 3.675 3.053 4.371 . 0 0 "[ . 1 . 2 ]" 1
1059 2 155 GLN H 2 163 PRO QG 3.100 . 4.500 4.296 3.289 4.607 0.107 20 0 "[ . 1 . 2 ]" 1
1060 2 155 GLN H 2 164 ILE MD 3.100 . 4.500 4.502 4.023 4.804 0.304 6 0 "[ . 1 . 2 ]" 1
1061 2 155 GLN H 2 164 ILE QG 3.100 . 4.500 4.148 3.202 4.616 0.116 21 0 "[ . 1 . 2 ]" 1
1062 2 156 LYS HA 2 160 ALA MB 3.100 . 4.500 3.487 2.149 4.578 0.078 15 0 "[ . 1 . 2 ]" 1
1063 2 157 PRO QD 2 160 ALA MB 3.600 . 5.500 2.364 1.791 3.916 0.009 13 0 "[ . 1 . 2 ]" 1
1064 2 158 LEU HA 2 160 ALA H 2.600 . 3.500 3.610 3.563 3.704 0.204 6 0 "[ . 1 . 2 ]" 1
1065 2 156 LYS QB 2 162 GLU H 3.900 . 6.000 5.404 4.079 6.140 0.140 9 0 "[ . 1 . 2 ]" 1
1066 2 95 VAL HA 2 165 THR H 3.400 . 5.000 4.578 4.319 4.884 . 0 0 "[ . 1 . 2 ]" 1
1067 2 149 ILE HA 2 166 VAL MG2 3.100 . 4.500 3.066 2.631 3.926 . 0 0 "[ . 1 . 2 ]" 1
1068 2 149 ILE HA 2 166 VAL MG1 3.100 . 4.500 2.993 2.223 3.658 . 0 0 "[ . 1 . 2 ]" 1
1069 2 153 ASN QB 2 166 VAL H 3.900 . 6.000 2.851 2.332 3.934 . 0 0 "[ . 1 . 2 ]" 1
1070 2 153 ASN HA 2 166 VAL MG1 3.100 . 4.500 2.058 1.773 2.644 0.027 18 0 "[ . 1 . 2 ]" 1
1071 2 153 ASN QB 2 166 VAL MG1 3.600 . 5.500 2.457 1.895 3.386 . 0 0 "[ . 1 . 2 ]" 1
1072 2 95 VAL HA 2 167 LYS H 3.400 . 5.000 3.370 3.157 3.738 . 0 0 "[ . 1 . 2 ]" 1
1073 2 93 LEU HA 2 168 PHE QD 4.400 . 7.000 3.632 2.611 4.297 . 0 0 "[ . 1 . 2 ]" 1
1074 2 93 LEU MD2 2 168 PHE QD 4.200 . 6.500 2.469 1.985 2.940 . 0 0 "[ . 1 . 2 ]" 1
1075 2 93 LEU MD2 2 168 PHE QE 4.200 . 6.500 2.729 2.099 3.203 . 0 0 "[ . 1 . 2 ]" 1
1076 2 93 LEU MD2 2 168 PHE H 3.900 . 6.000 3.542 2.739 4.183 . 0 0 "[ . 1 . 2 ]" 1
1077 2 93 LEU MD2 2 168 PHE HZ 3.100 . 4.500 3.739 3.161 4.514 0.014 20 0 "[ . 1 . 2 ]" 1
1078 2 145 ALA MB 2 168 PHE HZ 2.600 . 3.500 2.678 1.788 3.526 0.026 15 0 "[ . 1 . 2 ]" 1
1079 2 146 GLU HA 2 168 PHE HZ 2.600 . 3.500 2.901 2.072 3.521 0.021 2 0 "[ . 1 . 2 ]" 1
1080 2 146 GLU QG 2 168 PHE HZ 3.100 . 4.500 3.607 2.415 4.506 0.006 9 0 "[ . 1 . 2 ]" 1
1081 2 149 ILE MD 2 168 PHE QD 4.200 . 6.500 2.759 2.510 3.360 . 0 0 "[ . 1 . 2 ]" 1
1082 2 149 ILE MG 2 168 PHE QD 4.900 . 8.000 4.188 3.495 4.906 . 0 0 "[ . 1 . 2 ]" 1
1083 2 149 ILE MD 2 168 PHE QE 4.200 . 6.500 2.711 2.329 3.116 . 0 0 "[ . 1 . 2 ]" 1
1084 2 149 ILE MD 2 168 PHE H 3.100 . 4.500 2.565 2.085 3.454 . 0 0 "[ . 1 . 2 ]" 1
1085 2 149 ILE MD 2 168 PHE HZ 3.100 . 4.500 3.278 2.680 3.727 . 0 0 "[ . 1 . 2 ]" 1
1086 2 149 ILE QG 2 168 PHE HZ 3.900 . 6.000 4.778 4.371 5.443 . 0 0 "[ . 1 . 2 ]" 1
1087 2 93 LEU HA 2 169 ALA H 2.600 . 3.500 3.476 2.906 3.584 0.084 1 0 "[ . 1 . 2 ]" 1
1088 2 93 LEU MD2 2 169 ALA H 3.100 . 4.500 3.866 3.200 4.414 . 0 0 "[ . 1 . 2 ]" 1
1089 2 94 TYR HB3 2 169 ALA MB 3.100 . 4.500 3.945 3.130 4.527 0.027 9 0 "[ . 1 . 2 ]" 1
1090 2 92 ASN HA 2 138 ARG HA 2.100 . 5.000 2.128 2.025 2.309 . 0 0 "[ . 1 . 2 ]" 1
1091 2 104 GLN HA 2 121 ARG HA 2.600 . 3.500 3.512 3.223 3.643 0.143 14 0 "[ . 1 . 2 ]" 1
1092 2 96 SER HA 2 134 VAL HA 2.100 . 5.000 2.745 2.366 3.255 . 0 0 "[ . 1 . 2 ]" 1
1093 2 164 ILE HA 2 165 THR H 2.100 . 5.000 2.215 2.113 2.490 . 0 0 "[ . 1 . 2 ]" 1
1094 2 121 ARG H 2 137 ILE HA 2.600 . 3.500 3.627 3.540 3.732 0.232 18 0 "[ . 1 . 2 ]" 1
1095 2 85 SER H 2 88 ILE MG 2.600 . 4.100 3.546 2.358 4.248 0.148 10 0 "[ . 1 . 2 ]" 1
1096 2 85 SER H 2 88 ILE MD 2.600 . 4.100 3.213 2.040 4.152 0.052 15 0 "[ . 1 . 2 ]" 1
1097 2 84 SER H 2 85 SER H 2.600 . 4.100 3.405 2.258 4.297 0.197 18 0 "[ . 1 . 2 ]" 1
1098 2 86 ALA H 2 87 SER H 2.600 . 4.100 2.689 2.134 4.037 . 0 0 "[ . 1 . 2 ]" 1
1099 2 87 SER H 2 88 ILE H 2.600 . 4.100 3.348 2.194 4.130 0.030 3 0 "[ . 1 . 2 ]" 1
1100 2 93 LEU H 2 93 LEU HG 2.600 . 3.500 3.158 2.656 3.518 0.018 5 0 "[ . 1 . 2 ]" 1
1101 2 93 LEU H 2 93 LEU HB2 2.600 . 3.500 2.516 2.287 2.658 . 0 0 "[ . 1 . 2 ]" 1
1102 2 93 LEU HA 2 93 LEU MD2 2.600 . 3.500 1.999 1.790 2.336 0.010 7 0 "[ . 1 . 2 ]" 1
1103 2 94 TYR HA 2 94 TYR QD 3.900 . 6.000 2.848 2.709 3.035 . 0 0 "[ . 1 . 2 ]" 1
1104 2 94 TYR H 2 94 TYR HB3 2.600 . 3.500 2.412 2.271 2.566 . 0 0 "[ . 1 . 2 ]" 1
1105 2 95 VAL H 2 95 VAL HB 2.600 . 3.500 2.798 2.587 2.939 . 0 0 "[ . 1 . 2 ]" 1
1106 2 95 VAL H 2 95 VAL MG2 3.100 . 4.500 2.643 2.366 3.065 . 0 0 "[ . 1 . 2 ]" 1
1107 2 95 VAL HA 2 95 VAL MG1 2.900 . 4.000 2.213 2.127 2.397 . 0 0 "[ . 1 . 2 ]" 1
1108 2 95 VAL HA 2 95 VAL MG2 2.900 . 4.000 2.461 2.321 2.608 . 0 0 "[ . 1 . 2 ]" 1
1109 2 96 SER H 2 96 SER HB3 2.600 . 3.500 3.113 2.653 3.391 . 0 0 "[ . 1 . 2 ]" 1
1110 2 96 SER HA 2 96 SER HB3 2.600 . 3.500 2.433 2.330 2.594 . 0 0 "[ . 1 . 2 ]" 1
1111 2 96 SER HA 2 96 SER HB2 2.600 . 3.500 2.498 2.353 2.610 . 0 0 "[ . 1 . 2 ]" 1
1112 2 97 GLY H 2 97 GLY HA2 2.100 . 2.500 2.351 2.309 2.424 . 0 0 "[ . 1 . 2 ]" 1
1113 2 101 THR H 2 101 THR MG 2.600 . 3.500 2.726 2.282 3.209 . 0 0 "[ . 1 . 2 ]" 1
1114 2 102 MET HA 2 102 MET ME 2.600 . 3.500 2.645 2.194 3.402 . 0 0 "[ . 1 . 2 ]" 1
1115 2 102 MET H 2 102 MET QB 2.500 . 3.100 2.196 2.101 2.281 . 0 0 "[ . 1 . 2 ]" 1
1116 2 103 SER H 2 103 SER QB 2.900 . 4.000 2.222 2.101 2.358 . 0 0 "[ . 1 . 2 ]" 1
1117 2 108 GLU H 2 108 GLU QB 2.600 . 3.500 2.156 2.038 2.255 . 0 0 "[ . 1 . 2 ]" 1
1118 2 110 LEU H 2 110 LEU HB2 2.100 . 2.500 2.333 2.266 2.401 . 0 0 "[ . 1 . 2 ]" 1
1119 2 110 LEU H 2 110 LEU MD1 3.100 . 4.500 3.930 3.818 4.030 . 0 0 "[ . 1 . 2 ]" 1
1120 2 111 PHE HA 2 111 PHE QD 3.100 . 4.500 3.002 2.469 3.138 . 0 0 "[ . 1 . 2 ]" 1
1121 2 111 PHE H 2 111 PHE QD 3.100 . 4.500 2.322 2.110 2.624 . 0 0 "[ . 1 . 2 ]" 1
1122 2 111 PHE H 2 111 PHE HB2 2.600 . 3.500 2.295 2.239 2.354 . 0 0 "[ . 1 . 2 ]" 1
1123 2 111 PHE HA 2 111 PHE HB3 2.600 . 3.500 2.591 2.556 2.619 . 0 0 "[ . 1 . 2 ]" 1
1124 2 114 TYR HA 2 114 TYR QD 2.600 . 3.500 2.995 2.757 3.093 . 0 0 "[ . 1 . 2 ]" 1
1125 2 114 TYR H 2 114 TYR HB2 2.600 . 3.500 2.250 2.227 2.270 . 0 0 "[ . 1 . 2 ]" 1
1126 2 114 TYR HA 2 114 TYR HB3 2.600 . 3.500 2.625 2.615 2.644 . 0 0 "[ . 1 . 2 ]" 1
1127 2 117 ILE H 2 117 ILE QG 3.100 . 4.500 1.979 1.872 2.419 . 0 0 "[ . 1 . 2 ]" 1
1128 2 117 ILE HA 2 117 ILE MG 2.500 . 3.100 2.261 2.139 2.465 . 0 0 "[ . 1 . 2 ]" 1
1129 2 117 ILE HA 2 117 ILE QG 2.900 . 4.000 2.625 2.356 2.690 . 0 0 "[ . 1 . 2 ]" 1
1130 2 118 ILE H 2 118 ILE HB 2.100 . 2.500 2.569 2.514 2.617 0.117 11 0 "[ . 1 . 2 ]" 1
1131 2 118 ILE H 2 118 ILE MD 3.100 . 4.500 3.409 3.126 3.804 . 0 0 "[ . 1 . 2 ]" 1
1132 2 121 ARG H 2 121 ARG QB 2.900 . 4.000 3.008 2.807 3.455 . 0 0 "[ . 1 . 2 ]" 1
1133 2 154 GLY H 2 154 GLY HA3 2.600 . 3.500 2.381 2.301 2.571 . 0 0 "[ . 1 . 2 ]" 1
1134 2 109 GLN QE 2 110 LEU QB 2.600 . 4.100 3.094 1.919 3.605 . 0 0 "[ . 1 . 2 ]" 1
1135 2 109 GLN QE 2 110 LEU HG 2.600 . 4.100 4.153 4.121 4.185 0.085 13 0 "[ . 1 . 2 ]" 1
1136 2 109 GLN QE 2 110 LEU QD 2.600 . 6.000 2.804 2.183 3.053 . 0 0 "[ . 1 . 2 ]" 1
1137 2 110 LEU QB 2 113 GLN QE 2.600 . 4.100 3.820 3.670 4.016 . 0 0 "[ . 1 . 2 ]" 1
1138 2 110 LEU HG 2 113 GLN QE 2.600 . 4.100 2.934 2.399 4.119 0.019 3 0 "[ . 1 . 2 ]" 1
1139 2 110 LEU QD 2 113 GLN QE 2.600 . 6.000 2.998 2.686 3.475 . 0 0 "[ . 1 . 2 ]" 1
1140 2 149 ILE MG 2 153 ASN QD 2.600 . 4.100 2.913 1.782 4.086 0.018 17 0 "[ . 1 . 2 ]" 1
1141 2 150 LYS QB 2 153 ASN QD 2.600 . 4.100 3.882 3.366 4.180 0.080 7 0 "[ . 1 . 2 ]" 1
1142 1 2 A H2' 1 2 A H8 2.600 . 3.500 2.683 2.447 2.936 . 0 0 "[ . 1 . 2 ]" 1
1143 1 2 A H3' 1 2 A H8 3.100 . 4.500 4.284 4.054 4.406 . 0 0 "[ . 1 . 2 ]" 1
1144 1 7 U H3' 1 7 U H6 2.100 . 2.500 2.128 1.945 2.573 0.073 5 0 "[ . 1 . 2 ]" 1
1145 1 9 U H3' 1 9 U H6 3.100 . 4.500 4.695 4.604 4.828 0.328 2 0 "[ . 1 . 2 ]" 1
1146 1 9 U H5' 1 9 U H6 3.100 . 4.500 3.804 2.753 4.189 . 0 0 "[ . 1 . 2 ]" 1
1147 1 9 U H5'' 1 9 U H6 3.100 . 4.500 3.531 2.759 4.270 . 0 0 "[ . 1 . 2 ]" 1
1148 1 6 A H2' 1 6 A H8 2.600 . 3.500 3.164 2.301 3.645 0.145 16 0 "[ . 1 . 2 ]" 1
1149 1 6 A H3' 1 6 A H8 2.600 . 3.500 2.345 1.911 2.895 . 0 0 "[ . 1 . 2 ]" 1
1150 1 2 A H2 2 169 ALA MB 2.600 . 3.500 3.289 2.479 3.639 0.139 12 0 "[ . 1 . 2 ]" 1
1151 1 2 A H2 2 170 ASN HB2 2.600 . 3.500 3.507 3.116 3.592 0.092 20 0 "[ . 1 . 2 ]" 1
1152 1 2 A H2 2 170 ASN H 2.100 . 2.500 1.851 1.772 1.972 0.028 17 0 "[ . 1 . 2 ]" 1
1153 1 2 A H2 2 94 TYR QB 2.600 . 3.500 2.474 2.232 2.791 . 0 0 "[ . 1 . 2 ]" 1
1154 1 2 A H2 2 94 TYR HD2 2.100 . 2.500 2.885 2.781 2.934 0.434 7 0 "[ . 1 . 2 ]" 1
1155 1 2 A H2 2 94 TYR QE 3.100 . 4.500 4.350 4.211 4.422 . 0 0 "[ . 1 . 2 ]" 1
1156 1 2 A H8 2 94 TYR HD1 3.100 . 4.500 4.834 4.738 4.889 0.389 16 0 "[ . 1 . 2 ]" 1
1157 1 2 A H8 2 94 TYR QE 2.600 . 3.500 3.250 3.081 3.388 . 0 0 "[ . 1 . 2 ]" 1
1158 1 2 A H1' 2 134 VAL MG1 2.600 . 3.500 3.401 2.996 3.595 0.095 12 0 "[ . 1 . 2 ]" 1
1159 1 2 A H1' 2 134 VAL HB 3.100 . 4.500 4.622 4.532 4.841 0.341 7 0 "[ . 1 . 2 ]" 1
1160 1 2 A H1' 2 136 PHE HZ 2.600 . 3.500 2.706 2.146 3.554 0.054 18 0 "[ . 1 . 2 ]" 1
1161 1 2 A H1' 2 123 LEU MD2 3.100 . 4.500 4.314 3.961 4.709 0.209 16 0 "[ . 1 . 2 ]" 1
1162 1 2 A H4' 2 134 VAL MG2 2.600 . 3.500 3.112 2.800 3.507 0.007 2 0 "[ . 1 . 2 ]" 1
1163 1 2 A H4' 2 123 LEU MD2 2.600 . 3.500 1.788 1.713 1.873 0.087 5 0 "[ . 1 . 2 ]" 1
1164 1 2 A H4' 2 132 ARG QB 3.100 . 4.500 3.551 3.218 4.025 . 0 0 "[ . 1 . 2 ]" 1
1165 1 2 A H4' 2 136 PHE QE 3.100 . 4.500 3.350 3.027 3.831 . 0 0 "[ . 1 . 2 ]" 1
1166 1 2 A H5' 2 134 VAL MG2 2.600 . 3.500 2.175 1.803 2.809 . 0 0 "[ . 1 . 2 ]" 1
1167 1 2 A H5'' 2 134 VAL MG2 2.600 . 3.500 2.119 1.838 3.227 . 0 0 "[ . 1 . 2 ]" 1
1168 1 2 A H5' 2 123 LEU MD2 2.600 . 3.500 3.498 2.916 3.697 0.197 14 0 "[ . 1 . 2 ]" 1
1169 1 2 A H5'' 2 123 LEU MD2 2.600 . 3.500 2.421 1.894 3.570 0.070 7 0 "[ . 1 . 2 ]" 1
1170 1 2 A H5' 2 132 ARG QB 2.600 . 3.500 3.473 2.267 3.651 0.151 19 0 "[ . 1 . 2 ]" 1
1171 1 2 A H5'' 2 132 ARG QB 2.600 . 3.500 2.180 1.910 2.746 . 0 0 "[ . 1 . 2 ]" 1
1172 1 2 A H5' 2 94 TYR QE 3.100 . 4.500 3.713 3.034 4.514 0.014 16 0 "[ . 1 . 2 ]" 1
1173 1 2 A H5'' 2 94 TYR QE 3.100 . 4.500 4.579 4.437 4.780 0.280 7 0 "[ . 1 . 2 ]" 1
1174 1 3 U H5 2 123 LEU MD1 3.100 . 4.500 4.498 4.231 4.636 0.136 2 0 "[ . 1 . 2 ]" 1
1175 1 3 U H5 2 136 PHE QD 3.100 . 4.500 4.092 3.834 4.258 . 0 0 "[ . 1 . 2 ]" 1
1176 1 3 U H5 2 136 PHE QE . . 2.500 2.614 2.549 2.671 0.171 7 0 "[ . 1 . 2 ]" 1
1177 1 3 U H5 2 136 PHE HZ 2.100 . 2.500 2.699 2.539 2.794 0.294 4 0 "[ . 1 . 2 ]" 1
1178 1 3 U H6 2 123 LEU MD1 3.100 . 4.500 3.077 2.377 4.059 . 0 0 "[ . 1 . 2 ]" 1
1179 1 3 U H6 2 136 PHE QE 2.100 . 2.500 2.629 2.554 2.721 0.221 13 0 "[ . 1 . 2 ]" 1
1180 1 3 U H6 2 136 PHE HZ 2.100 . 2.500 2.253 1.767 2.463 0.033 7 0 "[ . 1 . 2 ]" 1
1181 1 3 U H1' 2 123 LEU QD 3.100 . 4.500 3.971 3.373 4.547 0.047 18 0 "[ . 1 . 2 ]" 1
1182 1 3 U H1' 2 136 PHE QE 2.100 . 2.500 2.680 2.591 2.759 0.259 7 0 "[ . 1 . 2 ]" 1
1183 1 3 U H1' 2 136 PHE HZ 3.100 . 4.500 4.608 4.546 4.706 0.206 18 0 "[ . 1 . 2 ]" 1
1184 1 3 U H4' 2 123 LEU QD 2.600 . 3.500 2.827 2.218 3.564 0.064 14 0 "[ . 1 . 2 ]" 1
1185 1 3 U H5' 2 123 LEU QD 3.100 . 4.500 2.315 1.625 3.177 0.175 2 0 "[ . 1 . 2 ]" 1
1186 1 3 U H5'' 2 123 LEU QD 3.100 . 4.500 3.210 2.271 3.930 . 0 0 "[ . 1 . 2 ]" 1
1187 1 3 U H5' 2 123 LEU QB 2.600 . 3.500 2.957 2.395 3.705 0.205 7 0 "[ . 1 . 2 ]" 1
1188 1 3 U H5'' 2 123 LEU QB 2.600 . 3.500 3.780 3.621 4.018 0.518 8 1 "[ . + 1 . 2 ]" 1
1189 1 4 U H3 2 75 THR MG 2.600 . 3.500 2.594 1.939 3.581 0.081 3 0 "[ . 1 . 2 ]" 1
1190 1 4 U H3 2 75 THR HB 2.600 . 3.500 3.340 3.091 3.620 0.120 7 0 "[ . 1 . 2 ]" 1
1191 1 4 U H5 2 11 TYR QE 3.100 . 4.500 3.910 3.060 4.524 0.024 7 0 "[ . 1 . 2 ]" 1
1192 1 4 U H5 2 77 LYS QB 3.100 . 4.500 4.581 4.500 4.687 0.187 16 0 "[ . 1 . 2 ]" 1
1193 1 4 U H6 2 11 TYR QE 3.100 . 4.500 3.938 3.456 4.569 0.069 17 0 "[ . 1 . 2 ]" 1
1194 1 4 U H1' 2 75 THR MG 3.100 . 4.500 4.264 4.041 4.412 . 0 0 "[ . 1 . 2 ]" 1
1195 1 4 U H1' 2 74 LYS QB 2.600 . 3.500 3.590 3.520 3.656 0.156 10 0 "[ . 1 . 2 ]" 1
1196 1 4 U H1' 2 74 LYS QG 3.100 . 4.500 3.761 3.407 4.157 . 0 0 "[ . 1 . 2 ]" 1
1197 1 4 U H1' 2 11 TYR QB 3.100 . 4.500 4.215 3.390 4.720 0.220 7 0 "[ . 1 . 2 ]" 1
1198 1 4 U H1' 2 11 TYR QD 3.100 . 4.500 3.762 2.930 4.528 0.028 8 0 "[ . 1 . 2 ]" 1
1199 1 4 U H1' 2 75 THR H 2.600 . 3.500 2.763 1.963 3.375 . 0 0 "[ . 1 . 2 ]" 1
1200 1 6 A H2 2 46 LEU QD 3.100 . 4.500 2.729 2.102 3.136 . 0 0 "[ . 1 . 2 ]" 1
1201 1 6 A H2 2 46 LEU QB 3.100 . 4.500 4.587 4.498 4.739 0.239 12 0 "[ . 1 . 2 ]" 1
1202 1 6 A H2 2 46 LEU HG 2.600 . 3.500 2.881 2.426 3.403 . 0 0 "[ . 1 . 2 ]" 1
1203 1 6 A H2 2 44 GLN QB 2.600 . 3.500 3.339 2.483 3.955 0.455 12 0 "[ . 1 . 2 ]" 1
1204 1 6 A H2 2 44 GLN QG 2.600 . 3.500 3.736 3.583 3.849 0.349 6 0 "[ . 1 . 2 ]" 1
1205 1 6 A H1' 2 46 LEU QD 3.100 . 4.500 2.131 1.852 2.574 . 0 0 "[ . 1 . 2 ]" 1
1206 1 6 A H1' 2 46 LEU QB 3.100 . 4.500 3.907 1.966 4.601 0.101 5 0 "[ . 1 . 2 ]" 1
1207 1 6 A H1' 2 46 LEU HG 3.100 . 4.500 4.477 3.840 4.699 0.199 19 0 "[ . 1 . 2 ]" 1
1208 1 7 U H5 2 119 THR MG 2.600 . 3.500 2.203 1.805 3.446 . 0 0 "[ . 1 . 2 ]" 1
1209 1 7 U H5 2 118 ILE MD 3.100 . 4.500 4.495 4.101 4.586 0.086 8 0 "[ . 1 . 2 ]" 1
1210 1 7 U H5 2 118 ILE HB 3.100 . 4.500 3.615 2.734 4.322 . 0 0 "[ . 1 . 2 ]" 1
1211 1 7 U H6 2 119 THR MG 3.100 . 4.500 3.695 2.503 4.516 0.016 5 0 "[ . 1 . 2 ]" 1
1212 1 7 U H6 2 118 ILE HB 3.100 . 4.500 4.529 4.276 4.677 0.177 5 0 "[ . 1 . 2 ]" 1
1213 1 7 U H5' 2 10 ASN QB 2.600 . 3.500 3.384 1.886 3.697 0.197 19 0 "[ . 1 . 2 ]" 1
1214 1 7 U H5'' 2 10 ASN QB 2.600 . 3.500 2.658 2.045 3.572 0.072 7 0 "[ . 1 . 2 ]" 1
1215 1 7 U H5' 2 11 TYR QE 2.600 . 3.500 3.132 1.920 3.577 0.077 8 0 "[ . 1 . 2 ]" 1
1216 1 7 U H5'' 2 11 TYR QE 2.600 . 3.500 2.917 1.877 3.560 0.060 7 0 "[ . 1 . 2 ]" 1
1217 1 7 U H1' 2 48 TYR QD 3.100 . 4.500 4.246 3.428 4.581 0.081 16 0 "[ . 1 . 2 ]" 1
1218 1 7 U H1' 2 48 TYR QB 3.100 . 4.500 4.259 3.618 4.657 0.157 19 0 "[ . 1 . 2 ]" 1
1219 1 7 U H1' 2 10 ASN QB 2.600 . 3.500 2.778 1.975 3.520 0.020 13 0 "[ . 1 . 2 ]" 1
1220 1 7 U H1' 2 8 ILE MD 3.100 . 4.500 2.469 1.876 4.205 . 0 0 "[ . 1 . 2 ]" 1
1221 1 8 U H3 2 82 ARG H 2.100 . 2.500 2.386 1.974 2.558 0.058 4 0 "[ . 1 . 2 ]" 1
1222 1 8 U H3 2 81 ALA MB 2.600 . 3.500 3.326 2.602 3.756 0.256 5 0 "[ . 1 . 2 ]" 1
1223 1 8 U H3 2 82 ARG QB 2.600 . 3.500 3.061 2.173 3.600 0.100 6 0 "[ . 1 . 2 ]" 1
1224 1 8 U H3 2 88 ILE MG 3.100 . 4.500 4.357 3.593 4.626 0.126 5 0 "[ . 1 . 2 ]" 1
1225 1 8 U H5 2 8 ILE MD 3.100 . 4.500 4.125 3.144 4.617 0.117 19 0 "[ . 1 . 2 ]" 1
1226 1 8 U H5 2 8 ILE MG 3.100 . 4.500 4.088 2.408 4.536 0.036 8 0 "[ . 1 . 2 ]" 1
1227 1 8 U H6 2 8 ILE MD 3.100 . 4.500 3.073 1.877 3.720 . 0 0 "[ . 1 . 2 ]" 1
1228 1 8 U H6 2 8 ILE MG 3.100 . 4.500 4.087 2.740 4.537 0.037 19 0 "[ . 1 . 2 ]" 1
1229 1 8 U H1' 2 8 ILE MD 3.100 . 4.500 2.910 2.501 3.506 . 0 0 "[ . 1 . 2 ]" 1
1230 1 8 U H1' 2 8 ILE MG 3.100 . 4.500 4.598 4.501 4.718 0.218 19 0 "[ . 1 . 2 ]" 1
1231 1 8 U H2' 2 88 ILE MD 3.100 . 4.500 2.750 1.798 3.835 0.002 10 0 "[ . 1 . 2 ]" 1
1232 1 8 U H3' 2 88 ILE MD 3.100 . 4.500 3.990 2.078 4.552 0.052 17 0 "[ . 1 . 2 ]" 1
1233 1 8 U H2' 2 89 ARG QB 3.100 . 4.500 4.406 3.400 4.743 0.243 1 0 "[ . 1 . 2 ]" 1
1234 1 8 U H3' 2 89 ARG QB 3.100 . 4.500 3.150 2.241 3.872 . 0 0 "[ . 1 . 2 ]" 1
1235 1 9 U H5 2 50 PHE QE 3.100 . 4.500 3.061 2.492 3.439 . 0 0 "[ . 1 . 2 ]" 1
1236 1 9 U H5 2 50 PHE HZ 3.100 . 4.500 3.480 3.118 4.302 . 0 0 "[ . 1 . 2 ]" 1
1237 1 9 U H6 2 50 PHE HZ 3.100 . 4.500 2.729 2.387 2.947 . 0 0 "[ . 1 . 2 ]" 1
1238 1 9 U H6 2 37 VAL MG2 3.100 . 4.500 2.556 1.969 3.824 . 0 0 "[ . 1 . 2 ]" 1
1239 1 9 U H6 2 37 VAL HB 3.100 . 4.500 4.712 4.337 4.812 0.312 18 0 "[ . 1 . 2 ]" 1
1240 1 9 U H1' 2 50 PHE HZ 2.600 . 3.500 3.579 3.378 3.671 0.171 1 0 "[ . 1 . 2 ]" 1
1241 1 9 U H1' 2 37 VAL QG 2.600 . 3.500 2.281 2.013 2.770 . 0 0 "[ . 1 . 2 ]" 1
1242 1 9 U H1' 2 37 VAL HB 3.100 . 4.500 4.652 4.418 4.862 0.362 3 0 "[ . 1 . 2 ]" 1
1243 1 9 U H1' 2 35 LYS QB 3.100 . 4.500 4.329 3.092 4.703 0.203 8 0 "[ . 1 . 2 ]" 1
1244 1 9 U H1' 2 35 LYS QG 2.600 . 3.500 3.218 2.820 3.569 0.069 14 0 "[ . 1 . 2 ]" 1
1245 1 9 U H4' 2 37 VAL HB 3.100 . 4.500 4.420 3.561 4.691 0.191 9 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 146
_Distance_constraint_stats_list.Viol_count 522
_Distance_constraint_stats_list.Viol_total 574.749
_Distance_constraint_stats_list.Viol_max 0.500
_Distance_constraint_stats_list.Viol_rms 0.0403
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0089
_Distance_constraint_stats_list.Viol_average_violations_only 0.0524
_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 A 1.998 0.115 1 0 "[ . 1 . 2 ]"
1 3 U 0.126 0.051 15 0 "[ . 1 . 2 ]"
1 4 U 0.121 0.094 14 0 "[ . 1 . 2 ]"
1 6 A 10.853 0.500 11 1 "[ . 1+ . 2 ]"
1 8 U 0.608 0.184 5 0 "[ . 1 . 2 ]"
1 9 U 1.889 0.120 5 0 "[ . 1 . 2 ]"
2 6 ASN 1.889 0.120 5 0 "[ . 1 . 2 ]"
2 7 LEU 0.178 0.036 6 0 "[ . 1 . 2 ]"
2 8 ILE 0.077 0.024 4 0 "[ . 1 . 2 ]"
2 9 VAL 0.226 0.038 7 0 "[ . 1 . 2 ]"
2 10 ASN 0.024 0.024 3 0 "[ . 1 . 2 ]"
2 11 TYR 0.489 0.101 2 0 "[ . 1 . 2 ]"
2 12 LEU 0.991 0.118 4 0 "[ . 1 . 2 ]"
2 13 PRO 0.021 0.009 18 0 "[ . 1 . 2 ]"
2 14 GLN 0.991 0.118 4 0 "[ . 1 . 2 ]"
2 16 MET 0.021 0.009 18 0 "[ . 1 . 2 ]"
2 17 THR 0.007 0.007 10 0 "[ . 1 . 2 ]"
2 18 GLN 0.012 0.012 19 0 "[ . 1 . 2 ]"
2 19 ASP 0.227 0.064 6 0 "[ . 1 . 2 ]"
2 20 GLU 0.074 0.037 6 0 "[ . 1 . 2 ]"
2 21 PHE 0.484 0.095 16 0 "[ . 1 . 2 ]"
2 22 LYS 0.146 0.042 16 0 "[ . 1 . 2 ]"
2 23 SER 0.227 0.064 6 0 "[ . 1 . 2 ]"
2 24 LEU 0.074 0.037 6 0 "[ . 1 . 2 ]"
2 25 PHE 0.477 0.095 16 0 "[ . 1 . 2 ]"
2 26 GLY 0.135 0.042 16 0 "[ . 1 . 2 ]"
2 33 SER 0.052 0.017 20 0 "[ . 1 . 2 ]"
2 35 LYS 0.085 0.038 3 0 "[ . 1 . 2 ]"
2 37 VAL 0.133 0.056 19 0 "[ . 1 . 2 ]"
2 44 GLN 10.853 0.500 11 1 "[ . 1+ . 2 ]"
2 47 GLY 0.489 0.101 2 0 "[ . 1 . 2 ]"
2 48 TYR 0.133 0.056 19 0 "[ . 1 . 2 ]"
2 49 GLY 0.226 0.038 7 0 "[ . 1 . 2 ]"
2 50 PHE 0.085 0.038 3 0 "[ . 1 . 2 ]"
2 51 VAL 0.178 0.036 6 0 "[ . 1 . 2 ]"
2 52 ASN 0.052 0.017 20 0 "[ . 1 . 2 ]"
2 55 ASP 0.652 0.100 15 0 "[ . 1 . 2 ]"
2 56 PRO 0.029 0.028 19 0 "[ . 1 . 2 ]"
2 57 ASN 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 58 ASP 0.047 0.046 20 0 "[ . 1 . 2 ]"
2 59 ALA 1.041 0.107 14 0 "[ . 1 . 2 ]"
2 60 ASP 0.029 0.028 19 0 "[ . 1 . 2 ]"
2 61 LYS 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 62 ALA 0.187 0.046 20 0 "[ . 1 . 2 ]"
2 63 ILE 0.389 0.107 14 0 "[ . 1 . 2 ]"
2 66 LEU 0.700 0.127 19 0 "[ . 1 . 2 ]"
2 69 LEU 0.139 0.031 18 0 "[ . 1 . 2 ]"
2 71 LEU 0.085 0.031 5 0 "[ . 1 . 2 ]"
2 74 LYS 0.085 0.031 5 0 "[ . 1 . 2 ]"
2 75 THR 0.121 0.094 14 0 "[ . 1 . 2 ]"
2 76 ILE 0.139 0.031 18 0 "[ . 1 . 2 ]"
2 77 LYS 0.024 0.024 3 0 "[ . 1 . 2 ]"
2 78 VAL 0.559 0.127 19 0 "[ . 1 . 2 ]"
2 79 SER 0.077 0.024 4 0 "[ . 1 . 2 ]"
2 82 ARG 0.608 0.184 5 0 "[ . 1 . 2 ]"
2 92 ASN 0.126 0.051 15 0 "[ . 1 . 2 ]"
2 93 LEU 0.403 0.089 13 0 "[ . 1 . 2 ]"
2 94 TYR 0.095 0.033 15 0 "[ . 1 . 2 ]"
2 95 VAL 0.473 0.060 16 0 "[ . 1 . 2 ]"
2 96 SER 0.053 0.020 17 0 "[ . 1 . 2 ]"
2 103 SER 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 104 GLN 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 105 LYS 0.008 0.008 11 0 "[ . 1 . 2 ]"
2 106 GLU 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 107 MET 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 108 GLU 0.319 0.068 10 0 "[ . 1 . 2 ]"
2 109 GLN 0.658 0.072 1 0 "[ . 1 . 2 ]"
2 110 LEU 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 111 PHE 0.259 0.088 4 0 "[ . 1 . 2 ]"
2 112 SER 0.319 0.068 10 0 "[ . 1 . 2 ]"
2 113 GLN 0.650 0.072 1 0 "[ . 1 . 2 ]"
2 115 GLY 0.259 0.088 4 0 "[ . 1 . 2 ]"
2 118 ILE 0.296 0.052 9 0 "[ . 1 . 2 ]"
2 119 THR 0.009 0.009 18 0 "[ . 1 . 2 ]"
2 121 ARG 0.194 0.038 6 0 "[ . 1 . 2 ]"
2 123 LEU 1.299 0.117 20 0 "[ . 1 . 2 ]"
2 134 VAL 1.299 0.117 20 0 "[ . 1 . 2 ]"
2 135 GLY 0.473 0.060 16 0 "[ . 1 . 2 ]"
2 136 PHE 0.194 0.038 6 0 "[ . 1 . 2 ]"
2 137 ILE 0.403 0.089 13 0 "[ . 1 . 2 ]"
2 138 ARG 0.305 0.052 9 0 "[ . 1 . 2 ]"
2 141 LYS 0.178 0.070 12 0 "[ . 1 . 2 ]"
2 142 ARG 0.116 0.025 15 0 "[ . 1 . 2 ]"
2 143 ILE 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 144 GLU 0.000 0.000 . 0 "[ . 1 . 2 ]"
2 145 ALA 0.475 0.070 12 0 "[ . 1 . 2 ]"
2 146 GLU 0.217 0.065 18 0 "[ . 1 . 2 ]"
2 147 GLU 0.153 0.043 7 0 "[ . 1 . 2 ]"
2 148 ALA 0.687 0.085 20 0 "[ . 1 . 2 ]"
2 149 ILE 0.313 0.048 7 0 "[ . 1 . 2 ]"
2 150 LYS 0.101 0.065 18 0 "[ . 1 . 2 ]"
2 151 GLY 0.153 0.043 7 0 "[ . 1 . 2 ]"
2 152 LEU 0.687 0.085 20 0 "[ . 1 . 2 ]"
2 153 ASN 0.016 0.016 21 0 "[ . 1 . 2 ]"
2 154 GLY 0.921 0.112 6 0 "[ . 1 . 2 ]"
2 164 ILE 0.921 0.112 6 0 "[ . 1 . 2 ]"
2 165 THR 0.053 0.020 17 0 "[ . 1 . 2 ]"
2 167 LYS 0.095 0.033 15 0 "[ . 1 . 2 ]"
2 170 ASN 1.998 0.115 1 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 2 7 LEU N 2 51 VAL O 3.300 2.500 3.500 3.109 2.493 3.373 0.007 7 0 "[ . 1 . 2 ]" 2
2 2 7 LEU H 2 51 VAL O 2.300 . 2.500 2.250 1.519 2.536 0.036 6 0 "[ . 1 . 2 ]" 2
3 2 7 LEU O 2 51 VAL N 3.300 2.500 3.500 2.633 2.498 3.104 0.002 8 0 "[ . 1 . 2 ]" 2
4 2 7 LEU O 2 51 VAL H 2.300 . 2.500 1.704 1.526 2.213 . 0 0 "[ . 1 . 2 ]" 2
5 2 9 VAL N 2 49 GLY O 3.300 2.500 3.500 2.506 2.462 2.593 0.038 7 0 "[ . 1 . 2 ]" 2
6 2 9 VAL H 2 49 GLY O 2.300 . 2.500 1.566 1.488 1.664 0.012 9 0 "[ . 1 . 2 ]" 2
7 2 8 ILE N 2 79 SER O 3.300 2.500 3.500 2.639 2.486 2.956 0.014 12 0 "[ . 1 . 2 ]" 2
8 2 8 ILE H 2 79 SER O 2.300 . 2.500 1.728 1.522 2.191 . 0 0 "[ . 1 . 2 ]" 2
9 2 8 ILE O 2 79 SER N 3.300 2.500 3.500 2.626 2.476 2.901 0.024 4 0 "[ . 1 . 2 ]" 2
10 2 8 ILE O 2 79 SER H 2.300 . 2.500 1.703 1.497 2.170 0.003 4 0 "[ . 1 . 2 ]" 2
11 2 10 ASN N 2 77 LYS O 3.300 2.500 3.500 2.974 2.517 3.478 . 0 0 "[ . 1 . 2 ]" 2
12 2 10 ASN H 2 77 LYS O 2.300 . 2.500 2.093 1.559 2.524 0.024 3 0 "[ . 1 . 2 ]" 2
13 2 37 VAL N 2 48 TYR O 3.300 2.500 3.500 3.127 2.554 3.497 . 0 0 "[ . 1 . 2 ]" 2
14 2 37 VAL H 2 48 TYR O 2.300 . 2.500 2.180 1.577 2.556 0.056 19 0 "[ . 1 . 2 ]" 2
15 2 35 LYS O 2 50 PHE N 3.300 2.500 3.500 2.557 2.462 2.686 0.038 3 0 "[ . 1 . 2 ]" 2
16 2 35 LYS O 2 50 PHE H 2.300 . 2.500 1.663 1.485 1.952 0.015 3 0 "[ . 1 . 2 ]" 2
17 2 35 LYS N 2 50 PHE O 3.300 2.500 3.500 2.741 2.538 2.896 . 0 0 "[ . 1 . 2 ]" 2
18 2 35 LYS H 2 50 PHE O 2.300 . 2.500 1.862 1.612 2.084 . 0 0 "[ . 1 . 2 ]" 2
19 2 33 SER O 2 52 ASN N 3.300 2.500 3.500 2.613 2.483 2.983 0.017 20 0 "[ . 1 . 2 ]" 2
20 2 33 SER O 2 52 ASN H 2.300 . 2.500 1.663 1.510 2.007 . 0 0 "[ . 1 . 2 ]" 2
21 2 11 TYR N 2 47 GLY O 3.300 2.500 3.500 2.874 2.487 3.295 0.013 5 0 "[ . 1 . 2 ]" 2
22 2 11 TYR H 2 47 GLY O 2.300 . 2.500 2.278 1.660 2.601 0.101 2 0 "[ . 1 . 2 ]" 2
23 2 69 LEU N 2 76 ILE O 3.300 2.500 3.500 2.608 2.469 2.924 0.031 18 0 "[ . 1 . 2 ]" 2
24 2 69 LEU H 2 76 ILE O 2.300 . 2.500 1.700 1.519 2.062 . 0 0 "[ . 1 . 2 ]" 2
25 2 17 THR O 2 21 PHE N 3.300 2.500 3.500 3.051 2.727 3.435 . 0 0 "[ . 1 . 2 ]" 2
26 2 17 THR O 2 21 PHE H 2.300 . 2.500 2.104 1.757 2.507 0.007 10 0 "[ . 1 . 2 ]" 2
27 2 18 GLN O 2 22 LYS N 3.300 2.500 3.500 2.868 2.552 3.386 . 0 0 "[ . 1 . 2 ]" 2
28 2 18 GLN O 2 22 LYS H 2.300 . 2.500 1.939 1.566 2.512 0.012 19 0 "[ . 1 . 2 ]" 2
29 2 19 ASP O 2 23 SER N 3.300 2.500 3.500 3.171 2.541 3.494 . 0 0 "[ . 1 . 2 ]" 2
30 2 19 ASP O 2 23 SER H 2.300 . 2.500 2.231 1.565 2.564 0.064 6 0 "[ . 1 . 2 ]" 2
31 2 20 GLU O 2 24 LEU N 3.300 2.500 3.500 3.098 2.482 3.462 0.018 1 0 "[ . 1 . 2 ]" 2
32 2 20 GLU O 2 24 LEU H 2.300 . 2.500 2.157 1.498 2.537 0.037 6 0 "[ . 1 . 2 ]" 2
33 2 21 PHE O 2 25 PHE N 3.300 2.500 3.500 3.339 2.944 3.520 0.020 16 0 "[ . 1 . 2 ]" 2
34 2 21 PHE O 2 25 PHE H 2.300 . 2.500 2.380 1.969 2.595 0.095 16 0 "[ . 1 . 2 ]" 2
35 2 22 LYS O 2 26 GLY N 3.300 2.500 3.500 2.617 2.458 2.920 0.042 16 0 "[ . 1 . 2 ]" 2
36 2 22 LYS O 2 26 GLY H 2.300 . 2.500 1.869 1.544 2.538 0.038 20 0 "[ . 1 . 2 ]" 2
37 2 12 LEU O 2 14 GLN N 3.300 2.500 3.500 2.857 2.631 2.992 . 0 0 "[ . 1 . 2 ]" 2
38 2 12 LEU O 2 14 GLN H 2.300 . 2.500 2.533 2.383 2.618 0.118 4 0 "[ . 1 . 2 ]" 2
39 2 13 PRO O 2 16 MET N 3.300 2.500 3.500 2.594 2.491 3.102 0.009 18 0 "[ . 1 . 2 ]" 2
40 2 13 PRO O 2 16 MET H 2.300 . 2.500 1.693 1.532 2.506 0.006 4 0 "[ . 1 . 2 ]" 2
41 2 56 PRO O 2 60 ASP N 3.300 2.500 3.500 2.737 2.472 3.281 0.028 19 0 "[ . 1 . 2 ]" 2
42 2 56 PRO O 2 60 ASP H 2.300 . 2.500 1.785 1.499 2.343 0.001 19 0 "[ . 1 . 2 ]" 2
43 2 55 ASP O 2 59 ALA N 3.300 2.500 3.500 3.314 2.961 3.463 . 0 0 "[ . 1 . 2 ]" 2
44 2 55 ASP O 2 59 ALA H 2.300 . 2.500 2.503 2.242 2.600 0.100 15 0 "[ . 1 . 2 ]" 2
45 2 57 ASN O 2 61 LYS N 3.300 2.500 3.500 2.701 2.505 3.096 . 0 0 "[ . 1 . 2 ]" 2
46 2 57 ASN O 2 61 LYS H 2.300 . 2.500 1.758 1.560 2.192 . 0 0 "[ . 1 . 2 ]" 2
47 2 58 ASP O 2 62 ALA N 3.300 2.500 3.500 3.002 2.593 3.444 . 0 0 "[ . 1 . 2 ]" 2
48 2 58 ASP O 2 62 ALA H 2.300 . 2.500 2.119 1.659 2.546 0.046 20 0 "[ . 1 . 2 ]" 2
49 2 59 ALA O 2 63 ILE N 3.300 2.500 3.500 3.264 2.621 3.520 0.020 5 0 "[ . 1 . 2 ]" 2
50 2 59 ALA O 2 63 ILE H 2.300 . 2.500 2.327 1.659 2.607 0.107 14 0 "[ . 1 . 2 ]" 2
51 2 62 ALA O 2 66 LEU N 3.300 2.500 3.500 2.850 2.470 3.450 0.030 2 0 "[ . 1 . 2 ]" 2
52 2 62 ALA O 2 66 LEU H 2.300 . 2.500 1.910 1.500 2.533 0.033 3 0 "[ . 1 . 2 ]" 2
53 2 69 LEU O 2 76 ILE N 3.300 2.500 3.500 2.612 2.469 2.908 0.031 9 0 "[ . 1 . 2 ]" 2
54 2 69 LEU O 2 76 ILE H 2.300 . 2.500 1.863 1.510 2.513 0.013 7 0 "[ . 1 . 2 ]" 2
55 2 66 LEU O 2 78 VAL N 3.300 2.500 3.500 3.288 2.821 3.508 0.008 3 0 "[ . 1 . 2 ]" 2
56 2 66 LEU O 2 78 VAL H 2.300 . 2.500 2.437 1.898 2.627 0.127 19 0 "[ . 1 . 2 ]" 2
57 2 71 LEU N 2 74 LYS O 3.300 2.500 3.500 2.550 2.469 2.760 0.031 5 0 "[ . 1 . 2 ]" 2
58 2 71 LEU H 2 74 LYS O 2.300 . 2.500 1.651 1.540 1.905 . 0 0 "[ . 1 . 2 ]" 2
59 2 93 LEU N 2 137 ILE O 3.300 2.500 3.500 2.922 2.456 3.259 0.044 9 0 "[ . 1 . 2 ]" 2
60 2 93 LEU H 2 137 ILE O 2.300 . 2.500 2.215 1.489 2.589 0.089 13 0 "[ . 1 . 2 ]" 2
61 2 93 LEU O 2 137 ILE N 3.300 2.500 3.500 3.111 2.804 3.353 . 0 0 "[ . 1 . 2 ]" 2
62 2 93 LEU O 2 137 ILE H 2.300 . 2.500 2.237 1.931 2.517 0.017 4 0 "[ . 1 . 2 ]" 2
63 2 95 VAL N 2 135 GLY O 3.300 2.500 3.500 2.488 2.440 2.598 0.060 16 0 "[ . 1 . 2 ]" 2
64 2 95 VAL H 2 135 GLY O 2.300 . 2.500 1.566 1.483 1.782 0.017 16 0 "[ . 1 . 2 ]" 2
65 2 95 VAL O 2 135 GLY N 3.300 2.500 3.500 2.588 2.483 2.785 0.017 1 0 "[ . 1 . 2 ]" 2
66 2 95 VAL O 2 135 GLY H 2.300 . 2.500 1.621 1.513 1.833 . 0 0 "[ . 1 . 2 ]" 2
67 2 94 TYR N 2 167 LYS O 3.300 2.500 3.500 2.728 2.467 3.449 0.033 15 0 "[ . 1 . 2 ]" 2
68 2 94 TYR H 2 167 LYS O 2.300 . 2.500 1.808 1.489 2.524 0.024 11 0 "[ . 1 . 2 ]" 2
69 2 94 TYR O 2 167 LYS N 3.300 2.500 3.500 2.717 2.498 3.351 0.002 1 0 "[ . 1 . 2 ]" 2
70 2 94 TYR O 2 167 LYS H 2.300 . 2.500 1.754 1.527 2.389 . 0 0 "[ . 1 . 2 ]" 2
71 2 96 SER N 2 165 THR O 3.300 2.500 3.500 2.644 2.480 3.170 0.020 17 0 "[ . 1 . 2 ]" 2
72 2 96 SER H 2 165 THR O 2.300 . 2.500 1.709 1.508 2.299 . 0 0 "[ . 1 . 2 ]" 2
73 2 96 SER O 2 165 THR N 3.300 2.500 3.500 2.898 2.580 3.416 . 0 0 "[ . 1 . 2 ]" 2
74 2 96 SER O 2 165 THR H 2.300 . 2.500 1.972 1.645 2.498 . 0 0 "[ . 1 . 2 ]" 2
75 2 118 ILE N 2 138 ARG O 3.300 2.500 3.500 2.513 2.448 2.695 0.052 9 0 "[ . 1 . 2 ]" 2
76 2 118 ILE H 2 138 ARG O 2.300 . 2.500 1.595 1.487 1.813 0.013 9 0 "[ . 1 . 2 ]" 2
77 2 119 THR O 2 138 ARG N 3.300 2.500 3.500 2.713 2.491 3.087 0.009 18 0 "[ . 1 . 2 ]" 2
78 2 119 THR O 2 138 ARG H 2.300 . 2.500 1.801 1.531 2.325 . 0 0 "[ . 1 . 2 ]" 2
79 2 121 ARG N 2 136 PHE O 3.300 2.500 3.500 2.830 2.718 3.027 . 0 0 "[ . 1 . 2 ]" 2
80 2 121 ARG H 2 136 PHE O 2.300 . 2.500 1.882 1.768 2.046 . 0 0 "[ . 1 . 2 ]" 2
81 2 121 ARG O 2 136 PHE N 3.300 2.500 3.500 2.513 2.462 2.655 0.038 6 0 "[ . 1 . 2 ]" 2
82 2 121 ARG O 2 136 PHE H 2.300 . 2.500 1.560 1.505 1.735 . 0 0 "[ . 1 . 2 ]" 2
83 2 123 LEU N 2 134 VAL O 3.300 2.500 3.500 2.660 2.513 2.905 . 0 0 "[ . 1 . 2 ]" 2
84 2 123 LEU H 2 134 VAL O 2.300 . 2.500 1.764 1.576 2.089 . 0 0 "[ . 1 . 2 ]" 2
85 2 123 LEU O 2 134 VAL N 3.300 2.500 3.500 3.467 3.222 3.561 0.061 20 0 "[ . 1 . 2 ]" 2
86 2 123 LEU O 2 134 VAL H 2.300 . 2.500 2.544 2.338 2.617 0.117 20 0 "[ . 1 . 2 ]" 2
87 2 103 SER O 2 107 MET N 3.300 2.500 3.500 3.028 2.690 3.349 . 0 0 "[ . 1 . 2 ]" 2
88 2 103 SER O 2 107 MET H 2.300 . 2.500 2.085 1.726 2.433 . 0 0 "[ . 1 . 2 ]" 2
89 2 104 GLN O 2 108 GLU N 3.300 2.500 3.500 2.831 2.530 3.216 . 0 0 "[ . 1 . 2 ]" 2
90 2 104 GLN O 2 108 GLU H 2.300 . 2.500 1.948 1.589 2.391 . 0 0 "[ . 1 . 2 ]" 2
91 2 105 LYS O 2 109 GLN N 3.300 2.500 3.500 2.767 2.492 3.333 0.008 11 0 "[ . 1 . 2 ]" 2
92 2 105 LYS O 2 109 GLN H 2.300 . 2.500 1.795 1.502 2.417 . 0 0 "[ . 1 . 2 ]" 2
93 2 106 GLU O 2 110 LEU N 3.300 2.500 3.500 2.815 2.578 3.239 . 0 0 "[ . 1 . 2 ]" 2
94 2 106 GLU O 2 110 LEU H 2.300 . 2.500 1.986 1.690 2.465 . 0 0 "[ . 1 . 2 ]" 2
95 2 107 MET O 2 111 PHE N 3.300 2.500 3.500 2.957 2.706 3.220 . 0 0 "[ . 1 . 2 ]" 2
96 2 107 MET O 2 111 PHE H 2.300 . 2.500 1.990 1.725 2.260 . 0 0 "[ . 1 . 2 ]" 2
97 2 108 GLU O 2 112 SER N 3.300 2.500 3.500 2.521 2.432 2.684 0.068 10 0 "[ . 1 . 2 ]" 2
98 2 108 GLU O 2 112 SER H 2.300 . 2.500 1.638 1.493 1.812 0.007 10 0 "[ . 1 . 2 ]" 2
99 2 109 GLN O 2 113 GLN N 3.300 2.500 3.500 3.471 3.383 3.533 0.033 17 0 "[ . 1 . 2 ]" 2
100 2 109 GLN O 2 113 GLN H 2.300 . 2.500 2.528 2.484 2.572 0.072 1 0 "[ . 1 . 2 ]" 2
101 2 111 PHE O 2 115 GLY N 3.300 2.500 3.500 2.908 2.589 3.312 . 0 0 "[ . 1 . 2 ]" 2
102 2 111 PHE O 2 115 GLY H 2.300 . 2.500 2.058 1.629 2.588 0.088 4 0 "[ . 1 . 2 ]" 2
103 2 141 LYS O 2 145 ALA N 3.300 2.500 3.500 3.277 2.986 3.500 0.000 12 0 "[ . 1 . 2 ]" 2
104 2 141 LYS O 2 145 ALA H 2.300 . 2.500 2.341 2.023 2.570 0.070 12 0 "[ . 1 . 2 ]" 2
105 2 142 ARG O 2 146 GLU N 3.300 2.500 3.500 2.556 2.475 2.774 0.025 15 0 "[ . 1 . 2 ]" 2
106 2 142 ARG O 2 146 GLU H 2.300 . 2.500 1.595 1.489 1.843 0.011 16 0 "[ . 1 . 2 ]" 2
107 2 143 ILE O 2 147 GLU N 3.300 2.500 3.500 2.720 2.611 2.942 . 0 0 "[ . 1 . 2 ]" 2
108 2 143 ILE O 2 147 GLU H 2.300 . 2.500 1.741 1.625 1.969 . 0 0 "[ . 1 . 2 ]" 2
109 2 144 GLU O 2 148 ALA N 3.300 2.500 3.500 2.760 2.609 3.334 . 0 0 "[ . 1 . 2 ]" 2
110 2 144 GLU O 2 148 ALA H 2.300 . 2.500 1.828 1.659 2.425 . 0 0 "[ . 1 . 2 ]" 2
111 2 145 ALA O 2 149 ILE N 3.300 2.500 3.500 2.514 2.452 2.641 0.048 7 0 "[ . 1 . 2 ]" 2
112 2 145 ALA O 2 149 ILE H 2.300 . 2.500 1.547 1.483 1.673 0.017 7 0 "[ . 1 . 2 ]" 2
113 2 146 GLU O 2 150 LYS N 3.300 2.500 3.500 3.117 2.630 3.470 . 0 0 "[ . 1 . 2 ]" 2
114 2 146 GLU O 2 150 LYS H 2.300 . 2.500 2.159 1.663 2.565 0.065 18 0 "[ . 1 . 2 ]" 2
115 2 147 GLU O 2 151 GLY N 3.300 2.500 3.500 3.162 2.829 3.483 . 0 0 "[ . 1 . 2 ]" 2
116 2 147 GLU O 2 151 GLY H 2.300 . 2.500 2.279 1.890 2.543 0.043 7 0 "[ . 1 . 2 ]" 2
117 2 148 ALA O 2 152 LEU N 3.300 2.500 3.500 2.777 2.558 2.927 . 0 0 "[ . 1 . 2 ]" 2
118 2 148 ALA O 2 152 LEU H 2.300 . 2.500 2.382 1.630 2.585 0.085 20 0 "[ . 1 . 2 ]" 2
119 2 149 ILE O 2 153 ASN N 3.300 2.500 3.500 2.649 2.484 2.755 0.016 21 0 "[ . 1 . 2 ]" 2
120 2 149 ILE O 2 153 ASN H 2.300 . 2.500 1.694 1.521 1.830 . 0 0 "[ . 1 . 2 ]" 2
121 2 154 GLY N 2 164 ILE O 3.300 2.500 3.500 3.172 2.678 3.536 0.036 4 0 "[ . 1 . 2 ]" 2
122 2 154 GLY H 2 164 ILE O 2.300 . 2.500 2.466 2.079 2.612 0.112 6 0 "[ . 1 . 2 ]" 2
123 1 2 A H61 2 170 ASN OD1 1.800 . 2.500 2.382 1.802 2.568 0.068 8 0 "[ . 1 . 2 ]" 2
124 1 2 A N6 2 170 ASN OD1 2.800 2.400 3.500 3.310 2.747 3.531 0.031 8 0 "[ . 1 . 2 ]" 2
125 1 2 A N1 2 170 ASN H 1.800 . 2.500 2.550 2.343 2.615 0.115 1 0 "[ . 1 . 2 ]" 2
126 1 2 A N1 2 170 ASN N 2.800 2.400 3.500 3.411 3.127 3.546 0.046 13 0 "[ . 1 . 2 ]" 2
127 1 3 U H3 2 92 ASN OD1 1.800 . 2.500 2.289 2.069 2.551 0.051 15 0 "[ . 1 . 2 ]" 2
128 1 3 U N3 2 92 ASN OD1 2.800 2.400 3.500 3.270 3.032 3.523 0.023 15 0 "[ . 1 . 2 ]" 2
129 1 3 U O4 2 92 ASN HD22 1.800 . 2.500 2.071 1.583 2.498 . 0 0 "[ . 1 . 2 ]" 2
130 1 3 U O4 2 92 ASN ND2 2.800 2.400 3.500 3.018 2.532 3.411 . 0 0 "[ . 1 . 2 ]" 2
131 1 4 U H3 2 75 THR O 1.800 . 2.500 2.270 2.070 2.527 0.027 8 0 "[ . 1 . 2 ]" 2
132 1 4 U N3 2 75 THR O 2.800 2.400 3.500 2.906 2.631 3.177 . 0 0 "[ . 1 . 2 ]" 2
133 1 4 U O2 2 75 THR H 1.800 . 2.500 2.151 1.832 2.594 0.094 14 0 "[ . 1 . 2 ]" 2
134 1 4 U O2 2 75 THR N 2.800 2.400 3.500 2.853 2.588 3.163 . 0 0 "[ . 1 . 2 ]" 2
135 1 6 A H61 2 44 GLN OE1 1.800 . 2.500 2.764 2.518 2.984 0.484 2 0 "[ . 1 . 2 ]" 2
136 1 6 A N6 2 44 GLN OE1 2.800 2.400 3.500 3.438 3.245 3.582 0.082 10 0 "[ . 1 . 2 ]" 2
137 1 6 A N1 2 44 GLN HE22 1.800 . 2.500 2.649 2.126 3.000 0.500 11 1 "[ . 1+ . 2 ]" 2
138 1 6 A N1 2 44 GLN NE2 2.800 2.400 3.500 3.015 2.660 3.343 . 0 0 "[ . 1 . 2 ]" 2
139 1 8 U H3 2 82 ARG O 1.800 . 2.500 2.312 2.126 2.684 0.184 5 0 "[ . 1 . 2 ]" 2
140 1 8 U N3 2 82 ARG O 2.800 2.400 3.500 3.202 2.977 3.603 0.103 5 0 "[ . 1 . 2 ]" 2
141 1 8 U O4 2 82 ARG H 1.800 . 2.500 2.088 1.545 2.628 0.128 8 0 "[ . 1 . 2 ]" 2
142 1 8 U O4 2 82 ARG N 2.800 2.400 3.500 2.902 2.515 3.503 0.003 11 0 "[ . 1 . 2 ]" 2
143 1 9 U H3 2 6 ASN OD1 1.800 . 2.500 2.559 2.305 2.620 0.120 5 0 "[ . 1 . 2 ]" 2
144 1 9 U N3 2 6 ASN OD1 2.800 2.400 3.500 3.498 3.198 3.570 0.070 10 0 "[ . 1 . 2 ]" 2
145 1 9 U O4 2 6 ASN HD22 1.800 . 2.500 1.655 1.509 2.052 . 0 0 "[ . 1 . 2 ]" 2
146 1 9 U O4 2 6 ASN ND2 2.800 2.400 3.500 2.629 2.477 3.030 . 0 0 "[ . 1 . 2 ]" 2
stop_
save_
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