NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
648152 | 6yts | 27989 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6yts 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 2772 _Distance_constraint_stats_list.Viol_count 12922 _Distance_constraint_stats_list.Viol_total 52047.945 _Distance_constraint_stats_list.Viol_max 1.627 _Distance_constraint_stats_list.Viol_rms 0.1100 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0469 _Distance_constraint_stats_list.Viol_average_violations_only 0.2014 _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 VAL 44.589 0.720 2 5 "[-+ . * 1* . *]" 1 3 SER 26.583 1.001 11 4 "[ * * * 1+ . 2]" 1 4 PHE 27.595 0.502 2 1 "[ + . 1 . 2]" 1 5 ARG 25.558 0.423 8 0 "[ . 1 . 2]" 1 6 LEU 28.989 0.396 19 0 "[ . 1 . 2]" 1 7 SER 16.642 0.396 2 0 "[ . 1 . 2]" 1 8 GLY 5.446 0.149 7 0 "[ . 1 . 2]" 1 9 ALA 26.146 0.615 18 1 "[ . 1 . + 2]" 1 10 THR 26.454 0.615 18 1 "[ . 1 . + 2]" 1 11 SER 12.791 0.338 11 0 "[ . 1 . 2]" 1 12 SER 3.967 0.214 9 0 "[ . 1 . 2]" 1 13 SER 19.796 0.479 4 0 "[ . 1 . 2]" 1 14 TYR 31.652 0.479 4 0 "[ . 1 . 2]" 1 15 GLY 23.083 0.429 11 0 "[ . 1 . 2]" 1 16 VAL 29.406 0.404 11 0 "[ . 1 . 2]" 1 17 PHE 21.069 0.423 4 0 "[ . 1 . 2]" 1 18 ILE 101.145 1.542 2 20 [*+***************-**] 1 19 SER 27.327 0.463 12 0 "[ . 1 . 2]" 1 20 ASN 43.855 1.542 2 20 [*+***************-**] 1 21 LEU 43.196 0.447 11 0 "[ . 1 . 2]" 1 22 ARG 10.192 0.301 1 0 "[ . 1 . 2]" 1 23 LYS 29.010 0.466 9 0 "[ . 1 . 2]" 1 24 ALA 19.076 0.850 2 4 "[ + * * 1- . 2]" 1 25 LEU 12.689 0.381 4 0 "[ . 1 . 2]" 1 26 PRO 2.665 0.207 8 0 "[ . 1 . 2]" 1 27 TYR 10.610 0.483 13 0 "[ . 1 . 2]" 1 28 GLU 12.942 0.437 10 0 "[ . 1 . 2]" 1 29 ARG 26.979 0.483 13 0 "[ . 1 . 2]" 1 30 LYS 45.274 0.784 12 6 "[ * * 1 + * * -]" 1 31 LEU 32.741 1.627 17 1 "[ . 1 . + 2]" 1 32 TYR 37.960 1.627 17 1 "[ . 1 . + 2]" 1 33 ASP 20.992 0.407 9 0 "[ . 1 . 2]" 1 34 ILE 22.173 0.437 5 0 "[ . 1 . 2]" 1 35 PRO 4.141 0.343 12 0 "[ . 1 . 2]" 1 36 LEU 25.479 0.784 12 9 "[ * * ** + *-* *]" 1 37 LEU 2.728 0.386 12 0 "[ . 1 . 2]" 1 38 ARG 7.228 0.601 11 4 "[ * . 1+ -* 2]" 1 39 SER 16.419 0.387 18 0 "[ . 1 . 2]" 1 40 THR 8.820 0.631 6 1 "[ .+ 1 . 2]" 1 41 LEU 24.646 0.739 6 6 "[ *-+* 1 ** 2]" 1 42 PRO 8.340 0.340 4 0 "[ . 1 . 2]" 1 43 GLY 9.282 0.739 6 5 "[ *-+* 1 .* 2]" 1 44 SER 12.274 1.190 5 1 "[ + 1 . 2]" 1 45 GLN 20.710 0.412 5 0 "[ . 1 . 2]" 1 46 ARG 5.377 0.646 15 3 "[ . 1 +- *]" 1 47 TYR 32.876 0.462 16 0 "[ . 1 . 2]" 1 48 ALA 12.896 0.629 5 1 "[ + 1 . 2]" 1 49 LEU 14.936 0.462 16 0 "[ . 1 . 2]" 1 50 ILE 58.085 1.363 5 10 "[** -+ **1* * * *]" 1 51 HIS 15.589 0.282 15 0 "[ . 1 . 2]" 1 52 LEU 25.079 1.001 11 1 "[ . 1+ . 2]" 1 53 THR 26.203 0.363 17 0 "[ . 1 . 2]" 1 54 ASN 10.899 0.441 4 0 "[ . 1 . 2]" 1 55 TYR 36.950 0.454 18 0 "[ . 1 . 2]" 1 56 ALA 28.719 0.313 12 0 "[ . 1 . 2]" 1 57 ASP 41.054 0.603 14 2 "[ . - 1 +. 2]" 1 58 GLU 28.217 0.603 14 2 "[ . - 1 +. 2]" 1 59 THR 0.852 0.080 12 0 "[ . 1 . 2]" 1 60 ILE 43.856 0.455 1 0 "[ . 1 . 2]" 1 61 SER 21.105 0.392 9 0 "[ . 1 . 2]" 1 62 VAL 30.085 0.639 2 9 "[*+ -. *1* * * **]" 1 63 ALA 18.901 0.547 19 1 "[ . 1 . +2]" 1 64 ILE 37.282 1.363 5 2 "[ + * 1 . 2]" 1 65 ASP 15.938 0.348 15 0 "[ . 1 . 2]" 1 66 VAL 29.344 0.421 6 0 "[ . 1 . 2]" 1 67 THR 8.576 0.421 6 0 "[ . 1 . 2]" 1 68 ASN 4.193 0.425 2 0 "[ . 1 . 2]" 1 69 VAL 11.298 0.607 13 1 "[ . 1 + . 2]" 1 70 TYR 16.976 0.479 4 0 "[ . 1 . 2]" 1 71 VAL 26.355 0.447 5 0 "[ . 1 . 2]" 1 72 MET 8.696 0.447 5 0 "[ . 1 . 2]" 1 73 GLY 15.812 0.373 12 0 "[ . 1 . 2]" 1 74 TYR 15.116 0.373 12 0 "[ . 1 . 2]" 1 75 ARG 47.272 0.690 3 7 "[ *+ .- 1 * .** *2]" 1 76 ALA 24.113 0.389 16 0 "[ . 1 . 2]" 1 77 GLY 10.948 0.320 5 0 "[ . 1 . 2]" 1 78 ASP 14.180 0.690 3 4 "[ + .- 1 .* *2]" 1 79 THR 39.273 0.606 10 3 "[ . + .* -2]" 1 80 SER 15.628 0.501 8 1 "[ . + 1 . 2]" 1 81 TYR 22.998 0.688 17 3 "[ * . 1 - . + 2]" 1 82 PHE 10.923 0.391 12 0 "[ . 1 . 2]" 1 83 PHE 14.153 0.464 13 0 "[ . 1 . 2]" 1 84 ASN 15.163 0.686 16 1 "[ . 1 .+ 2]" 1 85 GLU 11.677 1.491 17 3 "[- . 1 * . + 2]" 1 87 SER 5.337 0.367 17 0 "[ . 1 . 2]" 1 88 ALA 11.128 0.391 12 0 "[ . 1 . 2]" 1 89 THR 38.210 0.464 13 0 "[ . 1 . 2]" 1 90 GLU 12.780 0.458 9 0 "[ . 1 . 2]" 1 91 ALA 2.993 0.189 20 0 "[ . 1 . 2]" 1 92 ALA 30.393 0.649 19 5 "[ ** . 1 .*- +2]" 1 93 LYS 7.348 0.355 12 0 "[ . 1 . 2]" 1 94 TYR 21.633 1.190 5 4 "[ + * 1 *. - 2]" 1 95 VAL 19.429 0.298 5 0 "[ . 1 . 2]" 1 96 PHE 13.994 0.355 15 0 "[ . 1 . 2]" 1 97 LYS 53.841 0.758 14 5 "[ -. * 1 +.* * 2]" 1 98 ASP 9.280 0.248 20 0 "[ . 1 . 2]" 1 99 ALA 28.325 0.394 1 0 "[ . 1 . 2]" 1 100 LYS 31.058 1.013 9 6 "[ **. *+1 -*. 2]" 1 101 ARG 45.291 0.606 10 6 "[ . *- + *.* *2]" 1 102 LYS 22.749 0.649 19 5 "[ ** . 1 .*- +2]" 1 103 VAL 20.449 0.491 12 0 "[ . 1 . 2]" 1 104 THR 28.902 0.470 19 0 "[ . 1 . 2]" 1 105 LEU 7.000 0.296 1 0 "[ . 1 . 2]" 1 106 PRO 4.660 0.211 9 0 "[ . 1 . 2]" 1 107 TYR 59.573 1.491 17 2 "[ . 1 - . + 2]" 1 108 SER 32.958 0.880 14 3 "[ . 1 * +. -2]" 1 109 GLY 8.108 0.686 16 2 "[- . 1 .+ 2]" 1 110 ASN 27.076 0.393 16 0 "[ . 1 . 2]" 1 111 TYR 0.149 0.070 5 0 "[ . 1 . 2]" 1 112 GLU 25.086 0.460 8 0 "[ . 1 . 2]" 1 113 ARG 12.221 0.325 16 0 "[ . 1 . 2]" 1 114 LEU 30.965 0.880 14 3 "[ . 1 * +. -2]" 1 115 GLN 15.596 0.611 15 2 "[ - 1 + 2]" 1 116 ILE 27.877 0.465 13 0 "[ . 1 . 2]" 1 117 ALA 8.720 0.306 17 0 "[ . 1 . 2]" 1 118 ALA 19.166 0.465 13 0 "[ . 1 . 2]" 1 119 GLY 22.129 0.611 15 2 "[ - 1 + 2]" 1 120 LYS 49.278 0.567 16 6 "[- * . **1 * .+ 2]" 1 121 ILE 44.627 0.863 10 11 "[- * .* **+ ***.* * 2]" 1 122 ARG 5.675 0.329 18 0 "[ . 1 . 2]" 1 123 GLU 13.398 0.863 10 5 "[ .* + **. - 2]" 1 124 ASN 6.296 0.265 19 0 "[ . 1 . 2]" 1 125 ILE 19.286 0.511 3 1 "[ + . 1 . 2]" 1 126 PRO 5.247 0.305 18 0 "[ . 1 . 2]" 1 127 LEU 6.408 0.328 14 0 "[ . 1 . 2]" 1 128 GLY 2.486 0.262 4 0 "[ . 1 . 2]" 1 129 LEU 10.132 0.812 7 7 "[* **.*+ 1 - . * 2]" 1 130 PRO 9.954 0.580 15 8 "[* * . *-* + **]" 1 131 ALA 4.436 0.206 7 0 "[ . 1 . 2]" 1 132 LEU 27.722 0.580 15 8 "[* * . *-* + **]" 1 133 ASP 12.038 0.287 5 0 "[ . 1 . 2]" 1 134 SER 35.365 0.464 5 0 "[ . 1 . 2]" 1 135 ALA 13.442 0.464 5 0 "[ . 1 . 2]" 1 136 ILE 40.593 0.415 20 0 "[ . 1 . 2]" 1 137 THR 17.497 0.410 4 0 "[ . 1 . 2]" 1 138 THR 14.237 0.342 2 0 "[ . 1 . 2]" 1 139 LEU 47.602 0.595 9 5 "[ * * +1 .- *]" 1 140 PHE 36.236 0.455 1 0 "[ . 1 . 2]" 1 141 TYR 25.045 0.445 1 0 "[ . 1 . 2]" 1 142 TYR 55.355 0.595 9 9 "[-* * *+1 *** *]" 1 143 ASN 37.116 0.510 17 6 "[- * **1 * + 2]" 1 144 ALA 12.970 0.378 6 0 "[ . 1 . 2]" 1 145 ASN 2.553 0.211 19 0 "[ . 1 . 2]" 1 146 SER 13.820 0.438 18 0 "[ . 1 . 2]" 1 147 ALA 11.965 0.438 18 0 "[ . 1 . 2]" 1 148 ALA 13.138 0.355 12 0 "[ . 1 . 2]" 1 149 SER 1.531 0.338 11 0 "[ . 1 . 2]" 1 150 ALA 9.270 0.405 9 0 "[ . 1 . 2]" 1 151 LEU 8.974 0.574 10 1 "[ . + . 2]" 1 152 MET 2.799 0.574 10 1 "[ . + . 2]" 1 153 VAL 9.942 0.271 2 0 "[ . 1 . 2]" 1 154 LEU 9.027 0.630 12 6 "[ - . * ** + *. 2]" 1 155 ILE 18.658 0.326 4 0 "[ . 1 . 2]" 1 156 GLN 3.659 0.225 7 0 "[ . 1 . 2]" 1 157 SER 12.598 0.291 12 0 "[ . 1 . 2]" 1 158 THR 28.978 0.441 5 0 "[ . 1 . 2]" 1 159 SER 7.088 0.317 5 0 "[ . 1 . 2]" 1 160 GLU 5.759 0.326 4 0 "[ . 1 . 2]" 1 161 ALA 26.651 0.587 6 2 "[- .+ 1 . 2]" 1 162 ALA 10.635 0.818 6 2 "[- .+ 1 . 2]" 1 163 ARG 14.523 0.607 13 1 "[ . 1 + . 2]" 1 164 TYR 18.983 0.587 6 2 "[- .+ 1 . 2]" 1 165 LYS 5.652 0.400 3 0 "[ . 1 . 2]" 1 166 PHE 2.460 0.187 15 0 "[ . 1 . 2]" 1 167 ILE 17.301 0.323 4 0 "[ . 1 . 2]" 1 168 GLU 11.763 0.333 19 0 "[ . 1 . 2]" 1 169 GLN 24.998 0.367 3 0 "[ . 1 . 2]" 1 170 GLN 5.781 0.302 6 0 "[ . 1 . 2]" 1 171 ILE 58.483 0.441 5 0 "[ . 1 . 2]" 1 172 GLY 9.963 0.379 18 0 "[ . 1 . 2]" 1 173 LYS 20.959 0.510 6 4 "[- **.+ 1 . 2]" 1 174 ARG 6.264 0.379 18 0 "[ . 1 . 2]" 1 175 VAL 6.669 0.332 5 0 "[ . 1 . 2]" 1 176 ASP 5.055 0.422 19 0 "[ . 1 . 2]" 1 177 LYS 16.606 0.447 5 0 "[ . 1 . 2]" 1 178 THR 21.078 0.447 5 0 "[ . 1 . 2]" 1 179 PHE 11.385 0.353 15 0 "[ . 1 . 2]" 1 180 LEU 10.885 0.484 15 0 "[ . 1 . 2]" 1 181 PRO 5.448 0.370 11 0 "[ . 1 . 2]" 1 182 SER 11.317 0.399 19 0 "[ . 1 . 2]" 1 183 LEU 14.235 0.901 2 3 "[ + . - 1 * 2]" 1 184 ALA 3.870 0.243 13 0 "[ . 1 . 2]" 1 185 ILE 17.006 0.399 19 0 "[ . 1 . 2]" 1 186 ILE 34.532 0.398 6 0 "[ . 1 . 2]" 1 187 SER 11.465 0.306 12 0 "[ . 1 . 2]" 1 188 LEU 7.284 0.655 16 1 "[ . 1 .+ 2]" 1 189 GLU 7.643 0.267 4 0 "[ . 1 . 2]" 1 190 ASN 5.895 0.353 15 0 "[ . 1 . 2]" 1 191 SER 7.749 0.405 7 0 "[ . 1 . 2]" 1 192 TRP 12.383 0.600 15 1 "[ . 1 + 2]" 1 193 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 194 ALA 18.838 1.109 13 2 "[ . 1 + . - 2]" 1 195 LEU 13.496 1.114 10 4 "[ . **+ * 2]" 1 196 SER 24.488 1.114 10 5 "[ .* **+ - 2]" 1 197 LYS 17.465 1.109 13 3 "[ .* 1 + - 2]" 1 198 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 199 ILE 21.896 0.483 7 0 "[ . 1 . 2]" 1 200 GLN 14.204 0.420 9 0 "[ . 1 . 2]" 1 201 ILE 24.422 0.434 10 0 "[ . 1 . 2]" 1 202 ALA 10.110 0.282 19 0 "[ . 1 . 2]" 1 203 SER 7.769 0.440 16 0 "[ . 1 . 2]" 1 204 THR 8.846 0.262 14 0 "[ . 1 . 2]" 1 205 ASN 35.649 0.553 7 1 "[ . + 1 . 2]" 1 206 ASN 10.947 0.500 16 0 "[ . 1 . 2]" 1 207 GLY 16.143 0.553 7 1 "[ . + 1 . 2]" 1 208 GLN 3.754 0.500 16 0 "[ . 1 . 2]" 1 209 PHE 30.538 0.999 3 14 "[**+** *** **.-* **]" 1 210 GLU 10.736 0.365 4 0 "[ . 1 . 2]" 1 211 THR 11.809 0.999 3 3 "[* + . 1 - . 2]" 1 212 PRO 6.112 0.369 14 0 "[ . 1 . 2]" 1 213 VAL 27.672 0.887 17 4 "[ *. *1 . + -2]" 1 214 VAL 14.463 0.526 18 1 "[ . 1 . + 2]" 1 215 LEU 15.743 0.460 9 0 "[ . 1 . 2]" 1 216 ILE 14.063 0.409 20 0 "[ . 1 . 2]" 1 217 ASN 4.033 0.775 7 1 "[ . + 1 . 2]" 1 218 ALA 7.394 0.258 7 0 "[ . 1 . 2]" 1 219 GLN 26.839 0.803 2 3 "[*+ . 1 - . 2]" 1 220 ASN 12.939 0.901 2 3 "[ + . - 1 * 2]" 1 221 GLN 38.589 0.803 2 3 "[ + . - 1 * . 2]" 1 222 ARG 24.466 0.608 2 2 "[ + . - 1 . 2]" 1 223 VAL 27.009 0.775 7 1 "[ . + 1 . 2]" 1 224 THR 12.632 0.435 8 0 "[ . 1 . 2]" 1 225 ILE 29.155 0.467 4 0 "[ . 1 . 2]" 1 226 THR 27.530 0.448 7 0 "[ . 1 . 2]" 1 227 ASN 2.579 0.597 9 1 "[ . +1 . 2]" 1 228 VAL 11.668 0.850 20 8 "[ * * ** *.-* +]" 1 229 ASP 11.482 0.329 2 0 "[ . 1 . 2]" 1 230 ALA 9.411 0.329 2 0 "[ . 1 . 2]" 1 232 VAL 5.275 0.433 6 0 "[ . 1 . 2]" 1 233 VAL 4.770 0.238 12 0 "[ . 1 . 2]" 1 234 THR 3.440 0.238 12 0 "[ . 1 . 2]" 1 235 SER 1.267 0.189 19 0 "[ . 1 . 2]" 1 236 ASN 19.228 0.840 18 3 "[ -. 1 . +*2]" 1 237 ILE 13.746 0.840 18 3 "[ -. 1 . +*2]" 1 238 ALA 8.873 0.818 6 2 "[- .+ 1 . 2]" 1 239 LEU 23.936 0.419 3 0 "[ . 1 . 2]" 1 240 LEU 7.396 0.623 4 2 "[ +- 1 . 2]" 1 241 PRO 0.033 0.033 3 0 "[ . 1 . 2]" 1 242 ASN 4.011 0.291 16 0 "[ . 1 . 2]" 1 243 ARG 14.002 0.723 2 1 "[ + . 1 . 2]" 1 244 ASN 14.658 0.723 2 2 "[ + . 1 - 2]" 1 245 ASN 27.084 0.445 2 0 "[ . 1 . 2]" 1 246 MET 25.054 0.856 15 5 "[ - *1 + ** 2]" 1 247 ALA 11.157 0.856 15 5 "[ - *1 + ** 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 246 MET HB3 1 247 ALA H . . 2.730 2.100 1.691 2.921 0.191 17 0 "[ . 1 . 2]" 1 2 1 246 MET HB2 1 247 ALA H . . 2.940 2.926 1.762 3.680 0.740 5 1 "[ + 1 . 2]" 1 3 1 191 SER HB2 1 192 TRP H . . 3.920 3.353 3.094 4.083 0.163 8 0 "[ . 1 . 2]" 1 4 1 192 TRP H 1 192 TRP HB2 . . 3.070 2.326 2.267 2.481 . 0 0 "[ . 1 . 2]" 1 5 1 192 TRP H 1 192 TRP HD1 . . 4.190 4.546 4.423 4.790 0.600 15 1 "[ . 1 + 2]" 1 6 1 192 TRP H 1 193 SER H . . 4.330 2.938 2.825 3.062 . 0 0 "[ . 1 . 2]" 1 7 1 191 SER H 1 192 TRP H . . 3.190 2.582 2.478 2.695 . 0 0 "[ . 1 . 2]" 1 8 1 74 TYR H 1 81 TYR HB2 . . 4.080 2.832 2.693 2.985 . 0 0 "[ . 1 . 2]" 1 9 1 74 TYR H 1 81 TYR H . . 3.710 3.017 2.923 3.236 . 0 0 "[ . 1 . 2]" 1 10 1 74 TYR H 1 82 PHE HA . . 4.110 3.595 3.447 3.717 . 0 0 "[ . 1 . 2]" 1 11 1 237 ILE HA 1 238 ALA H . . 4.430 2.220 2.146 2.659 . 0 0 "[ . 1 . 2]" 1 12 1 238 ALA H 1 238 ALA MB . . 3.170 2.264 2.224 2.868 . 0 0 "[ . 1 . 2]" 1 13 1 237 ILE MD 1 238 ALA H . . 4.440 3.191 2.268 3.656 . 0 0 "[ . 1 . 2]" 1 14 1 121 ILE MD 1 124 ASN QD . . 3.570 2.679 2.495 2.928 . 0 0 "[ . 1 . 2]" 1 15 1 124 ASN HA 1 124 ASN QD . . 4.370 4.012 3.975 4.050 . 0 0 "[ . 1 . 2]" 1 16 1 124 ASN H 1 124 ASN QD . . 4.370 3.754 3.707 3.836 . 0 0 "[ . 1 . 2]" 1 17 1 192 TRP HB3 1 193 SER H . . 4.480 2.606 2.329 2.748 . 0 0 "[ . 1 . 2]" 1 18 1 102 LYS H 1 102 LYS QB . . 2.900 2.269 2.239 2.296 . 0 0 "[ . 1 . 2]" 1 19 1 102 LYS H 1 102 LYS HD2 . . 2.880 2.670 2.514 2.845 . 0 0 "[ . 1 . 2]" 1 20 1 102 LYS H 1 102 LYS HG2 . . 3.960 4.164 4.135 4.220 0.260 14 0 "[ . 1 . 2]" 1 21 1 101 ARG H 1 102 LYS H . . 4.020 4.067 3.975 4.132 0.112 3 0 "[ . 1 . 2]" 1 22 1 102 LYS H 1 103 VAL H . . 4.420 4.353 4.274 4.554 0.134 3 0 "[ . 1 . 2]" 1 23 1 194 ALA HA 1 195 LEU H . . 3.950 3.551 3.530 3.571 . 0 0 "[ . 1 . 2]" 1 24 1 195 LEU H 1 213 VAL QG . . 3.480 2.646 2.451 3.070 . 0 0 "[ . 1 . 2]" 1 25 1 194 ALA H 1 195 LEU H . . 3.350 2.566 2.499 2.643 . 0 0 "[ . 1 . 2]" 1 26 1 195 LEU H 1 196 SER H . . 3.680 2.800 2.750 2.841 . 0 0 "[ . 1 . 2]" 1 27 1 9 ALA HA 1 10 THR H . . 2.960 2.128 2.059 2.203 . 0 0 "[ . 1 . 2]" 1 28 1 9 ALA MB 1 10 THR H . . 2.970 2.817 2.656 3.041 0.071 18 0 "[ . 1 . 2]" 1 29 1 10 THR H 1 10 THR MG . . 3.150 3.053 2.958 3.142 . 0 0 "[ . 1 . 2]" 1 30 1 42 PRO HA 1 44 SER H . . 4.590 3.958 3.882 4.369 . 0 0 "[ . 1 . 2]" 1 31 1 44 SER H 1 44 SER HA . . 2.950 2.861 2.811 2.879 . 0 0 "[ . 1 . 2]" 1 32 1 43 GLY QA 1 44 SER H . . 3.930 2.840 2.711 2.882 . 0 0 "[ . 1 . 2]" 1 33 1 42 PRO HB3 1 44 SER H . . 3.930 3.584 3.437 3.984 0.054 16 0 "[ . 1 . 2]" 1 34 1 42 PRO QG 1 44 SER H . . 4.700 4.636 4.456 4.825 0.125 16 0 "[ . 1 . 2]" 1 35 1 42 PRO HB2 1 44 SER H . . 4.180 2.713 2.501 2.933 . 0 0 "[ . 1 . 2]" 1 36 1 44 SER H 1 46 ARG H . . 3.860 3.726 3.572 3.948 0.088 4 0 "[ . 1 . 2]" 1 37 1 7 SER H 1 7 SER HA . . 3.110 2.787 2.777 2.805 . 0 0 "[ . 1 . 2]" 1 38 1 6 LEU HA 1 7 SER H . . 3.950 3.475 3.443 3.496 . 0 0 "[ . 1 . 2]" 1 39 1 5 ARG HB3 1 7 SER H . . 3.860 3.043 2.823 3.930 0.070 9 0 "[ . 1 . 2]" 1 40 1 5 ARG HB2 1 7 SER H . . 3.460 3.465 2.485 3.856 0.396 2 0 "[ . 1 . 2]" 1 41 1 6 LEU QB 1 7 SER H . . 3.460 2.750 2.697 2.938 . 0 0 "[ . 1 . 2]" 1 42 1 7 SER H 1 55 TYR QD . . 3.980 3.570 3.436 3.659 . 0 0 "[ . 1 . 2]" 1 43 1 7 SER H 1 8 GLY H . . 4.330 4.398 4.381 4.416 0.086 4 0 "[ . 1 . 2]" 1 44 1 3 SER QB 1 51 HIS H . . 4.280 3.362 3.155 3.603 . 0 0 "[ . 1 . 2]" 1 45 1 51 HIS H 1 51 HIS HB3 . . 4.130 3.693 3.652 3.872 . 0 0 "[ . 1 . 2]" 1 46 1 51 HIS H 1 51 HIS HB2 . . 4.140 2.567 2.482 2.819 . 0 0 "[ . 1 . 2]" 1 47 1 50 ILE HB 1 51 HIS H . . 4.670 4.159 3.573 4.286 . 0 0 "[ . 1 . 2]" 1 48 1 50 ILE MG 1 51 HIS H . . 3.610 2.743 1.923 2.950 . 0 0 "[ . 1 . 2]" 1 49 1 3 SER H 1 51 HIS H . . 4.080 4.236 4.194 4.276 0.196 8 0 "[ . 1 . 2]" 1 50 1 51 HIS H 1 51 HIS HD2 . . 4.200 2.971 2.741 3.791 . 0 0 "[ . 1 . 2]" 1 51 1 3 SER HA 1 51 HIS H . . 3.670 2.381 2.143 2.509 . 0 0 "[ . 1 . 2]" 1 52 1 186 ILE HA 1 187 SER H . . 4.510 3.525 3.508 3.534 . 0 0 "[ . 1 . 2]" 1 53 1 186 ILE HB 1 187 SER H . . 3.530 2.609 2.349 2.785 . 0 0 "[ . 1 . 2]" 1 54 1 186 ILE MD 1 187 SER H . . 4.330 4.556 4.445 4.636 0.306 12 0 "[ . 1 . 2]" 1 55 1 186 ILE H 1 187 SER H . . 3.720 2.669 2.615 2.763 . 0 0 "[ . 1 . 2]" 1 56 1 48 ALA H 1 64 ILE H . . 3.790 2.719 2.610 2.824 . 0 0 "[ . 1 . 2]" 1 57 1 64 ILE H 1 65 ASP H . . 4.230 4.396 4.225 4.428 0.198 18 0 "[ . 1 . 2]" 1 58 1 63 ALA HA 1 64 ILE H . . 3.120 2.138 2.121 2.185 . 0 0 "[ . 1 . 2]" 1 59 1 120 LYS QG 1 124 ASN QD . . 4.560 2.677 2.280 2.928 . 0 0 "[ . 1 . 2]" 1 60 1 24 ALA HA 1 25 LEU H . . 3.470 3.499 3.487 3.555 0.085 2 0 "[ . 1 . 2]" 1 61 1 22 ARG HA 1 25 LEU H . . 4.240 3.456 3.283 3.525 . 0 0 "[ . 1 . 2]" 1 62 1 25 LEU H 1 26 PRO HD3 . . 4.650 4.388 4.138 4.686 0.036 3 0 "[ . 1 . 2]" 1 63 1 25 LEU H 1 66 VAL HB . . 4.540 4.814 4.768 4.876 0.336 5 0 "[ . 1 . 2]" 1 64 1 25 LEU H 1 25 LEU QB . . 3.250 2.579 2.536 2.608 . 0 0 "[ . 1 . 2]" 1 65 1 24 ALA H 1 25 LEU H . . 3.010 2.507 2.458 2.621 . 0 0 "[ . 1 . 2]" 1 66 1 206 ASN HB3 1 208 GLN QE . . 3.430 2.304 1.723 3.044 . 0 0 "[ . 1 . 2]" 1 67 1 206 ASN HB2 1 208 GLN QE . . 3.230 2.425 2.027 3.354 0.124 2 0 "[ . 1 . 2]" 1 68 1 146 SER HA 1 149 SER H . . 4.340 3.737 3.288 4.017 . 0 0 "[ . 1 . 2]" 1 69 1 118 ALA HA 1 149 SER H . . 4.170 3.228 3.067 3.439 . 0 0 "[ . 1 . 2]" 1 70 1 149 SER H 1 149 SER HA . . 3.030 2.802 2.789 2.811 . 0 0 "[ . 1 . 2]" 1 71 1 118 ALA MB 1 149 SER H . . 3.200 2.432 2.234 2.643 . 0 0 "[ . 1 . 2]" 1 72 1 138 THR HB 1 139 LEU H . . 3.360 2.365 2.324 2.410 . 0 0 "[ . 1 . 2]" 1 73 1 136 ILE HA 1 139 LEU H . . 4.610 3.742 3.614 3.896 . 0 0 "[ . 1 . 2]" 1 74 1 139 LEU H 1 140 PHE QB . . 4.470 4.553 4.513 4.602 0.132 20 0 "[ . 1 . 2]" 1 75 1 139 LEU H 1 150 ALA MB . . 3.410 3.236 3.117 3.351 . 0 0 "[ . 1 . 2]" 1 76 1 139 LEU H 1 139 LEU QB . . 3.470 2.333 2.322 2.343 . 0 0 "[ . 1 . 2]" 1 77 1 138 THR MG 1 139 LEU H . . 3.440 3.298 3.108 3.429 . 0 0 "[ . 1 . 2]" 1 78 1 60 ILE MD 1 139 LEU H . . 3.910 4.157 4.076 4.236 0.326 10 0 "[ . 1 . 2]" 1 79 1 139 LEU H 1 139 LEU HG . . 3.590 2.340 2.313 2.369 . 0 0 "[ . 1 . 2]" 1 80 1 131 ALA H 1 133 ASP H . . 4.500 3.889 3.795 4.093 . 0 0 "[ . 1 . 2]" 1 81 1 138 THR H 1 139 LEU H . . 3.690 2.667 2.636 2.703 . 0 0 "[ . 1 . 2]" 1 82 1 13 SER HA 1 16 VAL H . . 3.240 3.398 3.200 3.641 0.401 4 0 "[ . 1 . 2]" 1 83 1 14 TYR HA 1 16 VAL H . . 4.160 4.415 4.379 4.464 0.304 4 0 "[ . 1 . 2]" 1 84 1 16 VAL H 1 17 PHE QB . . 4.750 4.415 4.372 4.454 . 0 0 "[ . 1 . 2]" 1 85 1 34 ILE H 1 34 ILE HG12 . . 3.620 2.150 1.863 3.990 0.370 18 0 "[ . 1 . 2]" 1 86 1 34 ILE H 1 34 ILE MG . . 3.450 3.747 3.731 3.763 0.313 20 0 "[ . 1 . 2]" 1 87 1 30 LYS HA 1 34 ILE H . . 4.450 4.608 4.474 4.666 0.216 6 0 "[ . 1 . 2]" 1 88 1 14 TYR H 1 16 VAL H . . 3.930 4.040 3.984 4.103 0.173 20 0 "[ . 1 . 2]" 1 89 1 110 ASN H 1 110 ASN HA . . 2.910 2.893 2.885 2.901 . 0 0 "[ . 1 . 2]" 1 90 1 108 SER HA 1 110 ASN H . . 3.810 4.117 4.073 4.203 0.393 16 0 "[ . 1 . 2]" 1 91 1 108 SER HB2 1 110 ASN H . . 3.450 2.991 2.830 3.264 . 0 0 "[ . 1 . 2]" 1 92 1 109 GLY QA 1 110 ASN H . . 3.180 2.915 2.887 2.935 . 0 0 "[ . 1 . 2]" 1 93 1 110 ASN H 1 113 ARG QB . . 3.320 3.299 3.139 3.440 0.120 16 0 "[ . 1 . 2]" 1 94 1 110 ASN H 1 114 LEU MD2 . . 3.770 4.041 3.970 4.088 0.318 2 0 "[ . 1 . 2]" 1 95 1 110 ASN H 1 114 LEU HG . . 3.740 3.598 3.448 3.759 0.019 13 0 "[ . 1 . 2]" 1 96 1 110 ASN H 1 114 LEU H . . 4.150 4.305 4.137 4.413 0.263 13 0 "[ . 1 . 2]" 1 97 1 109 GLY H 1 110 ASN H . . 3.100 2.715 2.578 2.817 . 0 0 "[ . 1 . 2]" 1 98 1 27 TYR H 1 27 TYR HB3 . . 3.900 3.498 3.428 3.594 . 0 0 "[ . 1 . 2]" 1 99 1 26 PRO HB2 1 27 TYR H . . 3.120 2.873 2.514 3.206 0.086 4 0 "[ . 1 . 2]" 1 100 1 26 PRO HB3 1 27 TYR H . . 3.200 3.122 2.837 3.407 0.207 8 0 "[ . 1 . 2]" 1 101 1 27 TYR H 1 27 TYR QD . . 3.200 2.957 2.568 3.199 . 0 0 "[ . 1 . 2]" 1 102 1 2 VAL H 1 2 VAL MG2 . . 2.780 2.266 2.084 2.704 . 0 0 "[ . 1 . 2]" 1 103 1 2 VAL H 1 21 LEU QD . . 4.540 4.625 4.472 4.843 0.303 10 0 "[ . 1 . 2]" 1 104 1 2 VAL H 1 51 HIS HD2 . . 3.940 3.918 3.168 4.123 0.183 19 0 "[ . 1 . 2]" 1 105 1 2 VAL H 1 51 HIS H . . 3.930 3.848 3.489 4.147 0.217 8 0 "[ . 1 . 2]" 1 106 1 184 ALA MB 1 217 ASN H . . 4.670 4.353 4.216 4.469 . 0 0 "[ . 1 . 2]" 1 107 1 216 ILE MG 1 217 ASN H . . 2.910 2.680 2.526 2.795 . 0 0 "[ . 1 . 2]" 1 108 1 216 ILE MD 1 217 ASN H . . 4.140 3.707 3.511 3.804 . 0 0 "[ . 1 . 2]" 1 109 1 217 ASN H 1 221 GLN H . . 3.580 3.007 2.813 3.175 . 0 0 "[ . 1 . 2]" 1 110 1 121 ILE HA 1 122 ARG H . . 3.920 2.362 2.262 2.446 . 0 0 "[ . 1 . 2]" 1 111 1 121 ILE HB 1 122 ARG H . . 3.870 2.488 2.330 2.747 . 0 0 "[ . 1 . 2]" 1 112 1 121 ILE MG 1 122 ARG H . . 3.490 3.736 3.667 3.819 0.329 18 0 "[ . 1 . 2]" 1 113 1 122 ARG H 1 125 ILE MD . . 4.210 4.031 3.923 4.149 . 0 0 "[ . 1 . 2]" 1 114 1 122 ARG H 1 186 ILE MD . . 4.700 4.579 4.218 4.861 0.161 1 0 "[ . 1 . 2]" 1 115 1 122 ARG H 1 123 GLU H . . 4.590 2.700 2.525 2.817 . 0 0 "[ . 1 . 2]" 1 116 1 118 ALA HA 1 119 GLY H . . 3.740 3.423 3.407 3.443 . 0 0 "[ . 1 . 2]" 1 117 1 117 ALA HA 1 119 GLY H . . 3.760 3.997 3.925 4.066 0.306 17 0 "[ . 1 . 2]" 1 118 1 118 ALA MB 1 119 GLY H . . 2.910 2.794 2.723 2.848 . 0 0 "[ . 1 . 2]" 1 119 1 119 GLY H 1 148 ALA MB . . 4.030 4.328 4.285 4.372 0.342 13 0 "[ . 1 . 2]" 1 120 1 116 ILE MG 1 119 GLY H . . 4.450 4.482 4.421 4.549 0.099 8 0 "[ . 1 . 2]" 1 121 1 149 SER H 1 150 ALA H . . 3.040 2.698 2.661 2.725 . 0 0 "[ . 1 . 2]" 1 122 1 6 LEU H 1 7 SER HB3 . . 4.710 4.807 4.733 4.895 0.185 15 0 "[ . 1 . 2]" 1 123 1 6 LEU H 1 53 THR HB . . 4.240 2.989 2.830 3.118 . 0 0 "[ . 1 . 2]" 1 124 1 6 LEU H 1 6 LEU QB . . 3.340 2.094 2.071 2.155 . 0 0 "[ . 1 . 2]" 1 125 1 6 LEU H 1 55 TYR QD . . 4.710 4.938 4.849 5.106 0.396 19 0 "[ . 1 . 2]" 1 126 1 6 LEU H 1 7 SER H . . 3.370 2.518 2.492 2.542 . 0 0 "[ . 1 . 2]" 1 127 1 140 PHE HA 1 141 TYR H . . 3.720 3.488 3.478 3.498 . 0 0 "[ . 1 . 2]" 1 128 1 137 THR HA 1 141 TYR H . . 4.280 4.362 4.249 4.486 0.206 14 0 "[ . 1 . 2]" 1 129 1 141 TYR H 1 141 TYR HB3 . . 3.500 3.613 3.547 3.653 0.153 1 0 "[ . 1 . 2]" 1 130 1 141 TYR H 1 141 TYR HB2 . . 3.260 2.396 2.273 2.499 . 0 0 "[ . 1 . 2]" 1 131 1 60 ILE MG 1 141 TYR H . . 4.650 4.945 4.873 5.095 0.445 1 0 "[ . 1 . 2]" 1 132 1 141 TYR H 1 142 TYR H . . 2.810 2.350 2.296 2.381 . 0 0 "[ . 1 . 2]" 1 133 1 140 PHE QD 1 141 TYR H . . 4.030 3.401 3.277 3.543 . 0 0 "[ . 1 . 2]" 1 134 1 140 PHE H 1 141 TYR H . . 3.500 2.633 2.596 2.665 . 0 0 "[ . 1 . 2]" 1 135 1 208 GLN HA 1 209 PHE H . . 3.080 2.170 2.139 2.202 . 0 0 "[ . 1 . 2]" 1 136 1 209 PHE H 1 226 THR HA . . 4.520 3.803 3.621 3.992 . 0 0 "[ . 1 . 2]" 1 137 1 209 PHE H 1 209 PHE HB2 . . 4.240 2.263 2.217 2.314 . 0 0 "[ . 1 . 2]" 1 138 1 209 PHE H 1 209 PHE HB3 . . 4.050 3.543 3.515 3.575 . 0 0 "[ . 1 . 2]" 1 139 1 208 GLN HB3 1 209 PHE H . . 3.990 3.285 3.009 3.502 . 0 0 "[ . 1 . 2]" 1 140 1 209 PHE H 1 226 THR MG . . 4.550 4.771 4.632 4.948 0.398 8 0 "[ . 1 . 2]" 1 141 1 208 GLN H 1 209 PHE H . . 4.660 4.517 4.476 4.573 . 0 0 "[ . 1 . 2]" 1 142 1 209 PHE H 1 209 PHE QD . . 4.010 2.353 2.196 2.497 . 0 0 "[ . 1 . 2]" 1 143 1 4 PHE HA 1 5 ARG H . . 3.190 2.131 2.115 2.149 . 0 0 "[ . 1 . 2]" 1 144 1 5 ARG H 1 53 THR HB . . 4.660 4.739 4.511 4.882 0.222 20 0 "[ . 1 . 2]" 1 145 1 5 ARG H 1 5 ARG HD2 . . 4.420 4.238 2.159 4.701 0.281 5 0 "[ . 1 . 2]" 1 146 1 5 ARG H 1 5 ARG HB2 . . 3.100 2.776 2.574 3.523 0.423 8 0 "[ . 1 . 2]" 1 147 1 4 PHE QD 1 5 ARG H . . 3.340 3.496 3.415 3.566 0.226 2 0 "[ . 1 . 2]" 1 148 1 4 PHE H 1 5 ARG H . . 4.110 4.093 4.036 4.136 0.026 5 0 "[ . 1 . 2]" 1 149 1 74 TYR HB2 1 75 ARG H . . 4.300 2.432 2.265 3.446 . 0 0 "[ . 1 . 2]" 1 150 1 74 TYR HB3 1 75 ARG H . . 4.250 3.660 2.195 3.948 . 0 0 "[ . 1 . 2]" 1 151 1 75 ARG H 1 75 ARG HG2 . . 3.990 4.249 4.203 4.293 0.303 19 0 "[ . 1 . 2]" 1 152 1 61 SER H 1 75 ARG H . . 4.060 2.843 2.768 2.943 . 0 0 "[ . 1 . 2]" 1 153 1 74 TYR HA 1 75 ARG H . . 3.830 2.427 2.184 2.498 . 0 0 "[ . 1 . 2]" 1 154 1 200 GLN HB2 1 201 ILE H . . 4.230 2.372 2.152 2.651 . 0 0 "[ . 1 . 2]" 1 155 1 200 GLN HB3 1 201 ILE H . . 3.940 3.349 3.015 3.536 . 0 0 "[ . 1 . 2]" 1 156 1 201 ILE H 1 201 ILE HB . . 3.560 2.471 2.404 2.531 . 0 0 "[ . 1 . 2]" 1 157 1 201 ILE H 1 204 THR MG . . 4.620 4.741 4.534 4.882 0.262 14 0 "[ . 1 . 2]" 1 158 1 201 ILE H 1 202 ALA H . . 3.960 2.799 2.768 2.830 . 0 0 "[ . 1 . 2]" 1 159 1 92 ALA MB 1 93 LYS H . . 3.640 2.851 2.767 2.905 . 0 0 "[ . 1 . 2]" 1 160 1 194 ALA HA 1 196 SER H . . 4.610 4.768 4.669 4.868 0.258 3 0 "[ . 1 . 2]" 1 161 1 196 SER H 1 197 LYS HB2 . . 4.390 4.760 4.606 4.916 0.526 6 2 "[ .+ 1 - 2]" 1 162 1 195 LEU HG 1 196 SER H . . 3.510 3.852 3.518 4.624 1.114 10 4 "[ . **+ - 2]" 1 163 1 196 SER H 1 199 ILE MD . . 3.630 3.906 3.851 3.983 0.353 7 0 "[ . 1 . 2]" 1 164 1 178 THR HB 1 179 PHE H . . 3.770 2.244 2.064 2.681 . 0 0 "[ . 1 . 2]" 1 165 1 128 GLY HA3 1 179 PHE H . . 4.530 3.936 3.611 4.042 . 0 0 "[ . 1 . 2]" 1 166 1 126 PRO HB2 1 179 PHE H . . 4.550 4.235 3.980 4.766 0.216 7 0 "[ . 1 . 2]" 1 167 1 126 PRO HB3 1 179 PHE H . . 4.570 4.551 4.025 4.834 0.264 14 0 "[ . 1 . 2]" 1 168 1 179 PHE H 1 179 PHE QD . . 3.580 2.227 2.065 2.445 . 0 0 "[ . 1 . 2]" 1 169 1 178 THR HA 1 179 PHE H . . 3.670 2.423 2.349 2.495 . 0 0 "[ . 1 . 2]" 1 170 1 88 ALA HA 1 91 ALA H . . 3.580 3.296 3.110 3.541 . 0 0 "[ . 1 . 2]" 1 171 1 91 ALA H 1 91 ALA MB . . 2.710 2.234 2.222 2.245 . 0 0 "[ . 1 . 2]" 1 172 1 87 SER HA 1 88 ALA H . . 3.840 3.523 3.483 3.546 . 0 0 "[ . 1 . 2]" 1 173 1 88 ALA H 1 88 ALA MB . . 2.640 2.266 2.245 2.289 . 0 0 "[ . 1 . 2]" 1 174 1 88 ALA H 1 89 THR MG . . 4.370 4.533 4.390 4.695 0.325 12 0 "[ . 1 . 2]" 1 175 1 88 ALA H 1 91 ALA MB . . 4.580 4.500 4.303 4.641 0.061 9 0 "[ . 1 . 2]" 1 176 1 118 ALA HA 1 148 ALA H . . 4.600 4.153 3.938 4.362 . 0 0 "[ . 1 . 2]" 1 177 1 147 ALA HA 1 148 ALA H . . 3.460 3.502 3.477 3.524 0.064 2 0 "[ . 1 . 2]" 1 178 1 147 ALA MB 1 148 ALA H . . 2.900 2.727 2.604 2.811 . 0 0 "[ . 1 . 2]" 1 179 1 121 ILE H 1 121 ILE MG . . 2.630 2.072 1.971 2.114 . 0 0 "[ . 1 . 2]" 1 180 1 61 SER HB2 1 62 VAL H . . 4.730 4.227 4.099 4.283 . 0 0 "[ . 1 . 2]" 1 181 1 62 VAL H 1 62 VAL HB . . 4.000 2.657 2.617 2.723 . 0 0 "[ . 1 . 2]" 1 182 1 62 VAL H 1 62 VAL MG2 . . 3.660 2.373 2.187 2.504 . 0 0 "[ . 1 . 2]" 1 183 1 50 ILE MD 1 62 VAL H . . 4.040 4.292 4.141 4.377 0.337 2 0 "[ . 1 . 2]" 1 184 1 51 HIS HA 1 62 VAL H . . 4.380 3.812 3.465 3.942 . 0 0 "[ . 1 . 2]" 1 185 1 49 LEU HA 1 62 VAL H . . 4.430 3.935 3.841 4.253 . 0 0 "[ . 1 . 2]" 1 186 1 245 ASN HA 1 245 ASN HD22 . . 4.070 4.443 4.392 4.497 0.427 2 0 "[ . 1 . 2]" 1 187 1 67 THR HA 1 245 ASN HD22 . . 4.410 4.143 3.634 4.689 0.279 3 0 "[ . 1 . 2]" 1 188 1 67 THR HB 1 245 ASN HD22 . . 3.660 1.943 1.696 2.331 . 0 0 "[ . 1 . 2]" 1 189 1 39 SER HA 1 245 ASN HD22 . . 3.380 2.417 1.724 2.991 . 0 0 "[ . 1 . 2]" 1 190 1 39 SER HB2 1 245 ASN HD22 . . 4.160 3.942 3.489 4.547 0.387 18 0 "[ . 1 . 2]" 1 191 1 245 ASN HB2 1 245 ASN HD22 . . 3.660 3.530 3.435 3.723 0.063 20 0 "[ . 1 . 2]" 1 192 1 67 THR MG 1 245 ASN HD22 . . 3.960 3.140 2.640 3.352 . 0 0 "[ . 1 . 2]" 1 193 1 245 ASN H 1 245 ASN HD22 . . 4.720 4.826 4.661 4.988 0.268 7 0 "[ . 1 . 2]" 1 194 1 29 ARG HA 1 30 LYS H . . 3.520 2.797 2.726 2.851 . 0 0 "[ . 1 . 2]" 1 195 1 29 ARG QD 1 30 LYS H . . 4.300 3.274 2.274 3.935 . 0 0 "[ . 1 . 2]" 1 196 1 29 ARG QB 1 30 LYS H . . 3.350 1.937 1.842 2.028 . 0 0 "[ . 1 . 2]" 1 197 1 30 LYS H 1 30 LYS HB2 . . 3.810 3.781 3.745 3.828 0.018 12 0 "[ . 1 . 2]" 1 198 1 30 LYS H 1 30 LYS QD . . 3.610 2.364 2.243 2.484 . 0 0 "[ . 1 . 2]" 1 199 1 30 LYS H 1 30 LYS HB3 . . 3.690 3.747 3.713 3.789 0.099 18 0 "[ . 1 . 2]" 1 200 1 30 LYS H 1 31 LEU QD . . 3.390 3.599 3.480 3.703 0.313 6 0 "[ . 1 . 2]" 1 201 1 30 LYS H 1 30 LYS HG2 . . 4.320 4.138 4.103 4.192 . 0 0 "[ . 1 . 2]" 1 202 1 100 LYS HA 1 101 ARG H . . 3.320 3.363 3.307 3.404 0.084 20 0 "[ . 1 . 2]" 1 203 1 99 ALA HA 1 101 ARG H . . 3.380 3.660 3.613 3.703 0.323 5 0 "[ . 1 . 2]" 1 204 1 101 ARG H 1 101 ARG QD . . 4.080 4.369 4.283 4.640 0.560 7 1 "[ . + 1 . 2]" 1 205 1 99 ALA MB 1 101 ARG H . . 2.890 2.699 2.631 2.779 . 0 0 "[ . 1 . 2]" 1 206 1 79 THR HA 1 101 ARG H . . 3.210 3.316 3.170 3.390 0.180 11 0 "[ . 1 . 2]" 1 207 1 80 SER H 1 101 ARG H . . 3.630 3.283 3.199 3.435 . 0 0 "[ . 1 . 2]" 1 208 1 100 LYS H 1 101 ARG H . . 2.760 2.530 2.454 2.584 . 0 0 "[ . 1 . 2]" 1 209 1 209 PHE HA 1 210 GLU H . . 3.630 2.186 2.155 2.230 . 0 0 "[ . 1 . 2]" 1 210 1 209 PHE HB2 1 210 GLU H . . 4.280 4.273 4.111 4.404 0.124 2 0 "[ . 1 . 2]" 1 211 1 209 PHE HB3 1 210 GLU H . . 4.210 3.202 2.926 3.449 . 0 0 "[ . 1 . 2]" 1 212 1 210 GLU H 1 210 GLU HB2 . . 3.270 2.920 2.386 3.635 0.365 4 0 "[ . 1 . 2]" 1 213 1 201 ILE MD 1 210 GLU H . . 4.190 3.717 3.468 3.935 . 0 0 "[ . 1 . 2]" 1 214 1 209 PHE QD 1 210 GLU H . . 4.360 4.366 4.245 4.481 0.121 2 0 "[ . 1 . 2]" 1 215 1 115 GLN HA 1 120 LYS H . . 3.660 3.387 3.120 3.840 0.180 15 0 "[ . 1 . 2]" 1 216 1 120 LYS H 1 120 LYS QE . . 4.660 4.726 4.640 4.853 0.193 10 0 "[ . 1 . 2]" 1 217 1 120 LYS H 1 120 LYS HB2 . . 3.440 3.284 3.216 3.329 . 0 0 "[ . 1 . 2]" 1 218 1 120 LYS H 1 125 ILE MD . . 4.170 4.382 4.190 4.558 0.388 11 0 "[ . 1 . 2]" 1 219 1 118 ALA H 1 120 LYS H . . 3.670 3.976 3.920 4.066 0.396 10 0 "[ . 1 . 2]" 1 220 1 119 GLY H 1 120 LYS H . . 2.800 2.461 2.377 2.516 . 0 0 "[ . 1 . 2]" 1 221 1 67 THR MG 1 68 ASN H . . 4.100 3.852 3.725 3.966 . 0 0 "[ . 1 . 2]" 1 222 1 66 VAL QG 1 68 ASN H . . 4.350 4.163 4.111 4.265 . 0 0 "[ . 1 . 2]" 1 223 1 67 THR H 1 68 ASN H . . 3.720 2.313 2.260 2.368 . 0 0 "[ . 1 . 2]" 1 224 1 111 TYR HB2 1 112 GLU H . . 3.760 2.920 2.586 3.256 . 0 0 "[ . 1 . 2]" 1 225 1 112 GLU H 1 113 ARG H . . 3.590 2.805 2.734 2.919 . 0 0 "[ . 1 . 2]" 1 226 1 113 ARG HA 1 114 LEU H . . 3.480 3.509 3.498 3.522 0.042 13 0 "[ . 1 . 2]" 1 227 1 114 LEU H 1 114 LEU HB2 . . 3.060 2.533 2.459 2.617 . 0 0 "[ . 1 . 2]" 1 228 1 114 LEU H 1 114 LEU HB3 . . 3.530 3.569 3.561 3.579 0.049 13 0 "[ . 1 . 2]" 1 229 1 180 LEU H 1 180 LEU MD1 . . 2.980 3.269 2.352 3.464 0.484 15 0 "[ . 1 . 2]" 1 230 1 179 PHE HA 1 180 LEU H . . 2.960 2.256 2.182 2.330 . 0 0 "[ . 1 . 2]" 1 231 1 129 LEU H 1 130 PRO HD2 . . 4.360 2.466 2.352 2.598 . 0 0 "[ . 1 . 2]" 1 232 1 129 LEU H 1 130 PRO HD3 . . 4.500 2.762 2.623 2.883 . 0 0 "[ . 1 . 2]" 1 233 1 129 LEU H 1 129 LEU HG . . 3.660 3.019 2.324 3.954 0.294 12 0 "[ . 1 . 2]" 1 234 1 129 LEU H 1 129 LEU QD . . 3.460 2.780 1.965 3.302 . 0 0 "[ . 1 . 2]" 1 235 1 128 GLY HA2 1 129 LEU H . . 4.510 2.553 2.454 2.617 . 0 0 "[ . 1 . 2]" 1 236 1 13 SER HA 1 17 PHE H . . 4.170 4.133 4.023 4.314 0.144 20 0 "[ . 1 . 2]" 1 237 1 14 TYR HA 1 17 PHE H . . 4.020 3.055 2.976 3.138 . 0 0 "[ . 1 . 2]" 1 238 1 15 GLY QA 1 17 PHE H . . 4.320 3.928 3.861 4.012 . 0 0 "[ . 1 . 2]" 1 239 1 16 VAL HA 1 17 PHE H . . 4.170 3.535 3.520 3.547 . 0 0 "[ . 1 . 2]" 1 240 1 17 PHE H 1 17 PHE HB3 . . 3.640 2.238 2.210 2.280 . 0 0 "[ . 1 . 2]" 1 241 1 16 VAL HB 1 17 PHE H . . 3.590 2.676 2.552 2.745 . 0 0 "[ . 1 . 2]" 1 242 1 16 VAL QG 1 17 PHE H . . 3.310 3.133 3.042 3.202 . 0 0 "[ . 1 . 2]" 1 243 1 14 TYR QD 1 17 PHE H . . 4.700 5.044 4.919 5.123 0.423 4 0 "[ . 1 . 2]" 1 244 1 17 PHE H 1 17 PHE QD . . 3.860 4.097 4.076 4.126 0.266 11 0 "[ . 1 . 2]" 1 245 1 16 VAL H 1 17 PHE H . . 3.480 2.738 2.694 2.786 . 0 0 "[ . 1 . 2]" 1 246 1 143 ASN HA 1 146 SER H . . 4.320 4.596 4.509 4.646 0.326 17 0 "[ . 1 . 2]" 1 247 1 146 SER H 1 146 SER HB2 . . 3.350 2.986 2.615 3.266 . 0 0 "[ . 1 . 2]" 1 248 1 146 SER H 1 146 SER HB3 . . 3.430 2.949 2.499 3.848 0.418 13 0 "[ . 1 . 2]" 1 249 1 145 ASN QB 1 146 SER H . . 3.140 2.984 2.490 3.243 0.103 13 0 "[ . 1 . 2]" 1 250 1 146 SER H 1 147 ALA MB . . 3.460 3.504 3.321 3.898 0.438 18 0 "[ . 1 . 2]" 1 251 1 138 THR MG 1 146 SER H . . 4.230 3.962 3.651 4.246 0.016 1 0 "[ . 1 . 2]" 1 252 1 146 SER H 1 147 ALA H . . 2.870 1.793 1.568 2.288 . 0 0 "[ . 1 . 2]" 1 253 1 146 SER H 1 148 ALA H . . 4.200 3.909 3.563 4.395 0.195 15 0 "[ . 1 . 2]" 1 254 1 183 LEU HA 1 186 ILE H . . 4.050 3.319 3.025 3.581 . 0 0 "[ . 1 . 2]" 1 255 1 185 ILE HB 1 186 ILE H . . 4.040 2.361 2.315 2.415 . 0 0 "[ . 1 . 2]" 1 256 1 186 ILE H 1 186 ILE HB . . 3.520 2.406 2.290 2.573 . 0 0 "[ . 1 . 2]" 1 257 1 186 ILE H 1 186 ILE QG . . 3.590 2.064 1.811 2.292 . 0 0 "[ . 1 . 2]" 1 258 1 186 ILE H 1 186 ILE MG . . 3.340 3.693 3.674 3.713 0.373 19 0 "[ . 1 . 2]" 1 259 1 174 ARG HA 1 176 ASP H . . 4.000 3.384 2.996 3.722 . 0 0 "[ . 1 . 2]" 1 260 1 175 VAL HA 1 176 ASP H . . 4.220 3.484 3.382 3.546 . 0 0 "[ . 1 . 2]" 1 261 1 176 ASP H 1 176 ASP HB2 . . 3.830 2.370 2.277 2.502 . 0 0 "[ . 1 . 2]" 1 262 1 176 ASP H 1 176 ASP HB3 . . 3.740 3.609 3.535 3.665 . 0 0 "[ . 1 . 2]" 1 263 1 187 SER HA 1 190 ASN H . . 4.140 3.493 3.210 3.720 . 0 0 "[ . 1 . 2]" 1 264 1 190 ASN H 1 190 ASN HB2 . . 3.730 2.564 2.342 2.814 . 0 0 "[ . 1 . 2]" 1 265 1 190 ASN H 1 190 ASN HB3 . . 3.700 2.880 2.380 3.622 . 0 0 "[ . 1 . 2]" 1 266 1 186 ILE MG 1 190 ASN H . . 4.230 4.338 3.985 4.583 0.353 15 0 "[ . 1 . 2]" 1 267 1 190 ASN H 1 191 SER H . . 3.420 2.484 2.413 2.563 . 0 0 "[ . 1 . 2]" 1 268 1 190 ASN H 1 192 TRP H . . 4.730 3.899 3.725 4.090 . 0 0 "[ . 1 . 2]" 1 269 1 207 GLY HA3 1 208 GLN H . . 4.120 3.348 3.281 3.402 . 0 0 "[ . 1 . 2]" 1 270 1 202 ALA HA 1 208 GLN H . . 4.360 3.361 3.177 3.582 . 0 0 "[ . 1 . 2]" 1 271 1 207 GLY HA2 1 208 GLN H . . 4.340 3.241 3.165 3.326 . 0 0 "[ . 1 . 2]" 1 272 1 205 ASN HB3 1 208 GLN H . . 4.190 2.960 2.840 3.061 . 0 0 "[ . 1 . 2]" 1 273 1 206 ASN HB2 1 208 GLN H . . 4.460 3.726 3.403 4.960 0.500 16 0 "[ . 1 . 2]" 1 274 1 208 GLN H 1 208 GLN HB2 . . 3.320 2.468 2.210 2.777 . 0 0 "[ . 1 . 2]" 1 275 1 202 ALA MB 1 208 GLN H . . 4.110 3.216 2.998 3.423 . 0 0 "[ . 1 . 2]" 1 276 1 208 GLN H 1 208 GLN QE . . 4.640 3.203 2.733 3.588 . 0 0 "[ . 1 . 2]" 1 277 1 7 SER HA 1 8 GLY H . . 3.510 2.124 2.112 2.142 . 0 0 "[ . 1 . 2]" 1 278 1 182 SER HA 1 184 ALA H . . 3.930 4.043 3.829 4.167 0.237 15 0 "[ . 1 . 2]" 1 279 1 183 LEU QB 1 184 ALA H . . 4.220 2.888 2.771 2.968 . 0 0 "[ . 1 . 2]" 1 280 1 184 ALA H 1 184 ALA MB . . 3.120 2.233 2.229 2.241 . 0 0 "[ . 1 . 2]" 1 281 1 184 ALA H 1 216 ILE MG . . 3.930 3.191 2.876 3.497 . 0 0 "[ . 1 . 2]" 1 282 1 184 ALA H 1 185 ILE H . . 4.220 2.651 2.599 2.711 . 0 0 "[ . 1 . 2]" 1 283 1 183 LEU H 1 184 ALA H . . 4.630 2.623 2.540 2.722 . 0 0 "[ . 1 . 2]" 1 284 1 63 ALA H 1 74 TYR HB3 . . 4.660 3.806 3.588 5.001 0.341 19 0 "[ . 1 . 2]" 1 285 1 62 VAL MG1 1 63 ALA H . . 2.380 2.754 2.713 2.927 0.547 19 1 "[ . 1 . +2]" 1 286 1 63 ALA H 1 74 TYR HA . . 4.060 2.497 2.390 2.733 . 0 0 "[ . 1 . 2]" 1 287 1 10 THR HB 1 11 SER H . . 3.500 2.231 2.092 2.437 . 0 0 "[ . 1 . 2]" 1 288 1 11 SER H 1 11 SER HB2 . . 3.840 2.862 2.421 3.606 . 0 0 "[ . 1 . 2]" 1 289 1 11 SER H 1 11 SER HB3 . . 3.760 3.085 2.545 3.606 . 0 0 "[ . 1 . 2]" 1 290 1 10 THR MG 1 11 SER H . . 3.410 3.647 3.578 3.701 0.291 4 0 "[ . 1 . 2]" 1 291 1 11 SER H 1 175 VAL QG . . 3.390 2.098 1.867 2.272 . 0 0 "[ . 1 . 2]" 1 292 1 2 VAL HB 1 3 SER H . . 3.510 3.548 3.395 3.651 0.141 11 0 "[ . 1 . 2]" 1 293 1 2 VAL MG1 1 3 SER H . . 2.250 2.006 1.873 2.131 . 0 0 "[ . 1 . 2]" 1 294 1 61 SER H 1 61 SER HB3 . . 4.090 3.653 3.639 3.664 . 0 0 "[ . 1 . 2]" 1 295 1 60 ILE HB 1 61 SER H . . 3.750 2.841 2.739 2.892 . 0 0 "[ . 1 . 2]" 1 296 1 60 ILE QG 1 61 SER H . . 4.740 3.936 3.833 4.018 . 0 0 "[ . 1 . 2]" 1 297 1 60 ILE MG 1 61 SER H . . 3.370 3.730 3.662 3.762 0.392 9 0 "[ . 1 . 2]" 1 298 1 61 SER H 1 75 ARG QB . . 4.120 2.687 2.545 2.979 . 0 0 "[ . 1 . 2]" 1 299 1 60 ILE MD 1 61 SER H . . 4.310 4.591 4.522 4.675 0.365 5 0 "[ . 1 . 2]" 1 300 1 60 ILE HA 1 61 SER H . . 3.190 2.188 2.160 2.215 . 0 0 "[ . 1 . 2]" 1 301 1 76 ALA HA 1 77 GLY H . . 3.240 2.178 2.161 2.200 . 0 0 "[ . 1 . 2]" 1 302 1 76 ALA MB 1 77 GLY H . . 3.600 3.505 3.481 3.526 . 0 0 "[ . 1 . 2]" 1 303 1 75 ARG HG3 1 77 GLY H . . 4.370 4.334 4.184 4.412 0.042 5 0 "[ . 1 . 2]" 1 304 1 154 LEU HB2 1 155 ILE H . . 4.280 3.726 3.659 3.789 . 0 0 "[ . 1 . 2]" 1 305 1 155 ILE H 1 155 ILE HB . . 3.800 2.513 2.404 2.588 . 0 0 "[ . 1 . 2]" 1 306 1 154 LEU HB3 1 155 ILE H . . 4.280 2.429 2.336 2.623 . 0 0 "[ . 1 . 2]" 1 307 1 155 ILE H 1 155 ILE MG . . 3.470 3.746 3.721 3.756 0.286 18 0 "[ . 1 . 2]" 1 308 1 155 ILE H 1 156 GLN H . . 4.310 2.798 2.731 2.869 . 0 0 "[ . 1 . 2]" 1 309 1 10 THR HA 1 13 SER H . . 4.340 4.493 4.335 4.630 0.290 14 0 "[ . 1 . 2]" 1 310 1 13 SER H 1 13 SER HA . . 3.130 2.864 2.841 2.879 . 0 0 "[ . 1 . 2]" 1 311 1 12 SER HA 1 13 SER H . . 3.350 3.538 3.471 3.564 0.214 9 0 "[ . 1 . 2]" 1 312 1 10 THR MG 1 13 SER H . . 4.530 4.102 3.825 4.313 . 0 0 "[ . 1 . 2]" 1 313 1 54 ASN HB2 1 55 TYR H . . 3.820 2.113 2.041 2.297 . 0 0 "[ . 1 . 2]" 1 314 1 54 ASN HA 1 55 TYR H . . 3.660 2.576 2.540 2.605 . 0 0 "[ . 1 . 2]" 1 315 1 55 TYR H 1 133 ASP HA . . 4.750 3.520 3.388 3.643 . 0 0 "[ . 1 . 2]" 1 316 1 55 TYR H 1 55 TYR HB2 . . 3.920 2.500 2.408 2.553 . 0 0 "[ . 1 . 2]" 1 317 1 55 TYR H 1 55 TYR HB3 . . 3.880 3.620 3.593 3.629 . 0 0 "[ . 1 . 2]" 1 318 1 54 ASN HB3 1 55 TYR H . . 4.020 3.589 3.528 3.741 . 0 0 "[ . 1 . 2]" 1 319 1 55 TYR H 1 133 ASP HB2 . . 4.590 3.064 2.929 3.224 . 0 0 "[ . 1 . 2]" 1 320 1 6 LEU QB 1 55 TYR H . . 4.040 2.701 2.607 2.905 . 0 0 "[ . 1 . 2]" 1 321 1 55 TYR H 1 136 ILE MG . . 4.620 4.952 4.877 5.035 0.415 20 0 "[ . 1 . 2]" 1 322 1 55 TYR H 1 57 ASP H . . 4.670 4.171 4.133 4.220 . 0 0 "[ . 1 . 2]" 1 323 1 55 TYR H 1 56 ALA H . . 3.240 2.686 2.659 2.720 . 0 0 "[ . 1 . 2]" 1 324 1 55 TYR H 1 55 TYR QD . . 4.100 3.228 3.145 3.265 . 0 0 "[ . 1 . 2]" 1 325 1 55 TYR H 1 55 TYR QE . . 4.390 4.597 4.503 4.685 0.295 19 0 "[ . 1 . 2]" 1 326 1 244 ASN HA 1 245 ASN H . . 4.240 3.445 3.371 3.496 . 0 0 "[ . 1 . 2]" 1 327 1 245 ASN H 1 245 ASN HB2 . . 4.020 2.344 2.297 2.420 . 0 0 "[ . 1 . 2]" 1 328 1 245 ASN H 1 245 ASN HB3 . . 3.750 3.589 3.551 3.627 . 0 0 "[ . 1 . 2]" 1 329 1 233 VAL HA 1 234 THR H . . 4.750 3.554 3.490 3.579 . 0 0 "[ . 1 . 2]" 1 330 1 233 VAL HB 1 234 THR H . . 4.500 2.383 2.266 2.845 . 0 0 "[ . 1 . 2]" 1 331 1 234 THR H 1 234 THR MG . . 3.040 2.451 1.812 2.773 . 0 0 "[ . 1 . 2]" 1 332 1 233 VAL MG2 1 234 THR H . . 4.060 3.752 3.649 3.903 . 0 0 "[ . 1 . 2]" 1 333 1 233 VAL MG1 1 234 THR H . . 3.390 3.193 2.981 3.602 0.212 19 0 "[ . 1 . 2]" 1 334 1 233 VAL H 1 234 THR H . . 4.000 2.571 2.340 2.806 . 0 0 "[ . 1 . 2]" 1 335 1 220 ASN HA 1 221 GLN H . . 3.190 2.778 2.681 2.893 . 0 0 "[ . 1 . 2]" 1 336 1 216 ILE MD 1 221 GLN H . . 4.610 3.983 3.386 4.284 . 0 0 "[ . 1 . 2]" 1 337 1 78 ASP HA 1 79 THR H . . 3.530 3.300 3.269 3.355 . 0 0 "[ . 1 . 2]" 1 338 1 77 GLY HA3 1 79 THR H . . 3.810 3.119 3.034 3.211 . 0 0 "[ . 1 . 2]" 1 339 1 79 THR H 1 79 THR HB . . 3.000 2.643 2.529 2.778 . 0 0 "[ . 1 . 2]" 1 340 1 78 ASP QB 1 79 THR H . . 3.620 3.644 3.224 3.806 0.186 18 0 "[ . 1 . 2]" 1 341 1 76 ALA MB 1 79 THR H . . 4.080 4.356 4.203 4.469 0.389 16 0 "[ . 1 . 2]" 1 342 1 79 THR H 1 99 ALA MB . . 4.060 4.324 4.217 4.409 0.349 14 0 "[ . 1 . 2]" 1 343 1 79 THR H 1 79 THR MG . . 4.520 3.787 3.756 3.805 . 0 0 "[ . 1 . 2]" 1 344 1 76 ALA H 1 79 THR H . . 3.780 3.815 3.716 3.878 0.098 14 0 "[ . 1 . 2]" 1 345 1 48 ALA HA 1 49 LEU H . . 3.090 2.140 2.114 2.168 . 0 0 "[ . 1 . 2]" 1 346 1 48 ALA MB 1 49 LEU H . . 2.920 3.000 2.923 3.099 0.179 5 0 "[ . 1 . 2]" 1 347 1 49 LEU H 1 49 LEU QD . . 3.160 2.738 1.785 3.094 . 0 0 "[ . 1 . 2]" 1 348 1 49 LEU H 1 49 LEU HB3 . . 3.430 3.582 3.569 3.607 0.177 4 0 "[ . 1 . 2]" 1 349 1 2 VAL H 1 49 LEU H . . 4.220 4.292 4.164 4.452 0.232 10 0 "[ . 1 . 2]" 1 350 1 194 ALA H 1 194 ALA HA . . 2.890 2.876 2.858 2.890 0.000 3 0 "[ . 1 . 2]" 1 351 1 191 SER HA 1 194 ALA H . . 3.890 3.132 2.847 3.313 . 0 0 "[ . 1 . 2]" 1 352 1 127 LEU HA 1 128 GLY H . . 4.570 2.355 2.230 2.542 . 0 0 "[ . 1 . 2]" 1 353 1 128 GLY H 1 131 ALA MB . . 4.350 2.649 2.484 3.067 . 0 0 "[ . 1 . 2]" 1 354 1 128 GLY H 1 171 ILE MD . . 3.880 3.989 3.864 4.142 0.262 4 0 "[ . 1 . 2]" 1 355 1 203 SER H 1 203 SER HB3 . . 3.090 2.665 2.598 2.781 . 0 0 "[ . 1 . 2]" 1 356 1 200 GLN HA 1 203 SER H . . 3.990 3.541 3.396 3.680 . 0 0 "[ . 1 . 2]" 1 357 1 201 ILE HA 1 203 SER H . . 4.660 4.339 4.232 4.456 . 0 0 "[ . 1 . 2]" 1 358 1 202 ALA MB 1 203 SER H . . 3.370 2.739 2.655 2.797 . 0 0 "[ . 1 . 2]" 1 359 1 203 SER H 1 204 THR MG . . 4.440 4.046 3.966 4.126 . 0 0 "[ . 1 . 2]" 1 360 1 199 ILE MG 1 203 SER H . . 4.170 4.074 3.957 4.186 0.016 14 0 "[ . 1 . 2]" 1 361 1 202 ALA H 1 203 SER H . . 3.730 2.665 2.614 2.772 . 0 0 "[ . 1 . 2]" 1 362 1 203 SER H 1 205 ASN H . . 4.140 3.916 3.838 3.972 . 0 0 "[ . 1 . 2]" 1 363 1 199 ILE HA 1 202 ALA H . . 4.700 3.572 3.417 3.702 . 0 0 "[ . 1 . 2]" 1 364 1 201 ILE HB 1 202 ALA H . . 4.010 2.336 2.270 2.373 . 0 0 "[ . 1 . 2]" 1 365 1 201 ILE MD 1 202 ALA H . . 4.090 4.239 4.190 4.301 0.211 13 0 "[ . 1 . 2]" 1 366 1 5 ARG HA 1 53 THR H . . 3.700 2.702 2.410 2.957 . 0 0 "[ . 1 . 2]" 1 367 1 53 THR H 1 53 THR HB . . 3.580 2.509 2.462 2.557 . 0 0 "[ . 1 . 2]" 1 368 1 52 LEU QD 1 53 THR H . . 3.220 3.381 3.263 3.468 0.248 8 0 "[ . 1 . 2]" 1 369 1 4 PHE QD 1 53 THR H . . 4.250 4.488 4.426 4.530 0.280 8 0 "[ . 1 . 2]" 1 370 1 53 THR H 1 59 THR HA . . 4.420 4.018 3.939 4.185 . 0 0 "[ . 1 . 2]" 1 371 1 20 ASN HA 1 24 ALA H . . 4.230 4.228 4.100 4.482 0.252 2 0 "[ . 1 . 2]" 1 372 1 24 ALA H 1 24 ALA HA . . 2.880 2.844 2.840 2.852 . 0 0 "[ . 1 . 2]" 1 373 1 21 LEU HA 1 24 ALA H . . 3.950 3.408 3.343 3.500 . 0 0 "[ . 1 . 2]" 1 374 1 23 LYS QB 1 24 ALA H . . 3.100 2.781 2.691 2.931 . 0 0 "[ . 1 . 2]" 1 375 1 2 VAL MG2 1 24 ALA H . . 3.420 3.237 3.131 3.335 . 0 0 "[ . 1 . 2]" 1 376 1 24 ALA H 1 25 LEU QD . . 4.030 3.999 3.164 4.103 0.073 6 0 "[ . 1 . 2]" 1 377 1 203 SER HA 1 207 GLY H . . 4.710 4.011 3.853 4.339 . 0 0 "[ . 1 . 2]" 1 378 1 206 ASN HA 1 207 GLY H . . 3.350 3.024 2.998 3.055 . 0 0 "[ . 1 . 2]" 1 379 1 202 ALA HA 1 207 GLY H . . 4.280 3.221 3.066 3.340 . 0 0 "[ . 1 . 2]" 1 380 1 206 ASN HB3 1 207 GLY H . . 4.200 4.316 3.917 4.406 0.206 17 0 "[ . 1 . 2]" 1 381 1 206 ASN HB2 1 207 GLY H . . 4.570 4.011 3.894 4.443 . 0 0 "[ . 1 . 2]" 1 382 1 205 ASN HB2 1 207 GLY H . . 4.340 4.587 4.450 4.674 0.334 14 0 "[ . 1 . 2]" 1 383 1 202 ALA MB 1 207 GLY H . . 3.810 3.094 2.923 3.207 . 0 0 "[ . 1 . 2]" 1 384 1 205 ASN H 1 207 GLY H . . 3.940 2.749 2.702 2.870 . 0 0 "[ . 1 . 2]" 1 385 1 207 GLY H 1 208 GLN H . . 3.450 2.493 2.468 2.522 . 0 0 "[ . 1 . 2]" 1 386 1 206 ASN H 1 207 GLY H . . 4.470 2.685 2.632 2.717 . 0 0 "[ . 1 . 2]" 1 387 1 51 HIS HB3 1 52 LEU H . . 4.670 3.301 3.150 3.401 . 0 0 "[ . 1 . 2]" 1 388 1 51 HIS HB2 1 52 LEU H . . 4.300 4.161 4.087 4.232 . 0 0 "[ . 1 . 2]" 1 389 1 52 LEU H 1 52 LEU HB2 . . 4.090 2.764 2.634 2.805 . 0 0 "[ . 1 . 2]" 1 390 1 52 LEU H 1 52 LEU HB3 . . 4.130 3.218 3.160 3.672 . 0 0 "[ . 1 . 2]" 1 391 1 52 LEU H 1 59 THR MG . . 3.550 2.375 2.269 2.544 . 0 0 "[ . 1 . 2]" 1 392 1 50 ILE MG 1 52 LEU H . . 4.190 3.872 3.759 4.013 . 0 0 "[ . 1 . 2]" 1 393 1 52 LEU H 1 61 SER HA . . 4.190 3.662 3.494 3.860 . 0 0 "[ . 1 . 2]" 1 394 1 52 LEU H 1 62 VAL H . . 4.760 4.863 4.766 5.006 0.246 10 0 "[ . 1 . 2]" 1 395 1 104 THR HA 1 105 LEU H . . 3.460 2.116 2.105 2.136 . 0 0 "[ . 1 . 2]" 1 396 1 103 VAL H 1 103 VAL HB . . 3.180 2.497 2.436 2.788 . 0 0 "[ . 1 . 2]" 1 397 1 104 THR MG 1 105 LEU H . . 3.210 2.749 2.650 2.840 . 0 0 "[ . 1 . 2]" 1 398 1 80 SER H 1 103 VAL H . . 4.240 3.895 3.729 4.508 0.268 3 0 "[ . 1 . 2]" 1 399 1 103 VAL H 1 104 THR H . . 4.570 4.327 4.019 4.402 . 0 0 "[ . 1 . 2]" 1 400 1 82 PHE H 1 103 VAL H . . 4.350 4.077 3.768 4.236 . 0 0 "[ . 1 . 2]" 1 401 1 102 LYS HA 1 103 VAL H . . 3.090 2.175 2.141 2.343 . 0 0 "[ . 1 . 2]" 1 402 1 11 SER HA 1 14 TYR H . . 3.500 3.648 3.503 3.761 0.261 5 0 "[ . 1 . 2]" 1 403 1 9 ALA MB 1 14 TYR H . . 4.510 4.550 4.328 4.691 0.181 10 0 "[ . 1 . 2]" 1 404 1 14 TYR H 1 15 GLY H . . 3.360 2.644 2.595 2.693 . 0 0 "[ . 1 . 2]" 1 405 1 14 TYR H 1 14 TYR QD . . 3.890 4.115 4.083 4.149 0.259 18 0 "[ . 1 . 2]" 1 406 1 112 GLU HA 1 115 GLN H . . 4.370 3.735 3.624 3.921 . 0 0 "[ . 1 . 2]" 1 407 1 115 GLN H 1 115 GLN HB2 . . 3.480 2.396 2.312 2.533 . 0 0 "[ . 1 . 2]" 1 408 1 60 ILE H 1 60 ILE MD . . 4.060 4.184 4.171 4.195 0.135 12 0 "[ . 1 . 2]" 1 409 1 114 LEU H 1 115 GLN H . . 3.640 2.765 2.636 2.850 . 0 0 "[ . 1 . 2]" 1 410 1 113 ARG H 1 115 GLN H . . 4.030 4.173 4.087 4.246 0.216 12 0 "[ . 1 . 2]" 1 411 1 53 THR HA 1 60 ILE H . . 4.070 3.844 3.667 3.963 . 0 0 "[ . 1 . 2]" 1 412 1 161 ALA HA 1 162 ALA H . . 4.070 3.540 3.528 3.552 . 0 0 "[ . 1 . 2]" 1 413 1 162 ALA H 1 162 ALA MB . . 2.710 2.237 2.229 2.249 . 0 0 "[ . 1 . 2]" 1 414 1 21 LEU QD 1 162 ALA H . . 3.730 3.284 3.215 3.351 . 0 0 "[ . 1 . 2]" 1 415 1 18 ILE MG 1 162 ALA H . . 3.660 2.850 2.756 2.946 . 0 0 "[ . 1 . 2]" 1 416 1 18 ILE MD 1 162 ALA H . . 4.040 3.199 3.085 3.306 . 0 0 "[ . 1 . 2]" 1 417 1 160 GLU H 1 162 ALA H . . 3.960 4.095 3.977 4.198 0.238 9 0 "[ . 1 . 2]" 1 418 1 162 ALA H 1 163 ARG H . . 3.460 2.776 2.692 2.856 . 0 0 "[ . 1 . 2]" 1 419 1 161 ALA H 1 162 ALA H . . 3.360 2.640 2.541 2.724 . 0 0 "[ . 1 . 2]" 1 420 1 219 GLN HE21 1 219 GLN QG . . 3.210 2.149 2.103 2.179 . 0 0 "[ . 1 . 2]" 1 421 1 218 ALA MB 1 219 GLN HE21 . . 3.520 2.047 1.814 2.649 . 0 0 "[ . 1 . 2]" 1 422 1 54 ASN H 1 57 ASP HA . . 4.420 4.400 4.357 4.476 0.056 14 0 "[ . 1 . 2]" 1 423 1 53 THR HB 1 54 ASN H . . 4.590 4.338 4.301 4.368 . 0 0 "[ . 1 . 2]" 1 424 1 54 ASN H 1 54 ASN HB3 . . 4.320 2.675 2.443 2.764 . 0 0 "[ . 1 . 2]" 1 425 1 53 THR MG 1 54 ASN H . . 3.030 3.048 2.988 3.099 0.069 18 0 "[ . 1 . 2]" 1 426 1 54 ASN H 1 136 ILE MG . . 3.630 2.194 2.091 2.319 . 0 0 "[ . 1 . 2]" 1 427 1 6 LEU QD 1 54 ASN H . . 3.810 3.788 3.647 3.869 0.059 6 0 "[ . 1 . 2]" 1 428 1 54 ASN H 1 58 GLU H . . 3.770 3.325 3.222 3.428 . 0 0 "[ . 1 . 2]" 1 429 1 54 ASN H 1 59 THR HA . . 3.920 3.321 3.168 3.423 . 0 0 "[ . 1 . 2]" 1 430 1 237 ILE HA 1 239 LEU H . . 4.170 3.888 3.770 4.186 0.016 3 0 "[ . 1 . 2]" 1 431 1 163 ARG HA 1 239 LEU H . . 4.290 2.625 2.316 2.869 . 0 0 "[ . 1 . 2]" 1 432 1 239 LEU H 1 239 LEU HB3 . . 3.350 3.715 3.671 3.759 0.409 3 0 "[ . 1 . 2]" 1 433 1 239 LEU H 1 239 LEU HB2 . . 3.330 2.567 2.491 2.640 . 0 0 "[ . 1 . 2]" 1 434 1 239 LEU H 1 239 LEU MD2 . . 3.320 3.673 3.610 3.739 0.419 3 0 "[ . 1 . 2]" 1 435 1 34 ILE MG 1 239 LEU H . . 3.620 3.579 3.260 3.803 0.183 6 0 "[ . 1 . 2]" 1 436 1 164 TYR HA 1 239 LEU H . . 4.670 4.073 3.848 4.323 . 0 0 "[ . 1 . 2]" 1 437 1 192 TRP HE1 1 239 LEU H . . 3.980 3.369 3.082 3.750 . 0 0 "[ . 1 . 2]" 1 438 1 65 ASP H 1 71 VAL HA . . 4.470 3.435 3.313 3.574 . 0 0 "[ . 1 . 2]" 1 439 1 65 ASP H 1 65 ASP HB2 . . 3.830 2.686 2.606 2.843 . 0 0 "[ . 1 . 2]" 1 440 1 65 ASP H 1 65 ASP HB3 . . 3.650 2.483 2.360 2.555 . 0 0 "[ . 1 . 2]" 1 441 1 64 ILE MG 1 65 ASP H . . 2.920 2.670 2.578 2.713 . 0 0 "[ . 1 . 2]" 1 442 1 27 TYR HB3 1 28 GLU H . . 4.340 3.959 3.839 4.037 . 0 0 "[ . 1 . 2]" 1 443 1 28 GLU H 1 28 GLU HG2 . . 4.180 1.968 1.852 2.411 . 0 0 "[ . 1 . 2]" 1 444 1 28 GLU H 1 38 ARG QB . . 4.650 4.069 2.887 4.705 0.055 2 0 "[ . 1 . 2]" 1 445 1 28 GLU H 1 29 ARG H . . 3.330 2.322 2.273 2.382 . 0 0 "[ . 1 . 2]" 1 446 1 27 TYR QD 1 28 GLU H . . 4.330 4.103 3.820 4.310 . 0 0 "[ . 1 . 2]" 1 447 1 27 TYR HA 1 28 GLU H . . 3.810 2.121 2.072 2.157 . 0 0 "[ . 1 . 2]" 1 448 1 194 ALA HA 1 197 LYS H . . 4.230 3.899 3.738 4.036 . 0 0 "[ . 1 . 2]" 1 449 1 197 LYS H 1 197 LYS HB2 . . 3.260 2.360 2.247 2.475 . 0 0 "[ . 1 . 2]" 1 450 1 197 LYS H 1 197 LYS HB3 . . 3.320 2.569 2.388 2.736 . 0 0 "[ . 1 . 2]" 1 451 1 197 LYS H 1 197 LYS QG . . 3.810 3.927 3.876 3.978 0.168 3 0 "[ . 1 . 2]" 1 452 1 197 LYS H 1 198 GLN H . . 3.740 2.678 2.591 2.787 . 0 0 "[ . 1 . 2]" 1 453 1 4 PHE H 1 51 HIS HB3 . . 4.340 4.397 4.228 4.596 0.256 10 0 "[ . 1 . 2]" 1 454 1 4 PHE H 1 50 ILE MG . . 4.190 3.982 3.842 4.202 0.012 5 0 "[ . 1 . 2]" 1 455 1 4 PHE H 1 4 PHE QD . . 3.870 4.327 4.296 4.372 0.502 2 1 "[ + . 1 . 2]" 1 456 1 4 PHE H 1 52 LEU HA . . 3.910 2.792 2.728 2.875 . 0 0 "[ . 1 . 2]" 1 457 1 4 PHE H 1 51 HIS H . . 4.100 4.241 3.802 4.382 0.282 15 0 "[ . 1 . 2]" 1 458 1 35 PRO HA 1 36 LEU H . . 3.700 2.118 2.095 2.146 . 0 0 "[ . 1 . 2]" 1 459 1 36 LEU H 1 36 LEU HB3 . . 3.850 2.510 2.394 3.505 . 0 0 "[ . 1 . 2]" 1 460 1 36 LEU H 1 36 LEU HG . . 3.980 4.386 4.014 4.552 0.572 20 4 "[ . ** .- +]" 1 461 1 30 LYS HG2 1 36 LEU H . . 4.510 4.998 4.835 5.294 0.784 12 6 "[ * * 1 + * * -]" 1 462 1 29 ARG H 1 36 LEU H . . 4.660 3.415 3.193 3.545 . 0 0 "[ . 1 . 2]" 1 463 1 27 TYR QD 1 36 LEU H . . 4.700 3.519 3.027 3.878 . 0 0 "[ . 1 . 2]" 1 464 1 136 ILE H 1 137 THR HB . . 4.400 4.746 4.691 4.810 0.410 4 0 "[ . 1 . 2]" 1 465 1 135 ALA HA 1 136 ILE H . . 4.040 3.518 3.513 3.523 . 0 0 "[ . 1 . 2]" 1 466 1 133 ASP HA 1 136 ILE H . . 4.300 3.596 3.531 3.676 . 0 0 "[ . 1 . 2]" 1 467 1 135 ALA MB 1 136 ILE H . . 3.480 2.325 2.268 2.411 . 0 0 "[ . 1 . 2]" 1 468 1 136 ILE H 1 136 ILE MG . . 3.490 3.699 3.615 3.720 0.230 18 0 "[ . 1 . 2]" 1 469 1 41 LEU H 1 42 PRO QD . . 4.590 4.116 4.048 4.197 . 0 0 "[ . 1 . 2]" 1 470 1 41 LEU H 1 46 ARG QD . . 4.230 4.302 3.730 4.876 0.646 15 1 "[ . 1 + 2]" 1 471 1 41 LEU H 1 41 LEU QB . . 3.670 2.802 2.754 2.838 . 0 0 "[ . 1 . 2]" 1 472 1 41 LEU H 1 41 LEU QD . . 3.590 3.747 3.719 3.840 0.250 6 0 "[ . 1 . 2]" 1 473 1 41 LEU H 1 41 LEU HG . . 3.880 3.700 3.589 3.818 . 0 0 "[ . 1 . 2]" 1 474 1 140 PHE H 1 140 PHE QB . . 3.400 2.251 2.231 2.270 . 0 0 "[ . 1 . 2]" 1 475 1 139 LEU QB 1 140 PHE H . . 3.750 2.552 2.479 2.590 . 0 0 "[ . 1 . 2]" 1 476 1 60 ILE MG 1 140 PHE H . . 3.500 3.261 3.172 3.367 . 0 0 "[ . 1 . 2]" 1 477 1 136 ILE MG 1 140 PHE H . . 3.840 3.829 3.638 3.941 0.101 18 0 "[ . 1 . 2]" 1 478 1 139 LEU MD2 1 140 PHE H . . 4.320 4.559 4.541 4.571 0.251 9 0 "[ . 1 . 2]" 1 479 1 139 LEU HG 1 140 PHE H . . 4.740 4.490 4.457 4.529 . 0 0 "[ . 1 . 2]" 1 480 1 139 LEU H 1 140 PHE H . . 3.770 2.817 2.791 2.845 . 0 0 "[ . 1 . 2]" 1 481 1 140 PHE H 1 140 PHE QD . . 4.120 4.184 4.161 4.200 0.080 1 0 "[ . 1 . 2]" 1 482 1 73 GLY HA3 1 83 PHE H . . 4.250 3.541 3.402 3.671 . 0 0 "[ . 1 . 2]" 1 483 1 83 PHE H 1 83 PHE HB3 . . 3.620 3.569 3.562 3.574 . 0 0 "[ . 1 . 2]" 1 484 1 83 PHE H 1 83 PHE HB2 . . 3.770 2.412 2.363 2.473 . 0 0 "[ . 1 . 2]" 1 485 1 82 PHE QB 1 83 PHE H . . 3.970 2.867 2.776 2.949 . 0 0 "[ . 1 . 2]" 1 486 1 83 PHE H 1 88 ALA MB . . 3.220 2.237 2.129 2.333 . 0 0 "[ . 1 . 2]" 1 487 1 83 PHE H 1 105 LEU HB2 . . 4.540 4.193 4.005 4.619 0.079 2 0 "[ . 1 . 2]" 1 488 1 83 PHE H 1 83 PHE QD . . 3.780 2.893 2.805 2.968 . 0 0 "[ . 1 . 2]" 1 489 1 82 PHE HA 1 83 PHE H . . 3.270 2.177 2.141 2.226 . 0 0 "[ . 1 . 2]" 1 490 1 190 ASN HA 1 191 SER H . . 3.830 3.525 3.495 3.545 . 0 0 "[ . 1 . 2]" 1 491 1 191 SER H 1 191 SER HB2 . . 3.520 2.647 2.378 3.567 0.047 11 0 "[ . 1 . 2]" 1 492 1 191 SER H 1 191 SER HB3 . . 3.400 3.362 2.526 3.571 0.171 10 0 "[ . 1 . 2]" 1 493 1 190 ASN HB2 1 191 SER H . . 4.070 3.448 2.528 3.935 . 0 0 "[ . 1 . 2]" 1 494 1 190 ASN HB3 1 191 SER H . . 4.060 2.944 2.525 3.653 . 0 0 "[ . 1 . 2]" 1 495 1 116 ILE H 1 116 ILE HG13 . . 3.220 2.208 2.125 2.271 . 0 0 "[ . 1 . 2]" 1 496 1 115 GLN H 1 116 ILE H . . 3.840 2.621 2.546 2.665 . 0 0 "[ . 1 . 2]" 1 497 1 116 ILE H 1 118 ALA H . . 4.500 3.988 3.916 4.059 . 0 0 "[ . 1 . 2]" 1 498 1 116 ILE H 1 117 ALA H . . 3.250 2.696 2.672 2.721 . 0 0 "[ . 1 . 2]" 1 499 1 214 VAL HA 1 215 LEU H . . 3.830 2.100 2.087 2.114 . 0 0 "[ . 1 . 2]" 1 500 1 214 VAL HB 1 215 LEU H . . 4.410 4.279 4.237 4.307 . 0 0 "[ . 1 . 2]" 1 501 1 115 GLN HA 1 118 ALA H . . 3.570 3.535 3.390 3.648 0.078 5 0 "[ . 1 . 2]" 1 502 1 118 ALA H 1 148 ALA MB . . 3.220 2.602 2.548 2.692 . 0 0 "[ . 1 . 2]" 1 503 1 116 ILE MG 1 118 ALA H . . 4.430 4.835 4.786 4.895 0.465 13 0 "[ . 1 . 2]" 1 504 1 205 ASN HD21 1 208 GLN HB3 . . 4.240 3.631 3.163 4.151 . 0 0 "[ . 1 . 2]" 1 505 1 56 ALA HA 1 58 GLU H . . 4.190 4.378 4.347 4.410 0.220 10 0 "[ . 1 . 2]" 1 506 1 57 ASP HA 1 58 GLU H . . 3.410 3.086 3.056 3.126 . 0 0 "[ . 1 . 2]" 1 507 1 57 ASP HB3 1 58 GLU H . . 4.300 3.764 3.714 3.801 . 0 0 "[ . 1 . 2]" 1 508 1 57 ASP HB2 1 58 GLU H . . 4.000 4.370 4.334 4.409 0.409 15 0 "[ . 1 . 2]" 1 509 1 58 GLU H 1 58 GLU HG3 . . 3.510 2.826 1.822 3.384 . 0 0 "[ . 1 . 2]" 1 510 1 58 GLU H 1 58 GLU HG2 . . 3.260 2.210 1.803 2.896 . 0 0 "[ . 1 . 2]" 1 511 1 53 THR MG 1 58 GLU H . . 3.210 3.243 3.158 3.351 0.141 8 0 "[ . 1 . 2]" 1 512 1 58 GLU H 1 136 ILE MG . . 4.610 4.249 4.117 4.424 . 0 0 "[ . 1 . 2]" 1 513 1 58 GLU H 1 58 GLU HB3 . . 3.620 3.591 3.574 3.599 . 0 0 "[ . 1 . 2]" 1 514 1 53 THR HA 1 58 GLU H . . 4.560 4.418 4.343 4.519 . 0 0 "[ . 1 . 2]" 1 515 1 166 PHE HA 1 169 GLN H . . 4.010 3.702 3.553 3.854 . 0 0 "[ . 1 . 2]" 1 516 1 168 GLU HA 1 169 GLN H . . 4.290 3.533 3.486 3.542 . 0 0 "[ . 1 . 2]" 1 517 1 169 GLN H 1 169 GLN HG3 . . 3.410 2.126 2.016 2.282 . 0 0 "[ . 1 . 2]" 1 518 1 169 GLN H 1 169 GLN HB2 . . 3.470 2.447 2.398 2.523 . 0 0 "[ . 1 . 2]" 1 519 1 169 GLN H 1 169 GLN HB3 . . 3.460 3.561 3.549 3.581 0.121 14 0 "[ . 1 . 2]" 1 520 1 161 ALA MB 1 169 GLN H . . 4.310 4.635 4.619 4.677 0.367 3 0 "[ . 1 . 2]" 1 521 1 66 VAL H 1 66 VAL QG . . 2.900 1.850 1.836 1.865 . 0 0 "[ . 1 . 2]" 1 522 1 65 ASP HA 1 66 VAL H . . 3.710 2.145 2.113 2.169 . 0 0 "[ . 1 . 2]" 1 523 1 210 GLU HA 1 211 THR H . . 3.860 3.406 3.339 3.522 . 0 0 "[ . 1 . 2]" 1 524 1 209 PHE HB2 1 211 THR H . . 4.200 4.322 3.931 5.199 0.999 3 3 "[* + . 1 - . 2]" 1 525 1 211 THR H 1 211 THR MG . . 3.830 3.911 3.777 3.955 0.125 5 0 "[ . 1 . 2]" 1 526 1 201 ILE MD 1 211 THR H . . 4.260 4.321 3.859 4.480 0.220 14 0 "[ . 1 . 2]" 1 527 1 210 GLU H 1 211 THR H . . 3.290 2.295 2.216 2.571 . 0 0 "[ . 1 . 2]" 1 528 1 70 TYR QB 1 71 VAL H . . 4.230 3.467 2.950 3.890 . 0 0 "[ . 1 . 2]" 1 529 1 71 VAL H 1 71 VAL HB . . 3.980 2.463 2.434 2.505 . 0 0 "[ . 1 . 2]" 1 530 1 71 VAL H 1 71 VAL QG . . 3.350 2.261 2.138 2.368 . 0 0 "[ . 1 . 2]" 1 531 1 122 ARG HA 1 124 ASN H . . 3.930 3.851 3.433 4.041 0.111 7 0 "[ . 1 . 2]" 1 532 1 124 ASN H 1 124 ASN HB2 . . 3.450 2.414 2.364 2.462 . 0 0 "[ . 1 . 2]" 1 533 1 124 ASN H 1 124 ASN HB3 . . 3.400 3.635 3.608 3.652 0.252 9 0 "[ . 1 . 2]" 1 534 1 123 GLU QB 1 124 ASN H . . 3.740 2.902 2.812 2.981 . 0 0 "[ . 1 . 2]" 1 535 1 121 ILE MD 1 124 ASN H . . 3.560 3.548 3.421 3.624 0.064 17 0 "[ . 1 . 2]" 1 536 1 152 MET HA 1 156 GLN H . . 4.660 4.022 3.775 4.206 . 0 0 "[ . 1 . 2]" 1 537 1 155 ILE HA 1 156 GLN H . . 4.630 3.555 3.529 3.580 . 0 0 "[ . 1 . 2]" 1 538 1 156 GLN H 1 156 GLN HB2 . . 3.960 2.410 2.167 2.654 . 0 0 "[ . 1 . 2]" 1 539 1 155 ILE HB 1 156 GLN H . . 3.760 2.559 2.400 2.766 . 0 0 "[ . 1 . 2]" 1 540 1 155 ILE MG 1 156 GLN H . . 3.650 3.302 3.004 3.524 . 0 0 "[ . 1 . 2]" 1 541 1 79 THR HB 1 80 SER H . . 4.450 4.275 4.190 4.345 . 0 0 "[ . 1 . 2]" 1 542 1 80 SER H 1 101 ARG QB . . 3.810 4.101 3.060 4.311 0.501 8 1 "[ . + 1 . 2]" 1 543 1 80 SER H 1 99 ALA MB . . 3.000 2.628 2.528 2.756 . 0 0 "[ . 1 . 2]" 1 544 1 79 THR H 1 80 SER H . . 3.910 4.252 4.233 4.280 0.370 3 0 "[ . 1 . 2]" 1 545 1 45 GLN HA 1 46 ARG H . . 3.910 3.366 3.320 3.439 . 0 0 "[ . 1 . 2]" 1 546 1 44 SER HA 1 46 ARG H . . 4.450 4.006 3.907 4.139 . 0 0 "[ . 1 . 2]" 1 547 1 43 GLY QA 1 46 ARG H . . 4.350 3.212 3.144 3.375 . 0 0 "[ . 1 . 2]" 1 548 1 45 GLN QB 1 46 ARG H . . 3.920 3.076 2.924 3.160 . 0 0 "[ . 1 . 2]" 1 549 1 46 ARG H 1 46 ARG QG . . 3.350 3.047 2.679 3.909 0.559 15 3 "[ . 1 +- *]" 1 550 1 45 GLN H 1 46 ARG H . . 2.930 2.173 2.092 2.216 . 0 0 "[ . 1 . 2]" 1 551 1 46 ARG H 1 47 TYR H . . 3.010 2.746 2.616 2.915 . 0 0 "[ . 1 . 2]" 1 552 1 11 SER HA 1 15 GLY H . . 3.550 3.804 3.714 3.888 0.338 11 0 "[ . 1 . 2]" 1 553 1 14 TYR HA 1 15 GLY H . . 3.940 3.552 3.541 3.560 . 0 0 "[ . 1 . 2]" 1 554 1 15 GLY H 1 16 VAL HB . . 4.640 4.820 4.760 4.866 0.226 20 0 "[ . 1 . 2]" 1 555 1 15 GLY H 1 17 PHE H . . 4.630 4.023 3.948 4.094 . 0 0 "[ . 1 . 2]" 1 556 1 14 TYR QD 1 15 GLY H . . 4.530 3.079 2.864 3.345 . 0 0 "[ . 1 . 2]" 1 557 1 15 GLY H 1 16 VAL H . . 3.400 2.821 2.804 2.862 . 0 0 "[ . 1 . 2]" 1 558 1 130 PRO HA 1 132 LEU H . . 4.040 4.517 4.434 4.620 0.580 15 8 "[* * . *-* + **]" 1 559 1 132 LEU H 1 134 SER QB . . 4.380 4.743 4.675 4.815 0.435 3 0 "[ . 1 . 2]" 1 560 1 132 LEU H 1 132 LEU HB3 . . 3.780 3.621 3.612 3.628 . 0 0 "[ . 1 . 2]" 1 561 1 131 ALA MB 1 132 LEU H . . 3.010 2.500 2.445 2.604 . 0 0 "[ . 1 . 2]" 1 562 1 132 LEU H 1 132 LEU HB2 . . 3.940 2.555 2.472 2.590 . 0 0 "[ . 1 . 2]" 1 563 1 132 LEU H 1 132 LEU QD . . 2.700 1.822 1.747 1.876 . 0 0 "[ . 1 . 2]" 1 564 1 6 LEU QD 1 132 LEU H . . 3.680 3.742 3.596 3.897 0.217 19 0 "[ . 1 . 2]" 1 565 1 132 LEU H 1 171 ILE MG . . 4.440 4.733 4.645 4.793 0.353 15 0 "[ . 1 . 2]" 1 566 1 244 ASN H 1 244 ASN HB2 . . 3.650 2.487 2.322 2.715 . 0 0 "[ . 1 . 2]" 1 567 1 244 ASN H 1 244 ASN HB3 . . 3.410 3.161 2.401 3.633 0.223 3 0 "[ . 1 . 2]" 1 568 1 243 ARG HG3 1 244 ASN H . . 4.610 4.228 2.651 5.333 0.723 2 1 "[ + . 1 . 2]" 1 569 1 134 SER HA 1 135 ALA H . . 3.640 3.509 3.498 3.520 . 0 0 "[ . 1 . 2]" 1 570 1 135 ALA H 1 135 ALA HA . . 2.960 2.793 2.789 2.797 . 0 0 "[ . 1 . 2]" 1 571 1 157 SER HA 1 158 THR H . . 3.060 3.198 3.174 3.251 0.191 5 0 "[ . 1 . 2]" 1 572 1 158 THR H 1 158 THR HB . . 3.660 3.832 3.816 3.857 0.197 5 0 "[ . 1 . 2]" 1 573 1 155 ILE HA 1 158 THR H . . 3.960 3.735 3.658 3.808 . 0 0 "[ . 1 . 2]" 1 574 1 158 THR H 1 158 THR MG . . 3.180 3.151 3.102 3.190 0.010 20 0 "[ . 1 . 2]" 1 575 1 214 VAL H 1 214 VAL HB . . 2.940 2.798 2.545 2.894 . 0 0 "[ . 1 . 2]" 1 576 1 194 ALA MB 1 214 VAL H . . 4.440 4.723 4.547 4.966 0.526 18 1 "[ . 1 . + 2]" 1 577 1 127 LEU H 1 180 LEU HA . . 4.140 3.231 2.961 3.775 . 0 0 "[ . 1 . 2]" 1 578 1 126 PRO HB2 1 127 LEU H . . 4.090 3.697 2.997 4.037 . 0 0 "[ . 1 . 2]" 1 579 1 126 PRO HB3 1 127 LEU H . . 3.980 4.059 3.385 4.285 0.305 18 0 "[ . 1 . 2]" 1 580 1 127 LEU H 1 131 ALA MB . . 4.380 4.105 3.616 4.340 . 0 0 "[ . 1 . 2]" 1 581 1 127 LEU H 1 127 LEU HB3 . . 3.770 3.392 3.088 3.666 . 0 0 "[ . 1 . 2]" 1 582 1 127 LEU H 1 179 PHE H . . 3.960 2.639 2.159 2.968 . 0 0 "[ . 1 . 2]" 1 583 1 242 ASN HA 1 243 ARG H . . 2.800 2.152 2.083 2.315 . 0 0 "[ . 1 . 2]" 1 584 1 243 ARG H 1 243 ARG QD . . 4.110 4.006 3.669 4.319 0.209 5 0 "[ . 1 . 2]" 1 585 1 242 ASN HB3 1 243 ARG H . . 3.910 3.255 2.763 3.922 0.012 3 0 "[ . 1 . 2]" 1 586 1 242 ASN HB2 1 243 ARG H . . 3.940 4.008 3.669 4.231 0.291 16 0 "[ . 1 . 2]" 1 587 1 243 ARG H 1 243 ARG HG3 . . 3.030 2.444 1.901 3.723 0.693 2 1 "[ + . 1 . 2]" 1 588 1 36 LEU QD 1 243 ARG H . . 3.470 3.340 2.483 3.635 0.165 8 0 "[ . 1 . 2]" 1 589 1 245 ASN HA 1 245 ASN HD21 . . 3.890 4.248 4.081 4.335 0.445 2 0 "[ . 1 . 2]" 1 590 1 67 THR HB 1 245 ASN HD21 . . 3.680 2.501 2.005 2.726 . 0 0 "[ . 1 . 2]" 1 591 1 39 SER HA 1 245 ASN HD21 . . 3.530 3.462 2.920 3.732 0.202 20 0 "[ . 1 . 2]" 1 592 1 245 ASN HB2 1 245 ASN HD21 . . 3.370 2.388 2.167 2.823 . 0 0 "[ . 1 . 2]" 1 593 1 245 ASN HB3 1 245 ASN HD21 . . 3.120 2.692 2.243 2.968 . 0 0 "[ . 1 . 2]" 1 594 1 67 THR MG 1 245 ASN HD21 . . 4.100 4.035 3.367 4.295 0.195 19 0 "[ . 1 . 2]" 1 595 1 245 ASN H 1 245 ASN HD21 . . 4.470 4.232 3.900 4.751 0.281 7 0 "[ . 1 . 2]" 1 596 1 241 PRO HA 1 242 ASN H . . 4.050 2.232 2.137 2.350 . 0 0 "[ . 1 . 2]" 1 597 1 242 ASN H 1 242 ASN HB3 . . 3.930 3.391 2.620 3.611 . 0 0 "[ . 1 . 2]" 1 598 1 242 ASN H 1 242 ASN HB2 . . 3.990 2.556 2.226 3.390 . 0 0 "[ . 1 . 2]" 1 599 1 241 PRO QB 1 242 ASN H . . 4.490 2.941 2.552 3.513 . 0 0 "[ . 1 . 2]" 1 600 1 95 VAL H 1 95 VAL HA . . 3.120 2.906 2.902 2.909 . 0 0 "[ . 1 . 2]" 1 601 1 92 ALA HA 1 95 VAL H . . 3.480 3.556 3.401 3.635 0.155 2 0 "[ . 1 . 2]" 1 602 1 94 TYR QB 1 95 VAL H . . 3.660 2.502 2.445 2.601 . 0 0 "[ . 1 . 2]" 1 603 1 95 VAL H 1 97 LYS HD3 . . 4.140 4.219 4.130 4.390 0.250 14 0 "[ . 1 . 2]" 1 604 1 95 VAL H 1 95 VAL HB . . 3.460 3.654 3.635 3.668 0.208 19 0 "[ . 1 . 2]" 1 605 1 95 VAL H 1 95 VAL QG . . 2.520 1.848 1.800 1.926 . 0 0 "[ . 1 . 2]" 1 606 1 221 GLN QG 1 222 ARG H . . 3.420 3.833 3.662 4.028 0.608 2 2 "[ + . - 1 . 2]" 1 607 1 222 ARG H 1 222 ARG QG . . 3.550 1.932 1.843 2.028 . 0 0 "[ . 1 . 2]" 1 608 1 221 GLN H 1 222 ARG H . . 3.920 4.320 4.273 4.399 0.479 2 0 "[ . 1 . 2]" 1 609 1 202 ALA HA 1 204 THR H . . 4.050 4.103 4.063 4.140 0.090 20 0 "[ . 1 . 2]" 1 610 1 201 ILE HA 1 204 THR H . . 4.580 3.899 3.751 4.046 . 0 0 "[ . 1 . 2]" 1 611 1 204 THR H 1 205 ASN HB3 . . 4.290 4.486 4.425 4.547 0.257 6 0 "[ . 1 . 2]" 1 612 1 204 THR H 1 205 ASN HB2 . . 4.290 4.018 3.872 4.160 . 0 0 "[ . 1 . 2]" 1 613 1 202 ALA MB 1 204 THR H . . 4.530 4.564 4.525 4.599 0.069 10 0 "[ . 1 . 2]" 1 614 1 204 THR H 1 204 THR MG . . 3.070 2.016 1.937 2.065 . 0 0 "[ . 1 . 2]" 1 615 1 201 ILE MG 1 204 THR H . . 4.700 4.569 4.418 4.695 . 0 0 "[ . 1 . 2]" 1 616 1 152 MET HB2 1 153 VAL H . . 3.900 2.472 2.326 2.684 . 0 0 "[ . 1 . 2]" 1 617 1 153 VAL H 1 153 VAL QG . . 3.050 1.871 1.843 2.015 . 0 0 "[ . 1 . 2]" 1 618 1 153 VAL H 1 154 LEU H . . 3.650 2.648 2.606 2.749 . 0 0 "[ . 1 . 2]" 1 619 1 85 GLU H 1 108 SER HA . . 4.110 2.872 2.472 4.424 0.314 17 0 "[ . 1 . 2]" 1 620 1 83 PHE HB2 1 85 GLU H . . 4.360 3.437 2.897 4.243 . 0 0 "[ . 1 . 2]" 1 621 1 123 GLU H 1 123 GLU HG3 . . 4.260 2.811 2.126 4.270 0.010 18 0 "[ . 1 . 2]" 1 622 1 123 GLU H 1 123 GLU QB . . 3.650 2.335 2.028 2.528 . 0 0 "[ . 1 . 2]" 1 623 1 123 GLU H 1 125 ILE MD . . 4.660 4.826 4.616 4.995 0.335 7 0 "[ . 1 . 2]" 1 624 1 123 GLU H 1 124 ASN H . . 3.800 2.724 2.585 2.828 . 0 0 "[ . 1 . 2]" 1 625 1 224 THR HA 1 225 ILE H . . 4.060 2.163 2.134 2.198 . 0 0 "[ . 1 . 2]" 1 626 1 225 ILE H 1 226 THR MG . . 3.750 4.009 3.916 4.079 0.329 12 0 "[ . 1 . 2]" 1 627 1 225 ILE H 1 225 ILE MG . . 4.070 3.842 3.816 3.864 . 0 0 "[ . 1 . 2]" 1 628 1 67 THR H 1 67 THR MG . . 3.370 2.106 1.939 2.304 . 0 0 "[ . 1 . 2]" 1 629 1 108 SER HA 1 109 GLY H . . 3.530 2.421 2.369 2.474 . 0 0 "[ . 1 . 2]" 1 630 1 108 SER HB2 1 109 GLY H . . 3.470 3.515 3.366 3.663 0.193 3 0 "[ . 1 . 2]" 1 631 1 108 SER H 1 109 GLY H . . 4.560 4.554 4.351 4.591 0.031 20 0 "[ . 1 . 2]" 1 632 1 181 PRO HA 1 182 SER H . . 3.000 2.186 2.165 2.229 . 0 0 "[ . 1 . 2]" 1 633 1 182 SER H 1 185 ILE HG13 . . 4.010 2.774 2.631 2.898 . 0 0 "[ . 1 . 2]" 1 634 1 181 PRO QB 1 182 SER H . . 3.640 3.043 2.966 3.133 . 0 0 "[ . 1 . 2]" 1 635 1 182 SER H 1 185 ILE MD . . 3.290 1.732 1.680 1.882 . 0 0 "[ . 1 . 2]" 1 636 1 182 SER H 1 185 ILE MG . . 4.120 3.705 3.606 3.770 . 0 0 "[ . 1 . 2]" 1 637 1 42 PRO HA 1 43 GLY H . . 3.870 2.195 2.164 2.287 . 0 0 "[ . 1 . 2]" 1 638 1 202 ALA HA 1 205 ASN HD22 . . 4.550 4.780 4.739 4.832 0.282 19 0 "[ . 1 . 2]" 1 639 1 205 ASN HB3 1 205 ASN HD22 . . 3.770 3.457 3.443 3.464 . 0 0 "[ . 1 . 2]" 1 640 1 205 ASN HB2 1 205 ASN HD22 . . 3.840 3.773 3.755 3.793 . 0 0 "[ . 1 . 2]" 1 641 1 205 ASN HD22 1 208 GLN HB3 . . 3.940 3.411 2.846 3.976 0.036 10 0 "[ . 1 . 2]" 1 642 1 201 ILE MG 1 205 ASN HD22 . . 4.550 4.028 3.564 4.354 . 0 0 "[ . 1 . 2]" 1 643 1 143 ASN H 1 143 ASN QB . . 2.890 2.237 2.148 2.293 . 0 0 "[ . 1 . 2]" 1 644 1 143 ASN H 1 147 ALA MB . . 3.770 3.088 2.886 3.389 . 0 0 "[ . 1 . 2]" 1 645 1 138 THR MG 1 143 ASN H . . 3.520 2.749 2.634 2.864 . 0 0 "[ . 1 . 2]" 1 646 1 139 LEU MD2 1 143 ASN H . . 4.590 4.378 4.201 4.520 . 0 0 "[ . 1 . 2]" 1 647 1 141 TYR H 1 143 ASN H . . 4.020 4.298 4.241 4.352 0.332 13 0 "[ . 1 . 2]" 1 648 1 142 TYR H 1 143 ASN H . . 2.960 3.298 3.270 3.337 0.377 13 0 "[ . 1 . 2]" 1 649 1 143 ASN H 1 144 ALA H . . 4.360 4.009 3.883 4.120 . 0 0 "[ . 1 . 2]" 1 650 1 106 PRO HA 1 107 TYR H . . 3.020 3.103 3.051 3.150 0.130 5 0 "[ . 1 . 2]" 1 651 1 105 LEU HA 1 107 TYR H . . 3.920 4.050 4.002 4.102 0.182 9 0 "[ . 1 . 2]" 1 652 1 106 PRO HD3 1 107 TYR H . . 3.730 3.880 3.837 3.941 0.211 9 0 "[ . 1 . 2]" 1 653 1 107 TYR H 1 107 TYR HB2 . . 3.560 3.866 3.846 3.891 0.331 12 0 "[ . 1 . 2]" 1 654 1 107 TYR H 1 107 TYR HB3 . . 3.590 3.666 3.606 3.699 0.109 10 0 "[ . 1 . 2]" 1 655 1 84 ASN HB2 1 107 TYR H . . 3.580 2.704 2.413 3.018 . 0 0 "[ . 1 . 2]" 1 656 1 106 PRO HD2 1 107 TYR H . . 3.610 2.943 2.870 3.022 . 0 0 "[ . 1 . 2]" 1 657 1 84 ASN HB3 1 107 TYR H . . 3.700 3.596 3.436 3.783 0.083 1 0 "[ . 1 . 2]" 1 658 1 105 LEU HB3 1 107 TYR H . . 3.700 2.505 2.343 2.975 . 0 0 "[ . 1 . 2]" 1 659 1 107 TYR H 1 107 TYR HA . . 3.100 2.844 2.836 2.853 . 0 0 "[ . 1 . 2]" 1 660 1 105 LEU H 1 107 TYR H . . 4.360 4.571 4.507 4.656 0.296 1 0 "[ . 1 . 2]" 1 661 1 182 SER HA 1 183 LEU H . . 3.380 2.397 2.301 2.507 . 0 0 "[ . 1 . 2]" 1 662 1 182 SER HB2 1 183 LEU H . . 4.210 3.578 2.356 3.944 . 0 0 "[ . 1 . 2]" 1 663 1 183 LEU H 1 183 LEU HG . . 3.450 3.755 2.145 3.878 0.428 2 0 "[ . 1 . 2]" 1 664 1 183 LEU H 1 183 LEU QB . . 3.740 2.411 2.256 2.482 . 0 0 "[ . 1 . 2]" 1 665 1 183 LEU H 1 183 LEU QD . . 3.280 1.830 1.671 3.013 . 0 0 "[ . 1 . 2]" 1 666 1 177 LYS H 1 177 LYS HA . . 3.120 2.847 2.837 2.864 . 0 0 "[ . 1 . 2]" 1 667 1 174 ARG HA 1 177 LYS H . . 3.820 3.485 3.049 3.660 . 0 0 "[ . 1 . 2]" 1 668 1 130 PRO HD3 1 177 LYS H . . 4.070 3.661 3.350 4.381 0.311 5 0 "[ . 1 . 2]" 1 669 1 176 ASP HB2 1 177 LYS H . . 3.940 3.376 2.904 3.831 . 0 0 "[ . 1 . 2]" 1 670 1 176 ASP HB3 1 177 LYS H . . 3.790 4.042 3.779 4.212 0.422 19 0 "[ . 1 . 2]" 1 671 1 177 LYS H 1 177 LYS QD . . 3.380 2.672 2.185 3.538 0.158 5 0 "[ . 1 . 2]" 1 672 1 176 ASP H 1 177 LYS H . . 2.800 2.342 2.064 2.531 . 0 0 "[ . 1 . 2]" 1 673 1 146 SER HA 1 147 ALA H . . 3.670 3.373 3.323 3.412 . 0 0 "[ . 1 . 2]" 1 674 1 145 ASN HA 1 147 ALA H . . 4.620 4.575 4.000 4.831 0.211 19 0 "[ . 1 . 2]" 1 675 1 144 ALA HA 1 147 ALA H . . 4.120 3.123 2.909 3.478 . 0 0 "[ . 1 . 2]" 1 676 1 147 ALA H 1 147 ALA MB . . 2.510 2.199 2.179 2.213 . 0 0 "[ . 1 . 2]" 1 677 1 147 ALA H 1 148 ALA MB . . 4.070 4.351 4.286 4.425 0.355 12 0 "[ . 1 . 2]" 1 678 1 138 THR MG 1 147 ALA H . . 3.900 3.250 3.027 3.476 . 0 0 "[ . 1 . 2]" 1 679 1 139 LEU MD2 1 147 ALA H . . 4.530 4.543 4.406 4.721 0.191 19 0 "[ . 1 . 2]" 1 680 1 147 ALA H 1 148 ALA H . . 3.160 2.722 2.635 2.797 . 0 0 "[ . 1 . 2]" 1 681 1 143 ASN HA 1 144 ALA H . . 3.260 2.242 2.195 2.293 . 0 0 "[ . 1 . 2]" 1 682 1 143 ASN QB 1 144 ALA H . . 4.640 3.781 3.725 3.823 . 0 0 "[ . 1 . 2]" 1 683 1 108 SER H 1 108 SER HB2 . . 3.710 2.540 2.473 2.896 . 0 0 "[ . 1 . 2]" 1 684 1 107 TYR HB2 1 108 SER H . . 3.480 2.663 1.712 2.813 . 0 0 "[ . 1 . 2]" 1 685 1 107 TYR HB3 1 108 SER H . . 3.480 3.622 3.278 3.723 0.243 12 0 "[ . 1 . 2]" 1 686 1 108 SER H 1 113 ARG QB . . 3.480 2.297 2.114 2.582 . 0 0 "[ . 1 . 2]" 1 687 1 107 TYR QD 1 108 SER H . . 3.830 3.978 2.734 4.126 0.296 13 0 "[ . 1 . 2]" 1 688 1 107 TYR H 1 108 SER H . . 4.090 4.209 4.179 4.247 0.157 11 0 "[ . 1 . 2]" 1 689 1 45 GLN HA 1 45 GLN HE21 . . 4.310 4.259 4.061 4.445 0.135 7 0 "[ . 1 . 2]" 1 690 1 41 LEU HG 1 45 GLN HE21 . . 4.640 4.887 4.669 5.036 0.396 14 0 "[ . 1 . 2]" 1 691 1 45 GLN H 1 45 GLN HE21 . . 4.680 4.582 4.168 4.846 0.166 16 0 "[ . 1 . 2]" 1 692 1 47 TYR HB3 1 48 ALA H . . 3.570 2.865 2.751 3.848 0.278 5 0 "[ . 1 . 2]" 1 693 1 48 ALA H 1 64 ILE QG . . 4.180 4.119 4.025 4.809 0.629 5 1 "[ + 1 . 2]" 1 694 1 48 ALA H 1 48 ALA MB . . 3.190 2.637 2.614 2.668 . 0 0 "[ . 1 . 2]" 1 695 1 48 ALA H 1 66 VAL QG . . 3.200 2.778 2.664 2.907 . 0 0 "[ . 1 . 2]" 1 696 1 48 ALA H 1 49 LEU H . . 4.590 4.191 4.113 4.226 . 0 0 "[ . 1 . 2]" 1 697 1 47 TYR H 1 48 ALA H . . 4.350 4.343 4.310 4.394 0.044 5 0 "[ . 1 . 2]" 1 698 1 48 ALA H 1 63 ALA HA . . 4.260 4.192 4.051 4.421 0.161 5 0 "[ . 1 . 2]" 1 699 1 48 ALA H 1 65 ASP HA . . 4.590 4.119 4.020 4.259 . 0 0 "[ . 1 . 2]" 1 700 1 97 LYS HA 1 98 ASP H . . 3.790 3.480 3.459 3.509 . 0 0 "[ . 1 . 2]" 1 701 1 98 ASP H 1 98 ASP HB3 . . 3.590 2.425 2.341 2.556 . 0 0 "[ . 1 . 2]" 1 702 1 98 ASP H 1 98 ASP HB2 . . 3.580 2.624 2.521 2.688 . 0 0 "[ . 1 . 2]" 1 703 1 97 LYS HB2 1 98 ASP H . . 4.070 2.641 2.563 2.702 . 0 0 "[ . 1 . 2]" 1 704 1 98 ASP H 1 99 ALA H . . 2.900 2.370 2.349 2.404 . 0 0 "[ . 1 . 2]" 1 705 1 168 GLU H 1 169 GLN HG3 . . 4.430 4.539 4.237 4.666 0.236 3 0 "[ . 1 . 2]" 1 706 1 167 ILE HB 1 168 GLU H . . 4.210 2.539 2.476 2.609 . 0 0 "[ . 1 . 2]" 1 707 1 168 GLU H 1 168 GLU QG . . 4.390 3.839 2.526 3.925 . 0 0 "[ . 1 . 2]" 1 708 1 161 ALA MB 1 168 GLU H . . 4.540 3.124 3.027 3.205 . 0 0 "[ . 1 . 2]" 1 709 1 167 ILE MG 1 168 GLU H . . 4.470 3.509 3.372 3.600 . 0 0 "[ . 1 . 2]" 1 710 1 167 ILE H 1 168 GLU H . . 4.130 2.585 2.505 2.648 . 0 0 "[ . 1 . 2]" 1 711 1 168 GLU H 1 169 GLN H . . 4.150 2.847 2.601 2.894 . 0 0 "[ . 1 . 2]" 1 712 1 28 GLU HA 1 29 ARG H . . 3.900 3.420 3.376 3.458 . 0 0 "[ . 1 . 2]" 1 713 1 27 TYR HB3 1 29 ARG H . . 4.160 4.491 4.353 4.643 0.483 13 0 "[ . 1 . 2]" 1 714 1 29 ARG H 1 29 ARG QB . . 3.270 3.269 3.227 3.342 0.072 6 0 "[ . 1 . 2]" 1 715 1 29 ARG H 1 36 LEU HB3 . . 3.200 2.709 2.521 3.389 0.189 12 0 "[ . 1 . 2]" 1 716 1 29 ARG H 1 29 ARG HG2 . . 3.730 3.151 2.766 3.715 . 0 0 "[ . 1 . 2]" 1 717 1 29 ARG H 1 29 ARG HG3 . . 3.740 3.216 2.672 3.585 . 0 0 "[ . 1 . 2]" 1 718 1 29 ARG H 1 36 LEU HB2 . . 4.180 4.227 2.288 4.469 0.289 13 0 "[ . 1 . 2]" 1 719 1 27 TYR QD 1 29 ARG H . . 3.400 2.902 2.537 3.286 . 0 0 "[ . 1 . 2]" 1 720 1 27 TYR HA 1 29 ARG H . . 4.160 3.813 3.694 3.933 . 0 0 "[ . 1 . 2]" 1 721 1 169 GLN QE 1 169 GLN HG3 . . 3.450 2.257 2.172 2.839 . 0 0 "[ . 1 . 2]" 1 722 1 84 ASN HD21 1 104 THR MG . . 4.650 2.731 2.014 4.853 0.203 18 0 "[ . 1 . 2]" 1 723 1 229 ASP HA 1 230 ALA H . . 4.380 3.342 3.240 3.424 . 0 0 "[ . 1 . 2]" 1 724 1 229 ASP HB3 1 230 ALA H . . 3.580 3.252 2.997 3.552 . 0 0 "[ . 1 . 2]" 1 725 1 229 ASP HB2 1 230 ALA H . . 4.160 4.177 4.041 4.298 0.138 16 0 "[ . 1 . 2]" 1 726 1 230 ALA H 1 230 ALA MB . . 3.020 2.227 2.205 2.251 . 0 0 "[ . 1 . 2]" 1 727 1 229 ASP H 1 230 ALA H . . 3.120 2.271 2.205 2.422 . 0 0 "[ . 1 . 2]" 1 728 1 20 ASN HA 1 23 LYS H . . 3.820 3.112 3.044 3.252 . 0 0 "[ . 1 . 2]" 1 729 1 23 LYS H 1 23 LYS HA . . 3.130 2.836 2.826 2.844 . 0 0 "[ . 1 . 2]" 1 730 1 22 ARG HA 1 23 LYS H . . 4.210 3.473 3.452 3.483 . 0 0 "[ . 1 . 2]" 1 731 1 23 LYS H 1 23 LYS HG3 . . 3.090 2.377 2.293 2.437 . 0 0 "[ . 1 . 2]" 1 732 1 2 VAL MG2 1 23 LYS H . . 4.290 4.576 4.516 4.650 0.360 1 0 "[ . 1 . 2]" 1 733 1 21 LEU QD 1 23 LYS H . . 4.740 4.881 4.847 4.914 0.174 5 0 "[ . 1 . 2]" 1 734 1 23 LYS H 1 25 LEU H . . 4.380 4.098 4.023 4.399 0.019 2 0 "[ . 1 . 2]" 1 735 1 158 THR HA 1 159 SER H . . 4.110 3.525 3.514 3.548 . 0 0 "[ . 1 . 2]" 1 736 1 158 THR HB 1 159 SER H . . 3.350 2.711 2.637 2.778 . 0 0 "[ . 1 . 2]" 1 737 1 159 SER H 1 159 SER HB2 . . 3.510 2.718 2.378 3.549 0.039 4 0 "[ . 1 . 2]" 1 738 1 71 VAL QG 1 159 SER H . . 3.460 3.551 3.351 3.777 0.317 5 0 "[ . 1 . 2]" 1 739 1 158 THR H 1 159 SER H . . 3.460 2.686 2.597 2.770 . 0 0 "[ . 1 . 2]" 1 740 1 78 ASP HA 1 100 LYS H . . 4.130 2.835 2.673 2.934 . 0 0 "[ . 1 . 2]" 1 741 1 78 ASP HB2 1 100 LYS H . . 3.290 2.251 1.796 3.450 0.160 13 0 "[ . 1 . 2]" 1 742 1 100 LYS H 1 100 LYS HB3 . . 3.180 3.546 3.535 3.556 0.376 3 0 "[ . 1 . 2]" 1 743 1 100 LYS H 1 100 LYS HG3 . . 3.220 3.522 3.421 3.576 0.356 15 0 "[ . 1 . 2]" 1 744 1 100 LYS H 1 100 LYS HG2 . . 3.460 2.170 2.054 2.249 . 0 0 "[ . 1 . 2]" 1 745 1 99 ALA MB 1 100 LYS H . . 3.030 3.025 2.980 3.070 0.040 2 0 "[ . 1 . 2]" 1 746 1 79 THR HA 1 100 LYS H . . 4.510 4.460 4.345 4.546 0.036 12 0 "[ . 1 . 2]" 1 747 1 246 MET H 1 246 MET HA . . 3.010 2.893 2.887 2.899 . 0 0 "[ . 1 . 2]" 1 748 1 243 ARG HA 1 246 MET H . . 4.050 3.233 2.933 3.403 . 0 0 "[ . 1 . 2]" 1 749 1 245 ASN HB2 1 246 MET H . . 4.150 2.882 2.477 3.366 . 0 0 "[ . 1 . 2]" 1 750 1 245 ASN HB3 1 246 MET H . . 3.920 3.616 3.133 4.012 0.092 8 0 "[ . 1 . 2]" 1 751 1 246 MET H 1 246 MET HB3 . . 3.260 3.589 3.555 3.625 0.365 9 0 "[ . 1 . 2]" 1 752 1 246 MET H 1 246 MET HB2 . . 2.790 2.388 2.324 2.517 . 0 0 "[ . 1 . 2]" 1 753 1 243 ARG H 1 246 MET H . . 4.750 4.800 4.602 5.088 0.338 15 0 "[ . 1 . 2]" 1 754 1 103 VAL HB 1 104 THR H . . 4.000 4.304 4.280 4.328 0.328 19 0 "[ . 1 . 2]" 1 755 1 104 THR H 1 104 THR MG . . 3.320 3.779 3.760 3.790 0.470 19 0 "[ . 1 . 2]" 1 756 1 103 VAL MG1 1 104 THR H . . 2.960 2.942 2.864 3.019 0.059 19 0 "[ . 1 . 2]" 1 757 1 197 LYS HA 1 200 GLN H . . 4.280 3.648 3.437 3.822 . 0 0 "[ . 1 . 2]" 1 758 1 200 GLN H 1 200 GLN HB2 . . 3.740 2.408 2.200 2.563 . 0 0 "[ . 1 . 2]" 1 759 1 200 GLN H 1 200 GLN HB3 . . 3.310 3.539 3.497 3.569 0.259 3 0 "[ . 1 . 2]" 1 760 1 199 ILE HB 1 200 GLN H . . 3.870 2.698 2.552 2.900 . 0 0 "[ . 1 . 2]" 1 761 1 199 ILE MG 1 200 GLN H . . 3.710 3.066 2.811 3.329 . 0 0 "[ . 1 . 2]" 1 762 1 31 LEU QD 1 200 GLN H . . 3.620 3.670 3.375 4.030 0.410 17 0 "[ . 1 . 2]" 1 763 1 200 GLN H 1 201 ILE H . . 4.120 2.760 2.713 2.822 . 0 0 "[ . 1 . 2]" 1 764 1 244 ASN HB2 1 244 ASN HD21 . . 3.440 2.861 2.212 3.444 0.004 20 0 "[ . 1 . 2]" 1 765 1 244 ASN HB3 1 244 ASN HD21 . . 3.290 2.379 2.170 3.452 0.162 15 0 "[ . 1 . 2]" 1 766 1 214 VAL HA 1 223 VAL H . . 4.640 4.295 3.970 4.672 0.032 7 0 "[ . 1 . 2]" 1 767 1 71 VAL HA 1 72 MET H . . 3.600 2.180 2.162 2.197 . 0 0 "[ . 1 . 2]" 1 768 1 223 VAL H 1 223 VAL HB . . 3.760 3.822 3.718 3.886 0.126 13 0 "[ . 1 . 2]" 1 769 1 222 ARG HB3 1 223 VAL H . . 3.590 3.249 2.881 3.759 0.169 2 0 "[ . 1 . 2]" 1 770 1 71 VAL QG 1 72 MET H . . 3.530 2.346 2.270 2.424 . 0 0 "[ . 1 . 2]" 1 771 1 223 VAL H 1 223 VAL MG1 . . 2.960 2.832 2.587 2.977 0.017 13 0 "[ . 1 . 2]" 1 772 1 215 LEU H 1 223 VAL H . . 4.360 3.148 2.973 3.430 . 0 0 "[ . 1 . 2]" 1 773 1 222 ARG H 1 223 VAL H . . 4.100 4.479 4.359 4.560 0.460 13 0 "[ . 1 . 2]" 1 774 1 64 ILE HA 1 72 MET H . . 3.910 3.132 2.790 3.281 . 0 0 "[ . 1 . 2]" 1 775 1 158 THR HA 1 161 ALA H . . 4.580 4.149 4.008 4.255 . 0 0 "[ . 1 . 2]" 1 776 1 161 ALA H 1 167 ILE MD . . 3.820 4.056 3.938 4.143 0.323 4 0 "[ . 1 . 2]" 1 777 1 161 ALA H 1 171 ILE MD . . 3.530 3.757 3.545 3.850 0.320 20 0 "[ . 1 . 2]" 1 778 1 160 GLU H 1 161 ALA H . . 3.480 2.695 2.606 2.811 . 0 0 "[ . 1 . 2]" 1 779 1 158 THR H 1 161 ALA H . . 4.270 3.510 3.401 3.600 . 0 0 "[ . 1 . 2]" 1 780 1 21 LEU H 1 23 LYS QB . . 4.290 4.575 4.529 4.608 0.318 20 0 "[ . 1 . 2]" 1 781 1 2 VAL MG1 1 21 LEU H . . 3.380 2.999 2.918 3.082 . 0 0 "[ . 1 . 2]" 1 782 1 21 LEU H 1 21 LEU HB3 . . 3.370 2.411 2.383 2.448 . 0 0 "[ . 1 . 2]" 1 783 1 31 LEU HA 1 32 TYR H . . 2.990 2.049 2.033 2.104 . 0 0 "[ . 1 . 2]" 1 784 1 32 TYR H 1 32 TYR HA . . 3.140 2.251 2.239 2.260 . 0 0 "[ . 1 . 2]" 1 785 1 32 TYR H 1 32 TYR HB2 . . 4.140 3.537 3.316 3.589 . 0 0 "[ . 1 . 2]" 1 786 1 31 LEU QB 1 32 TYR H . . 3.960 3.313 3.241 3.458 . 0 0 "[ . 1 . 2]" 1 787 1 137 THR H 1 137 THR HB . . 3.220 2.460 2.368 2.513 . 0 0 "[ . 1 . 2]" 1 788 1 133 ASP HA 1 137 THR H . . 4.190 4.104 3.983 4.315 0.125 15 0 "[ . 1 . 2]" 1 789 1 136 ILE HA 1 137 THR H . . 4.700 3.518 3.503 3.547 . 0 0 "[ . 1 . 2]" 1 790 1 136 ILE HB 1 137 THR H . . 3.800 2.496 2.394 2.801 . 0 0 "[ . 1 . 2]" 1 791 1 137 THR H 1 137 THR MG . . 3.500 3.718 3.708 3.728 0.228 15 0 "[ . 1 . 2]" 1 792 1 136 ILE MG 1 137 THR H . . 3.730 3.090 2.915 3.256 . 0 0 "[ . 1 . 2]" 1 793 1 54 ASN HD22 1 137 THR H . . 4.500 4.463 4.206 4.769 0.269 11 0 "[ . 1 . 2]" 1 794 1 112 GLU HA 1 113 ARG H . . 4.000 3.594 3.582 3.602 . 0 0 "[ . 1 . 2]" 1 795 1 113 ARG H 1 113 ARG QD . . 3.830 3.141 2.947 3.350 . 0 0 "[ . 1 . 2]" 1 796 1 110 ASN HB2 1 113 ARG H . . 4.470 3.900 3.773 4.008 . 0 0 "[ . 1 . 2]" 1 797 1 110 ASN HB3 1 113 ARG H . . 4.590 4.751 4.694 4.794 0.204 10 0 "[ . 1 . 2]" 1 798 1 112 GLU HG2 1 113 ARG H . . 4.040 3.281 3.130 3.419 . 0 0 "[ . 1 . 2]" 1 799 1 113 ARG H 1 113 ARG QB . . 2.710 2.457 2.382 2.526 . 0 0 "[ . 1 . 2]" 1 800 1 113 ARG H 1 114 LEU H . . 3.420 2.551 2.527 2.591 . 0 0 "[ . 1 . 2]" 1 801 1 16 VAL HA 1 19 SER H . . 3.750 3.633 3.554 3.764 0.014 18 0 "[ . 1 . 2]" 1 802 1 18 ILE HA 1 19 SER H . . 4.020 3.496 3.490 3.505 . 0 0 "[ . 1 . 2]" 1 803 1 18 ILE HB 1 19 SER H . . 3.640 2.499 2.477 2.520 . 0 0 "[ . 1 . 2]" 1 804 1 18 ILE HG13 1 19 SER H . . 4.420 4.869 4.851 4.883 0.463 12 0 "[ . 1 . 2]" 1 805 1 18 ILE MG 1 19 SER H . . 3.120 3.308 3.262 3.354 0.234 13 0 "[ . 1 . 2]" 1 806 1 18 ILE MD 1 19 SER H . . 4.250 4.492 4.477 4.504 0.254 17 0 "[ . 1 . 2]" 1 807 1 18 ILE H 1 19 SER H . . 3.290 2.541 2.518 2.565 . 0 0 "[ . 1 . 2]" 1 808 1 17 PHE H 1 19 SER H . . 4.380 4.002 3.957 4.103 . 0 0 "[ . 1 . 2]" 1 809 1 68 ASN HB2 1 69 VAL H . . 4.710 4.257 4.127 4.352 . 0 0 "[ . 1 . 2]" 1 810 1 68 ASN H 1 69 VAL H . . 3.430 1.808 1.718 1.890 . 0 0 "[ . 1 . 2]" 1 811 1 67 THR H 1 69 VAL H . . 4.310 3.454 3.293 3.584 . 0 0 "[ . 1 . 2]" 1 812 1 225 ILE HA 1 226 THR H . . 3.210 2.167 2.134 2.185 . 0 0 "[ . 1 . 2]" 1 813 1 226 THR H 1 230 ALA MB . . 4.640 4.575 4.212 4.838 0.198 16 0 "[ . 1 . 2]" 1 814 1 225 ILE MG 1 226 THR H . . 2.870 3.215 3.150 3.318 0.448 7 0 "[ . 1 . 2]" 1 815 1 198 GLN HA 1 199 ILE H . . 4.390 3.533 3.513 3.559 . 0 0 "[ . 1 . 2]" 1 816 1 199 ILE H 1 199 ILE MD . . 3.410 2.946 2.148 3.571 0.161 9 0 "[ . 1 . 2]" 1 817 1 199 ILE H 1 200 GLN H . . 4.330 2.713 2.651 2.804 . 0 0 "[ . 1 . 2]" 1 818 1 198 GLN H 1 199 ILE H . . 4.130 2.627 2.530 2.720 . 0 0 "[ . 1 . 2]" 1 819 1 223 VAL HA 1 224 THR H . . 2.850 2.145 2.084 2.187 . 0 0 "[ . 1 . 2]" 1 820 1 69 VAL HA 1 70 TYR H . . 3.630 3.141 3.051 3.244 . 0 0 "[ . 1 . 2]" 1 821 1 68 ASN HB3 1 70 TYR H . . 4.300 2.664 2.481 2.841 . 0 0 "[ . 1 . 2]" 1 822 1 70 TYR H 1 70 TYR QB . . 2.920 2.143 2.082 2.204 . 0 0 "[ . 1 . 2]" 1 823 1 223 VAL HB 1 224 THR H . . 3.220 3.115 2.976 3.313 0.093 2 0 "[ . 1 . 2]" 1 824 1 64 ILE MG 1 70 TYR H . . 3.360 3.515 3.294 3.608 0.248 15 0 "[ . 1 . 2]" 1 825 1 70 TYR H 1 70 TYR QD . . 3.640 3.748 2.631 4.119 0.479 4 0 "[ . 1 . 2]" 1 826 1 68 ASN H 1 70 TYR H . . 3.610 3.289 3.113 3.571 . 0 0 "[ . 1 . 2]" 1 827 1 69 VAL H 1 70 TYR H . . 3.370 2.673 2.547 2.756 . 0 0 "[ . 1 . 2]" 1 828 1 117 ALA H 1 117 ALA HA . . 3.010 2.809 2.805 2.812 . 0 0 "[ . 1 . 2]" 1 829 1 116 ILE HA 1 117 ALA H . . 3.500 3.552 3.547 3.557 0.057 4 0 "[ . 1 . 2]" 1 830 1 116 ILE HB 1 117 ALA H . . 3.200 2.400 2.343 2.471 . 0 0 "[ . 1 . 2]" 1 831 1 117 ALA H 1 118 ALA H . . 3.200 2.675 2.659 2.710 . 0 0 "[ . 1 . 2]" 1 832 1 229 ASP H 1 230 ALA HA . . 4.490 4.777 4.712 4.819 0.329 2 0 "[ . 1 . 2]" 1 833 1 228 VAL HA 1 229 ASP H . . 4.240 3.175 3.099 3.347 . 0 0 "[ . 1 . 2]" 1 834 1 228 VAL HB 1 229 ASP H . . 4.730 4.303 4.013 4.394 . 0 0 "[ . 1 . 2]" 1 835 1 229 ASP H 1 230 ALA MB . . 3.960 3.935 3.881 4.026 0.066 16 0 "[ . 1 . 2]" 1 836 1 130 PRO HA 1 131 ALA H . . 4.220 3.492 3.472 3.504 . 0 0 "[ . 1 . 2]" 1 837 1 130 PRO HD3 1 131 ALA H . . 4.380 4.062 4.015 4.098 . 0 0 "[ . 1 . 2]" 1 838 1 130 PRO HB2 1 131 ALA H . . 3.980 3.055 2.992 3.105 . 0 0 "[ . 1 . 2]" 1 839 1 131 ALA H 1 131 ALA MB . . 2.840 2.259 2.250 2.273 . 0 0 "[ . 1 . 2]" 1 840 1 131 ALA H 1 132 LEU H . . 3.190 2.499 2.442 2.590 . 0 0 "[ . 1 . 2]" 1 841 1 31 LEU HA 1 33 ASP H . . 3.870 3.305 3.204 3.508 . 0 0 "[ . 1 . 2]" 1 842 1 33 ASP H 1 33 ASP HA . . 2.780 2.258 2.242 2.276 . 0 0 "[ . 1 . 2]" 1 843 1 33 ASP H 1 33 ASP HB3 . . 3.320 3.609 3.549 3.692 0.372 4 0 "[ . 1 . 2]" 1 844 1 33 ASP H 1 33 ASP HB2 . . 3.370 3.327 3.254 3.383 0.013 20 0 "[ . 1 . 2]" 1 845 1 30 LYS HB2 1 33 ASP H . . 4.130 2.876 2.770 2.927 . 0 0 "[ . 1 . 2]" 1 846 1 30 LYS QD 1 33 ASP H . . 3.730 2.814 2.492 3.128 . 0 0 "[ . 1 . 2]" 1 847 1 32 TYR QD 1 33 ASP H . . 4.480 4.735 4.621 4.862 0.382 11 0 "[ . 1 . 2]" 1 848 1 31 LEU H 1 33 ASP H . . 4.310 4.046 3.979 4.103 . 0 0 "[ . 1 . 2]" 1 849 1 137 THR HB 1 138 THR H . . 3.310 2.398 2.323 2.524 . 0 0 "[ . 1 . 2]" 1 850 1 137 THR HA 1 138 THR H . . 4.130 3.554 3.544 3.564 . 0 0 "[ . 1 . 2]" 1 851 1 137 THR MG 1 138 THR H . . 3.120 3.244 3.116 3.339 0.219 4 0 "[ . 1 . 2]" 1 852 1 138 THR H 1 138 THR MG . . 3.620 3.742 3.721 3.753 0.133 12 0 "[ . 1 . 2]" 1 853 1 45 GLN HA 1 47 TYR H . . 4.020 3.266 3.156 3.466 . 0 0 "[ . 1 . 2]" 1 854 1 44 SER HA 1 47 TYR H . . 4.410 4.635 4.153 4.826 0.416 5 0 "[ . 1 . 2]" 1 855 1 46 ARG HA 1 47 TYR H . . 3.870 3.237 3.115 3.298 . 0 0 "[ . 1 . 2]" 1 856 1 45 GLN QB 1 47 TYR H . . 4.750 4.300 4.220 4.374 . 0 0 "[ . 1 . 2]" 1 857 1 47 TYR H 1 66 VAL QG . . 3.580 3.101 3.010 3.196 . 0 0 "[ . 1 . 2]" 1 858 1 46 ARG QB 1 47 TYR H . . 3.660 3.417 3.208 3.592 . 0 0 "[ . 1 . 2]" 1 859 1 47 TYR H 1 65 ASP HA . . 4.480 4.759 4.685 4.828 0.348 15 0 "[ . 1 . 2]" 1 860 1 47 TYR H 1 66 VAL H . . 4.720 4.211 4.104 4.298 . 0 0 "[ . 1 . 2]" 1 861 1 172 GLY HA3 1 174 ARG H . . 4.220 4.495 4.368 4.599 0.379 18 0 "[ . 1 . 2]" 1 862 1 173 LYS HA 1 174 ARG H . . 3.790 3.445 3.399 3.486 . 0 0 "[ . 1 . 2]" 1 863 1 172 GLY HA2 1 174 ARG H . . 4.540 3.935 3.820 4.041 . 0 0 "[ . 1 . 2]" 1 864 1 174 ARG H 1 174 ARG QB . . 3.320 2.243 2.209 2.282 . 0 0 "[ . 1 . 2]" 1 865 1 174 ARG H 1 174 ARG HD2 . . 3.380 2.668 2.451 2.888 . 0 0 "[ . 1 . 2]" 1 866 1 171 ILE MG 1 174 ARG H . . 4.390 4.421 4.343 4.512 0.122 14 0 "[ . 1 . 2]" 1 867 1 128 GLY HA2 1 174 ARG H . . 4.720 3.951 3.789 4.110 . 0 0 "[ . 1 . 2]" 1 868 1 172 GLY H 1 174 ARG H . . 4.610 4.193 4.094 4.287 . 0 0 "[ . 1 . 2]" 1 869 1 95 VAL HB 1 96 PHE H . . 3.350 2.226 2.167 2.281 . 0 0 "[ . 1 . 2]" 1 870 1 49 LEU QD 1 96 PHE H . . 2.870 2.490 2.273 2.988 0.118 18 0 "[ . 1 . 2]" 1 871 1 95 VAL QG 1 96 PHE H . . 3.000 3.042 3.014 3.068 0.068 4 0 "[ . 1 . 2]" 1 872 1 95 VAL H 1 96 PHE H . . 4.290 4.498 4.492 4.509 0.219 4 0 "[ . 1 . 2]" 1 873 1 96 PHE H 1 96 PHE QD . . 4.180 2.770 2.677 2.899 . 0 0 "[ . 1 . 2]" 1 874 1 219 GLN HE22 1 219 GLN QG . . 3.550 3.253 3.182 3.266 . 0 0 "[ . 1 . 2]" 1 875 1 219 GLN HB2 1 219 GLN HE22 . . 4.600 4.427 4.096 5.051 0.451 5 0 "[ . 1 . 2]" 1 876 1 218 ALA MB 1 219 GLN HE22 . . 3.180 2.696 2.256 3.434 0.254 3 0 "[ . 1 . 2]" 1 877 1 42 PRO HA 1 45 GLN H . . 4.330 4.520 4.442 4.670 0.340 4 0 "[ . 1 . 2]" 1 878 1 44 SER HA 1 45 GLN H . . 3.570 3.479 3.449 3.509 . 0 0 "[ . 1 . 2]" 1 879 1 43 GLY QA 1 45 GLN H . . 4.510 3.794 3.732 3.888 . 0 0 "[ . 1 . 2]" 1 880 1 42 PRO QG 1 45 GLN H . . 3.910 4.120 4.001 4.229 0.319 2 0 "[ . 1 . 2]" 1 881 1 42 PRO HB2 1 45 GLN H . . 3.930 2.634 2.490 2.890 . 0 0 "[ . 1 . 2]" 1 882 1 45 GLN H 1 45 GLN QB . . 2.900 2.355 2.264 2.460 . 0 0 "[ . 1 . 2]" 1 883 1 45 GLN H 1 46 ARG QB . . 3.950 3.918 3.683 4.050 0.100 9 0 "[ . 1 . 2]" 1 884 1 44 SER H 1 45 GLN H . . 3.590 2.427 2.369 2.640 . 0 0 "[ . 1 . 2]" 1 885 1 36 LEU HA 1 240 LEU H . . 4.240 3.359 2.925 3.784 . 0 0 "[ . 1 . 2]" 1 886 1 239 LEU HA 1 240 LEU H . . 3.870 2.209 2.130 2.268 . 0 0 "[ . 1 . 2]" 1 887 1 239 LEU HB3 1 240 LEU H . . 3.550 2.887 2.741 3.086 . 0 0 "[ . 1 . 2]" 1 888 1 239 LEU HB2 1 240 LEU H . . 4.070 3.990 3.927 4.099 0.029 18 0 "[ . 1 . 2]" 1 889 1 239 LEU MD2 1 240 LEU H . . 3.330 3.338 3.187 3.512 0.182 6 0 "[ . 1 . 2]" 1 890 1 240 LEU H 1 240 LEU QB . . 3.420 2.466 2.323 3.185 . 0 0 "[ . 1 . 2]" 1 891 1 240 LEU H 1 240 LEU MD1 . . 3.710 4.010 3.195 4.333 0.623 4 2 "[ +- 1 . 2]" 1 892 1 6 LEU HA 1 9 ALA H . . 3.760 3.827 3.686 3.955 0.195 6 0 "[ . 1 . 2]" 1 893 1 9 ALA H 1 55 TYR QE . . 4.550 3.099 2.836 3.424 . 0 0 "[ . 1 . 2]" 1 894 1 8 GLY H 1 9 ALA H . . 3.270 2.466 2.393 2.544 . 0 0 "[ . 1 . 2]" 1 895 1 37 LEU HA 1 38 ARG H . . 4.550 2.325 2.141 2.481 . 0 0 "[ . 1 . 2]" 1 896 1 38 ARG H 1 66 VAL QG . . 4.580 4.280 3.973 4.557 . 0 0 "[ . 1 . 2]" 1 897 1 151 LEU HA 1 154 LEU H . . 3.910 3.487 3.210 3.860 . 0 0 "[ . 1 . 2]" 1 898 1 153 VAL HB 1 154 LEU H . . 3.810 3.959 2.295 4.081 0.271 2 0 "[ . 1 . 2]" 1 899 1 154 LEU H 1 154 LEU HB2 . . 3.810 2.433 2.317 2.489 . 0 0 "[ . 1 . 2]" 1 900 1 154 LEU H 1 154 LEU HB3 . . 3.580 2.600 2.529 2.765 . 0 0 "[ . 1 . 2]" 1 901 1 153 VAL QG 1 154 LEU H . . 3.620 2.269 2.199 3.011 . 0 0 "[ . 1 . 2]" 1 902 1 154 LEU H 1 155 ILE H . . 4.380 2.702 2.580 2.802 . 0 0 "[ . 1 . 2]" 1 903 1 122 ARG HA 1 125 ILE H . . 3.910 3.291 2.838 3.581 . 0 0 "[ . 1 . 2]" 1 904 1 124 ASN HB2 1 125 ILE H . . 4.460 3.633 3.545 3.710 . 0 0 "[ . 1 . 2]" 1 905 1 124 ASN HB3 1 125 ILE H . . 4.330 4.236 4.185 4.307 . 0 0 "[ . 1 . 2]" 1 906 1 125 ILE H 1 125 ILE HB . . 3.420 2.152 2.133 2.175 . 0 0 "[ . 1 . 2]" 1 907 1 125 ILE H 1 125 ILE MG . . 3.030 3.271 3.168 3.381 0.351 5 0 "[ . 1 . 2]" 1 908 1 124 ASN HA 1 125 ILE H . . 3.770 3.212 3.139 3.276 . 0 0 "[ . 1 . 2]" 1 909 1 123 GLU H 1 125 ILE H . . 4.750 4.014 3.885 4.173 . 0 0 "[ . 1 . 2]" 1 910 1 124 ASN H 1 125 ILE H . . 3.150 2.322 2.254 2.390 . 0 0 "[ . 1 . 2]" 1 911 1 167 ILE HA 1 171 ILE H . . 4.270 4.045 3.960 4.142 . 0 0 "[ . 1 . 2]" 1 912 1 171 ILE H 1 171 ILE HG13 . . 3.840 2.161 2.030 2.340 . 0 0 "[ . 1 . 2]" 1 913 1 171 ILE H 1 171 ILE HB . . 3.520 2.409 2.369 2.453 . 0 0 "[ . 1 . 2]" 1 914 1 170 GLN HB2 1 171 ILE H . . 3.710 2.549 2.455 2.665 . 0 0 "[ . 1 . 2]" 1 915 1 171 ILE H 1 171 ILE MD . . 3.070 3.347 3.092 3.456 0.386 14 0 "[ . 1 . 2]" 1 916 1 171 ILE H 1 171 ILE MG . . 3.580 3.739 3.731 3.752 0.172 4 0 "[ . 1 . 2]" 1 917 1 14 TYR QE 1 171 ILE H . . 4.450 4.264 4.028 4.494 0.044 7 0 "[ . 1 . 2]" 1 918 1 169 GLN HB2 1 170 GLN H . . 4.100 2.553 2.355 2.849 . 0 0 "[ . 1 . 2]" 1 919 1 169 GLN HB3 1 170 GLN H . . 4.090 3.559 3.447 3.823 . 0 0 "[ . 1 . 2]" 1 920 1 170 GLN H 1 170 GLN HB2 . . 3.630 2.441 2.364 2.484 . 0 0 "[ . 1 . 2]" 1 921 1 170 GLN H 1 170 GLN HG2 . . 4.190 2.319 2.207 2.522 . 0 0 "[ . 1 . 2]" 1 922 1 170 GLN H 1 185 ILE MD . . 4.730 4.702 4.426 4.921 0.191 16 0 "[ . 1 . 2]" 1 923 1 170 GLN H 1 171 ILE H . . 4.120 2.790 2.634 2.842 . 0 0 "[ . 1 . 2]" 1 924 1 143 ASN HA 1 143 ASN HD22 . . 4.470 4.311 3.569 4.612 0.142 3 0 "[ . 1 . 2]" 1 925 1 141 TYR QD 1 143 ASN HD22 . . 4.710 4.185 3.281 4.777 0.067 6 0 "[ . 1 . 2]" 1 926 1 14 TYR HA 1 18 ILE H . . 4.620 3.939 3.885 3.982 . 0 0 "[ . 1 . 2]" 1 927 1 17 PHE HB3 1 18 ILE H . . 4.420 2.604 2.561 2.662 . 0 0 "[ . 1 . 2]" 1 928 1 18 ILE H 1 18 ILE HB . . 3.680 2.434 2.408 2.452 . 0 0 "[ . 1 . 2]" 1 929 1 18 ILE H 1 18 ILE MG . . 3.710 3.722 3.714 3.733 0.023 6 0 "[ . 1 . 2]" 1 930 1 18 ILE H 1 18 ILE MD . . 3.850 3.123 3.089 3.153 . 0 0 "[ . 1 . 2]" 1 931 1 18 ILE H 1 21 LEU H . . 4.360 4.396 4.352 4.427 0.067 1 0 "[ . 1 . 2]" 1 932 1 18 ILE HA 1 22 ARG H . . 4.640 4.003 3.929 4.083 . 0 0 "[ . 1 . 2]" 1 933 1 22 ARG H 1 22 ARG HB2 . . 3.340 2.537 2.459 3.611 0.271 1 0 "[ . 1 . 2]" 1 934 1 22 ARG H 1 22 ARG HG2 . . 3.770 3.447 1.906 3.580 . 0 0 "[ . 1 . 2]" 1 935 1 22 ARG H 1 162 ALA MB . . 3.950 3.937 3.716 4.099 0.149 11 0 "[ . 1 . 2]" 1 936 1 21 LEU QD 1 22 ARG H . . 4.100 3.825 3.800 3.867 . 0 0 "[ . 1 . 2]" 1 937 1 18 ILE MG 1 22 ARG H . . 4.610 3.827 3.759 3.907 . 0 0 "[ . 1 . 2]" 1 938 1 22 ARG H 1 24 ALA H . . 4.180 4.082 3.972 4.171 . 0 0 "[ . 1 . 2]" 1 939 1 21 LEU H 1 22 ARG H . . 3.610 2.639 2.608 2.692 . 0 0 "[ . 1 . 2]" 1 940 1 217 ASN HA 1 219 GLN H . . 4.410 4.146 4.024 4.305 . 0 0 "[ . 1 . 2]" 1 941 1 219 GLN H 1 219 GLN HA . . 3.140 2.904 2.897 2.913 . 0 0 "[ . 1 . 2]" 1 942 1 218 ALA HA 1 219 GLN H . . 3.780 3.365 3.317 3.408 . 0 0 "[ . 1 . 2]" 1 943 1 219 GLN H 1 219 GLN HB2 . . 3.090 2.455 2.406 2.523 . 0 0 "[ . 1 . 2]" 1 944 1 218 ALA MB 1 219 GLN H . . 3.330 3.165 3.100 3.236 . 0 0 "[ . 1 . 2]" 1 945 1 216 ILE MG 1 219 GLN H . . 3.910 4.207 4.086 4.284 0.374 18 0 "[ . 1 . 2]" 1 946 1 168 GLU HA 1 172 GLY H . . 4.380 3.927 3.595 4.084 . 0 0 "[ . 1 . 2]" 1 947 1 169 GLN HA 1 172 GLY H . . 4.510 3.579 3.291 3.827 . 0 0 "[ . 1 . 2]" 1 948 1 171 ILE HG13 1 172 GLY H . . 4.610 4.189 4.095 4.265 . 0 0 "[ . 1 . 2]" 1 949 1 171 ILE MD 1 172 GLY H . . 4.080 4.297 4.167 4.364 0.284 8 0 "[ . 1 . 2]" 1 950 1 171 ILE MG 1 172 GLY H . . 3.740 3.218 3.172 3.255 . 0 0 "[ . 1 . 2]" 1 951 1 14 TYR QE 1 172 GLY H . . 3.690 2.883 2.632 3.053 . 0 0 "[ . 1 . 2]" 1 952 1 54 ASN HB2 1 56 ALA H . . 3.810 3.018 2.867 3.391 . 0 0 "[ . 1 . 2]" 1 953 1 55 TYR HA 1 56 ALA H . . 3.330 3.450 3.434 3.466 0.136 15 0 "[ . 1 . 2]" 1 954 1 55 TYR HB2 1 56 ALA H . . 3.580 2.916 2.838 3.004 . 0 0 "[ . 1 . 2]" 1 955 1 55 TYR HB3 1 56 ALA H . . 3.530 3.813 3.774 3.843 0.313 12 0 "[ . 1 . 2]" 1 956 1 54 ASN HB3 1 56 ALA H . . 4.110 4.199 4.138 4.299 0.189 2 0 "[ . 1 . 2]" 1 957 1 56 ALA H 1 58 GLU HG3 . . 4.670 4.342 3.459 4.900 0.230 12 0 "[ . 1 . 2]" 1 958 1 54 ASN HD22 1 56 ALA H . . 4.450 3.748 2.790 4.026 . 0 0 "[ . 1 . 2]" 1 959 1 54 ASN HD21 1 56 ALA H . . 4.570 4.124 3.219 4.412 . 0 0 "[ . 1 . 2]" 1 960 1 56 ALA H 1 58 GLU H . . 3.810 3.482 3.418 3.548 . 0 0 "[ . 1 . 2]" 1 961 1 76 ALA H 1 80 SER HA . . 4.000 2.955 2.898 3.080 . 0 0 "[ . 1 . 2]" 1 962 1 75 ARG HD2 1 76 ALA H . . 4.470 4.761 4.733 4.786 0.316 12 0 "[ . 1 . 2]" 1 963 1 76 ALA H 1 76 ALA MB . . 3.520 2.724 2.714 2.736 . 0 0 "[ . 1 . 2]" 1 964 1 75 ARG HG2 1 76 ALA H . . 3.810 2.566 2.484 2.641 . 0 0 "[ . 1 . 2]" 1 965 1 75 ARG QB 1 76 ALA H . . 4.300 3.457 3.435 3.476 . 0 0 "[ . 1 . 2]" 1 966 1 166 PHE HB2 1 167 ILE H . . 4.750 3.774 3.673 3.916 . 0 0 "[ . 1 . 2]" 1 967 1 167 ILE H 1 167 ILE MD . . 4.330 3.521 3.374 3.674 . 0 0 "[ . 1 . 2]" 1 968 1 167 ILE H 1 167 ILE MG . . 4.260 3.755 3.738 3.765 . 0 0 "[ . 1 . 2]" 1 969 1 219 GLN HA 1 220 ASN H . . 3.600 3.173 2.874 3.263 . 0 0 "[ . 1 . 2]" 1 970 1 220 ASN H 1 220 ASN HA . . 2.910 2.255 2.244 2.274 . 0 0 "[ . 1 . 2]" 1 971 1 220 ASN H 1 221 GLN HG2 . . 3.910 3.813 3.608 4.216 0.306 11 0 "[ . 1 . 2]" 1 972 1 219 GLN HB2 1 220 ASN H . . 3.830 3.575 3.387 4.013 0.183 8 0 "[ . 1 . 2]" 1 973 1 218 ALA MB 1 220 ASN H . . 4.130 4.333 4.244 4.388 0.258 7 0 "[ . 1 . 2]" 1 974 1 184 ALA MB 1 220 ASN H . . 4.720 3.800 3.371 4.268 . 0 0 "[ . 1 . 2]" 1 975 1 216 ILE MG 1 220 ASN H . . 3.010 2.957 2.742 3.219 0.209 8 0 "[ . 1 . 2]" 1 976 1 220 ASN H 1 221 GLN H . . 3.000 2.530 2.372 2.987 . 0 0 "[ . 1 . 2]" 1 977 1 219 GLN H 1 220 ASN H . . 2.960 2.355 2.200 2.735 . 0 0 "[ . 1 . 2]" 1 978 1 88 ALA HA 1 89 THR H . . 4.060 3.501 3.479 3.512 . 0 0 "[ . 1 . 2]" 1 979 1 89 THR H 1 89 THR HA . . 3.140 2.807 2.795 2.815 . 0 0 "[ . 1 . 2]" 1 980 1 88 ALA MB 1 89 THR H . . 2.850 2.587 2.478 2.698 . 0 0 "[ . 1 . 2]" 1 981 1 89 THR H 1 89 THR MG . . 2.900 2.689 2.554 2.791 . 0 0 "[ . 1 . 2]" 1 982 1 89 THR H 1 91 ALA MB . . 4.400 4.464 4.346 4.561 0.161 12 0 "[ . 1 . 2]" 1 983 1 89 THR H 1 92 ALA MB . . 4.520 4.591 4.492 4.740 0.220 3 0 "[ . 1 . 2]" 1 984 1 88 ALA H 1 89 THR H . . 2.980 2.456 2.418 2.502 . 0 0 "[ . 1 . 2]" 1 985 1 62 VAL HA 1 73 GLY H . . 4.710 4.789 4.716 4.836 0.126 17 0 "[ . 1 . 2]" 1 986 1 71 VAL HB 1 73 GLY H . . 4.260 4.519 4.431 4.606 0.346 7 0 "[ . 1 . 2]" 1 987 1 72 MET QB 1 73 GLY H . . 4.190 3.019 2.781 3.150 . 0 0 "[ . 1 . 2]" 1 988 1 71 VAL QG 1 73 GLY H . . 2.940 2.044 1.960 2.121 . 0 0 "[ . 1 . 2]" 1 989 1 73 GLY H 1 83 PHE QE . . 4.710 3.739 3.512 3.968 . 0 0 "[ . 1 . 2]" 1 990 1 64 ILE HA 1 73 GLY H . . 4.710 4.802 4.696 4.884 0.174 4 0 "[ . 1 . 2]" 1 991 1 72 MET HA 1 73 GLY H . . 4.040 3.391 3.364 3.429 . 0 0 "[ . 1 . 2]" 1 992 1 72 MET H 1 73 GLY H . . 3.320 1.950 1.912 2.046 . 0 0 "[ . 1 . 2]" 1 993 1 63 ALA H 1 73 GLY H . . 4.100 3.369 3.305 3.425 . 0 0 "[ . 1 . 2]" 1 994 1 59 THR H 1 59 THR HB . . 3.100 2.619 2.534 2.677 . 0 0 "[ . 1 . 2]" 1 995 1 53 THR MG 1 59 THR H . . 4.300 3.603 3.448 3.751 . 0 0 "[ . 1 . 2]" 1 996 1 58 GLU HB3 1 59 THR H . . 4.110 3.742 3.646 3.804 . 0 0 "[ . 1 . 2]" 1 997 1 75 ARG HA 1 81 TYR H . . 3.760 3.082 2.572 3.243 . 0 0 "[ . 1 . 2]" 1 998 1 80 SER HA 1 81 TYR H . . 3.410 2.426 2.109 2.480 . 0 0 "[ . 1 . 2]" 1 999 1 80 SER QB 1 81 TYR H . . 3.930 2.365 2.198 3.214 . 0 0 "[ . 1 . 2]" 1 1000 1 81 TYR H 1 103 VAL HB . . 4.650 4.603 4.475 4.659 0.009 2 0 "[ . 1 . 2]" 1 1001 1 75 ARG HG3 1 81 TYR H . . 4.530 4.973 4.737 5.218 0.688 17 3 "[ * . 1 - . + 2]" 1 1002 1 56 ALA HA 1 57 ASP H . . 3.380 3.269 3.233 3.292 . 0 0 "[ . 1 . 2]" 1 1003 1 57 ASP H 1 57 ASP HB3 . . 3.460 3.677 3.640 3.712 0.252 19 0 "[ . 1 . 2]" 1 1004 1 57 ASP H 1 58 GLU HG2 . . 4.340 4.084 3.551 4.943 0.603 14 2 "[ . - 1 +. 2]" 1 1005 1 53 THR MG 1 57 ASP H . . 2.830 2.825 2.772 2.890 0.060 19 0 "[ . 1 . 2]" 1 1006 1 56 ALA H 1 57 ASP H . . 3.000 2.498 2.480 2.527 . 0 0 "[ . 1 . 2]" 1 1007 1 54 ASN H 1 57 ASP H . . 4.310 3.964 3.907 4.054 . 0 0 "[ . 1 . 2]" 1 1008 1 57 ASP H 1 58 GLU H . . 3.070 2.359 2.311 2.416 . 0 0 "[ . 1 . 2]" 1 1009 1 50 ILE H 1 62 VAL HB . . 4.410 2.923 2.622 3.164 . 0 0 "[ . 1 . 2]" 1 1010 1 50 ILE H 1 50 ILE HB . . 3.590 2.464 2.440 2.531 . 0 0 "[ . 1 . 2]" 1 1011 1 50 ILE H 1 50 ILE HG12 . . 3.450 3.609 3.534 3.650 0.200 11 0 "[ . 1 . 2]" 1 1012 1 50 ILE H 1 50 ILE MG . . 3.570 3.753 3.741 3.775 0.205 5 0 "[ . 1 . 2]" 1 1013 1 50 ILE H 1 62 VAL H . . 3.970 2.618 2.525 2.803 . 0 0 "[ . 1 . 2]" 1 1014 1 83 PHE HA 1 84 ASN H . . 3.520 2.308 2.222 2.364 . 0 0 "[ . 1 . 2]" 1 1015 1 83 PHE HB3 1 84 ASN H . . 4.040 2.528 2.383 2.749 . 0 0 "[ . 1 . 2]" 1 1016 1 84 ASN H 1 84 ASN HB3 . . 3.680 2.499 2.372 2.665 . 0 0 "[ . 1 . 2]" 1 1017 1 84 ASN H 1 85 GLU H . . 3.430 2.659 2.503 3.771 0.341 13 0 "[ . 1 . 2]" 1 1018 1 84 ASN H 1 107 TYR QD . . 4.420 4.442 4.228 4.618 0.198 16 0 "[ . 1 . 2]" 1 1019 1 17 PHE HA 1 20 ASN H . . 4.380 3.392 3.327 3.546 . 0 0 "[ . 1 . 2]" 1 1020 1 20 ASN H 1 20 ASN HA . . 3.130 2.809 2.802 2.813 . 0 0 "[ . 1 . 2]" 1 1021 1 16 VAL HA 1 20 ASN H . . 4.330 3.827 3.757 3.886 . 0 0 "[ . 1 . 2]" 1 1022 1 18 ILE HA 1 20 ASN H . . 4.220 4.410 4.365 4.448 0.228 2 0 "[ . 1 . 2]" 1 1023 1 20 ASN H 1 23 LYS QB . . 4.320 4.627 4.547 4.728 0.408 2 0 "[ . 1 . 2]" 1 1024 1 20 ASN H 1 22 ARG H . . 4.540 4.187 4.145 4.322 . 0 0 "[ . 1 . 2]" 1 1025 1 18 ILE H 1 20 ASN H . . 4.390 4.040 3.987 4.075 . 0 0 "[ . 1 . 2]" 1 1026 1 204 THR HA 1 205 ASN H . . 3.680 3.111 3.087 3.150 . 0 0 "[ . 1 . 2]" 1 1027 1 205 ASN H 1 206 ASN HA . . 4.170 4.275 4.157 4.374 0.204 14 0 "[ . 1 . 2]" 1 1028 1 202 ALA HA 1 205 ASN H . . 3.900 3.162 3.123 3.219 . 0 0 "[ . 1 . 2]" 1 1029 1 205 ASN H 1 205 ASN HB3 . . 3.590 2.820 2.785 2.847 . 0 0 "[ . 1 . 2]" 1 1030 1 202 ALA MB 1 205 ASN H . . 4.500 4.128 4.083 4.190 . 0 0 "[ . 1 . 2]" 1 1031 1 204 THR MG 1 205 ASN H . . 3.880 3.423 3.360 3.476 . 0 0 "[ . 1 . 2]" 1 1032 1 201 ILE MG 1 205 ASN H . . 4.530 4.721 4.576 4.803 0.273 14 0 "[ . 1 . 2]" 1 1033 1 204 THR H 1 205 ASN H . . 2.820 2.585 2.541 2.631 . 0 0 "[ . 1 . 2]" 1 1034 1 205 ASN H 1 208 GLN H . . 4.450 4.389 4.296 4.495 0.045 13 0 "[ . 1 . 2]" 1 1035 1 205 ASN H 1 206 ASN H . . 4.130 2.329 2.155 2.469 . 0 0 "[ . 1 . 2]" 1 1036 1 88 ALA HA 1 92 ALA H . . 4.290 4.081 3.864 4.254 . 0 0 "[ . 1 . 2]" 1 1037 1 89 THR HB 1 92 ALA H . . 4.750 5.074 4.985 5.118 0.368 20 0 "[ . 1 . 2]" 1 1038 1 90 GLU HA 1 92 ALA H . . 4.340 4.273 4.100 4.408 0.068 11 0 "[ . 1 . 2]" 1 1039 1 92 ALA H 1 92 ALA HA . . 2.940 2.775 2.769 2.782 . 0 0 "[ . 1 . 2]" 1 1040 1 91 ALA MB 1 92 ALA H . . 3.010 2.482 2.401 2.528 . 0 0 "[ . 1 . 2]" 1 1041 1 82 PHE QD 1 92 ALA H . . 3.880 3.944 3.808 4.059 0.179 20 0 "[ . 1 . 2]" 1 1042 1 82 PHE QE 1 92 ALA H . . 4.050 3.861 3.744 4.059 0.009 5 0 "[ . 1 . 2]" 1 1043 1 89 THR H 1 92 ALA H . . 4.240 4.523 4.432 4.602 0.362 13 0 "[ . 1 . 2]" 1 1044 1 92 ALA H 1 94 TYR H . . 4.320 4.291 4.222 4.350 0.030 16 0 "[ . 1 . 2]" 1 1045 1 82 PHE H 1 104 THR HA . . 3.950 3.295 3.111 3.452 . 0 0 "[ . 1 . 2]" 1 1046 1 73 GLY HA3 1 82 PHE H . . 4.730 4.485 4.326 4.603 . 0 0 "[ . 1 . 2]" 1 1047 1 82 PHE H 1 82 PHE QB . . 3.880 2.790 2.773 2.805 . 0 0 "[ . 1 . 2]" 1 1048 1 82 PHE H 1 88 ALA MB . . 4.410 4.713 4.662 4.801 0.391 12 0 "[ . 1 . 2]" 1 1049 1 82 PHE H 1 103 VAL HB . . 3.960 3.607 3.533 3.703 . 0 0 "[ . 1 . 2]" 1 1050 1 82 PHE H 1 105 LEU QD . . 3.900 2.114 1.897 2.863 . 0 0 "[ . 1 . 2]" 1 1051 1 82 PHE H 1 82 PHE QD . . 3.770 3.475 3.384 3.665 . 0 0 "[ . 1 . 2]" 1 1052 1 81 TYR HA 1 82 PHE H . . 3.100 2.269 2.244 2.299 . 0 0 "[ . 1 . 2]" 1 1053 1 82 PHE H 1 105 LEU H . . 3.780 3.338 3.158 3.500 . 0 0 "[ . 1 . 2]" 1 1054 1 141 TYR HA 1 142 TYR H . . 2.870 3.128 3.092 3.160 0.290 19 0 "[ . 1 . 2]" 1 1055 1 142 TYR H 1 142 TYR HA . . 2.690 2.313 2.303 2.325 . 0 0 "[ . 1 . 2]" 1 1056 1 142 TYR H 1 142 TYR HB2 . . 2.970 2.699 2.684 2.726 . 0 0 "[ . 1 . 2]" 1 1057 1 138 THR MG 1 142 TYR H . . 4.340 4.611 4.552 4.682 0.342 2 0 "[ . 1 . 2]" 1 1058 1 139 LEU QB 1 142 TYR H . . 4.650 4.371 4.328 4.438 . 0 0 "[ . 1 . 2]" 1 1059 1 139 LEU MD2 1 142 TYR H . . 4.070 4.535 4.439 4.665 0.595 9 5 "[ * * +1 .- *]" 1 1060 1 140 PHE QD 1 142 TYR H . . 4.590 4.910 4.857 5.044 0.454 16 0 "[ . 1 . 2]" 1 1061 1 140 PHE H 1 142 TYR H . . 4.070 3.723 3.691 3.777 . 0 0 "[ . 1 . 2]" 1 1062 1 169 GLN HA 1 173 LYS H . . 3.890 3.978 3.800 4.097 0.207 6 0 "[ . 1 . 2]" 1 1063 1 172 GLY HA2 1 173 LYS H . . 3.810 3.505 3.481 3.521 . 0 0 "[ . 1 . 2]" 1 1064 1 171 ILE MG 1 173 LYS H . . 4.390 4.752 4.708 4.800 0.410 2 0 "[ . 1 . 2]" 1 1065 1 172 GLY H 1 173 LYS H . . 3.520 2.748 2.688 2.805 . 0 0 "[ . 1 . 2]" 1 1066 1 157 SER H 1 157 SER QB . . 3.600 2.451 2.399 2.681 . 0 0 "[ . 1 . 2]" 1 1067 1 156 GLN HB2 1 157 SER H . . 4.590 2.658 2.474 2.902 . 0 0 "[ . 1 . 2]" 1 1068 1 157 SER H 1 158 THR MG . . 4.220 4.225 4.164 4.262 0.042 20 0 "[ . 1 . 2]" 1 1069 1 157 SER H 1 171 ILE MD . . 3.880 3.528 3.278 3.837 . 0 0 "[ . 1 . 2]" 1 1070 1 157 SER H 1 171 ILE MG . . 4.650 4.617 4.374 4.917 0.267 5 0 "[ . 1 . 2]" 1 1071 1 215 LEU HA 1 216 ILE H . . 3.440 2.219 2.177 2.265 . 0 0 "[ . 1 . 2]" 1 1072 1 184 ALA HA 1 216 ILE H . . 3.950 3.845 3.675 3.958 0.008 12 0 "[ . 1 . 2]" 1 1073 1 187 SER QB 1 216 ILE H . . 3.490 2.340 2.187 2.414 . 0 0 "[ . 1 . 2]" 1 1074 1 233 VAL H 1 233 VAL HB . . 4.330 2.472 2.405 2.558 . 0 0 "[ . 1 . 2]" 1 1075 1 216 ILE H 1 216 ILE QG . . 3.120 2.215 2.141 2.333 . 0 0 "[ . 1 . 2]" 1 1076 1 233 VAL H 1 233 VAL MG2 . . 3.410 2.239 2.015 2.445 . 0 0 "[ . 1 . 2]" 1 1077 1 216 ILE H 1 216 ILE MD . . 3.240 3.191 3.029 3.435 0.195 15 0 "[ . 1 . 2]" 1 1078 1 216 ILE H 1 217 ASN H . . 4.720 4.463 4.427 4.498 . 0 0 "[ . 1 . 2]" 1 1079 1 36 LEU HG 1 242 ASN QD . . 4.670 2.910 2.095 4.251 . 0 0 "[ . 1 . 2]" 1 1080 1 31 LEU H 1 35 PRO HA . . 4.480 4.671 4.545 4.823 0.343 12 0 "[ . 1 . 2]" 1 1081 1 31 LEU H 1 34 ILE HB . . 4.510 3.621 3.432 3.861 . 0 0 "[ . 1 . 2]" 1 1082 1 30 LYS HB2 1 31 LEU H . . 4.060 3.426 3.339 3.534 . 0 0 "[ . 1 . 2]" 1 1083 1 31 LEU H 1 31 LEU QB . . 3.420 2.363 2.272 2.415 . 0 0 "[ . 1 . 2]" 1 1084 1 31 LEU H 1 31 LEU QD . . 3.520 2.243 2.129 2.447 . 0 0 "[ . 1 . 2]" 1 1085 1 31 LEU H 1 34 ILE H . . 3.840 3.907 3.747 3.978 0.138 9 0 "[ . 1 . 2]" 1 1086 1 30 LYS HA 1 31 LEU H . . 3.330 2.051 2.030 2.076 . 0 0 "[ . 1 . 2]" 1 1087 1 39 SER H 1 39 SER HA . . 3.050 2.855 2.839 2.868 . 0 0 "[ . 1 . 2]" 1 1088 1 39 SER H 1 39 SER HB2 . . 3.310 3.004 2.493 3.550 0.240 13 0 "[ . 1 . 2]" 1 1089 1 38 ARG QB 1 39 SER H . . 3.670 3.595 3.131 3.952 0.282 6 0 "[ . 1 . 2]" 1 1090 1 39 SER H 1 242 ASN QD . . 4.600 2.621 2.230 3.469 . 0 0 "[ . 1 . 2]" 1 1091 1 39 SER H 1 40 THR H . . 4.010 2.534 2.394 2.640 . 0 0 "[ . 1 . 2]" 1 1092 1 96 PHE HA 1 97 LYS H . . 3.830 2.736 2.679 2.777 . 0 0 "[ . 1 . 2]" 1 1093 1 95 VAL HA 1 97 LYS H . . 3.650 3.492 3.421 3.565 . 0 0 "[ . 1 . 2]" 1 1094 1 96 PHE HB3 1 97 LYS H . . 4.710 4.476 4.459 4.491 . 0 0 "[ . 1 . 2]" 1 1095 1 97 LYS H 1 97 LYS QE . . 4.340 4.477 4.354 4.563 0.223 9 0 "[ . 1 . 2]" 1 1096 1 97 LYS H 1 97 LYS HB2 . . 3.210 2.564 2.513 2.594 . 0 0 "[ . 1 . 2]" 1 1097 1 97 LYS H 1 97 LYS HG2 . . 2.840 1.796 1.740 1.857 . 0 0 "[ . 1 . 2]" 1 1098 1 97 LYS H 1 99 ALA H . . 3.770 4.050 4.015 4.086 0.316 4 0 "[ . 1 . 2]" 1 1099 1 96 PHE H 1 97 LYS H . . 3.590 2.897 2.857 2.930 . 0 0 "[ . 1 . 2]" 1 1100 1 221 GLN HE21 1 221 GLN HG2 . . 3.120 2.209 2.187 2.227 . 0 0 "[ . 1 . 2]" 1 1101 1 221 GLN HB3 1 221 GLN HE21 . . 4.250 2.786 2.752 2.818 . 0 0 "[ . 1 . 2]" 1 1102 1 147 ALA HA 1 151 LEU H . . 4.360 3.890 3.734 4.075 . 0 0 "[ . 1 . 2]" 1 1103 1 150 ALA MB 1 151 LEU H . . 3.560 2.369 2.325 2.420 . 0 0 "[ . 1 . 2]" 1 1104 1 151 LEU H 1 151 LEU QB . . 3.660 2.309 2.237 2.497 . 0 0 "[ . 1 . 2]" 1 1105 1 151 LEU H 1 151 LEU HG . . 3.580 2.558 2.142 2.740 . 0 0 "[ . 1 . 2]" 1 1106 1 149 SER H 1 151 LEU H . . 4.640 4.340 4.225 4.453 . 0 0 "[ . 1 . 2]" 1 1107 1 151 LEU H 1 152 MET H . . 3.770 2.739 2.691 2.806 . 0 0 "[ . 1 . 2]" 1 1108 1 150 ALA H 1 151 LEU H . . 3.390 2.851 2.823 2.882 . 0 0 "[ . 1 . 2]" 1 1109 1 134 SER H 1 134 SER HA . . 3.060 2.777 2.768 2.786 . 0 0 "[ . 1 . 2]" 1 1110 1 133 ASP HB3 1 134 SER H . . 3.310 2.246 2.195 2.296 . 0 0 "[ . 1 . 2]" 1 1111 1 133 ASP HB2 1 134 SER H . . 3.430 3.681 3.648 3.717 0.287 5 0 "[ . 1 . 2]" 1 1112 1 134 SER H 1 135 ALA MB . . 3.840 4.284 4.257 4.304 0.464 5 0 "[ . 1 . 2]" 1 1113 1 134 SER H 1 135 ALA H . . 3.120 2.687 2.661 2.721 . 0 0 "[ . 1 . 2]" 1 1114 1 96 PHE HA 1 99 ALA H . . 3.900 3.392 3.309 3.599 . 0 0 "[ . 1 . 2]" 1 1115 1 98 ASP HA 1 99 ALA H . . 3.300 3.409 3.368 3.425 0.125 11 0 "[ . 1 . 2]" 1 1116 1 96 PHE HB2 1 99 ALA H . . 4.210 4.208 4.119 4.308 0.098 10 0 "[ . 1 . 2]" 1 1117 1 96 PHE HB3 1 99 ALA H . . 4.030 3.305 3.239 3.519 . 0 0 "[ . 1 . 2]" 1 1118 1 98 ASP HB3 1 99 ALA H . . 3.740 3.068 2.995 3.212 . 0 0 "[ . 1 . 2]" 1 1119 1 98 ASP HB2 1 99 ALA H . . 4.000 4.110 4.053 4.144 0.144 9 0 "[ . 1 . 2]" 1 1120 1 177 LYS HA 1 178 THR H . . 2.890 2.806 2.455 2.892 0.002 16 0 "[ . 1 . 2]" 1 1121 1 178 THR H 1 178 THR HB . . 4.070 3.785 3.629 3.821 . 0 0 "[ . 1 . 2]" 1 1122 1 177 LYS QD 1 178 THR H . . 3.690 2.852 2.514 3.970 0.280 3 0 "[ . 1 . 2]" 1 1123 1 178 THR H 1 178 THR MG . . 3.040 3.299 3.013 3.486 0.446 5 0 "[ . 1 . 2]" 1 1124 1 177 LYS H 1 178 THR H . . 3.990 4.278 4.231 4.437 0.447 5 0 "[ . 1 . 2]" 1 1125 1 151 LEU HA 1 152 MET H . . 3.770 3.533 3.516 3.553 . 0 0 "[ . 1 . 2]" 1 1126 1 152 MET H 1 152 MET HG3 . . 3.890 2.393 2.151 3.763 . 0 0 "[ . 1 . 2]" 1 1127 1 152 MET H 1 152 MET HB3 . . 3.830 3.599 3.570 3.612 . 0 0 "[ . 1 . 2]" 1 1128 1 152 MET H 1 152 MET HG2 . . 3.650 3.459 2.534 3.716 0.066 18 0 "[ . 1 . 2]" 1 1129 1 152 MET H 1 152 MET HB2 . . 3.330 2.458 2.339 2.553 . 0 0 "[ . 1 . 2]" 1 1130 1 150 ALA MB 1 152 MET H . . 4.290 4.398 4.321 4.480 0.190 6 0 "[ . 1 . 2]" 1 1131 1 151 LEU QB 1 152 MET H . . 4.070 2.576 2.350 2.647 . 0 0 "[ . 1 . 2]" 1 1132 1 150 ALA H 1 152 MET H . . 4.550 4.049 3.962 4.148 . 0 0 "[ . 1 . 2]" 1 1133 1 226 THR HB 1 227 ASN H . . 4.450 4.082 3.948 4.232 . 0 0 "[ . 1 . 2]" 1 1134 1 225 ILE HA 1 227 ASN H . . 3.470 3.293 3.073 3.425 . 0 0 "[ . 1 . 2]" 1 1135 1 227 ASN H 1 230 ALA MB . . 4.130 3.845 3.193 4.087 . 0 0 "[ . 1 . 2]" 1 1136 1 225 ILE MG 1 227 ASN H . . 3.130 2.691 2.347 2.886 . 0 0 "[ . 1 . 2]" 1 1137 1 226 THR H 1 227 ASN H . . 3.080 2.188 2.022 2.339 . 0 0 "[ . 1 . 2]" 1 1138 1 136 ILE H 1 137 THR H . . 3.180 2.657 2.585 2.750 . 0 0 "[ . 1 . 2]" 1 1139 1 137 THR H 1 138 THR H . . 3.340 2.750 2.662 2.829 . 0 0 "[ . 1 . 2]" 1 1140 1 118 ALA H 1 119 GLY H . . 3.140 2.423 2.402 2.452 . 0 0 "[ . 1 . 2]" 1 1141 1 157 SER H 1 158 THR H . . 3.460 2.729 2.686 2.765 . 0 0 "[ . 1 . 2]" 1 1142 1 29 ARG H 1 30 LYS H . . 4.800 4.292 4.271 4.316 . 0 0 "[ . 1 . 2]" 1 1143 1 27 TYR H 1 28 GLU H . . 4.210 4.199 4.132 4.234 0.024 17 0 "[ . 1 . 2]" 1 1144 1 76 ALA H 1 77 GLY H . . 4.750 3.584 3.545 3.624 . 0 0 "[ . 1 . 2]" 1 1145 1 75 ARG H 1 76 ALA H . . 4.870 4.422 4.347 4.497 . 0 0 "[ . 1 . 2]" 1 1146 1 19 SER H 1 20 ASN H . . 3.010 2.833 2.817 2.861 . 0 0 "[ . 1 . 2]" 1 1147 1 164 TYR H 1 237 ILE HA . . 5.110 5.397 5.053 5.560 0.450 14 0 "[ . 1 . 2]" 1 1148 1 159 SER HB2 1 160 GLU H . . 3.950 3.080 2.348 3.932 . 0 0 "[ . 1 . 2]" 1 1149 1 164 TYR H 1 164 TYR HB2 . . 4.320 2.771 2.354 3.075 . 0 0 "[ . 1 . 2]" 1 1150 1 164 TYR H 1 164 TYR HB3 . . 4.310 3.770 3.090 3.871 . 0 0 "[ . 1 . 2]" 1 1151 1 164 TYR H 1 238 ALA MB . . 4.250 3.190 2.887 4.313 0.063 1 0 "[ . 1 . 2]" 1 1152 1 164 TYR H 1 167 ILE MD . . 3.430 3.592 3.185 3.689 0.259 16 0 "[ . 1 . 2]" 1 1153 1 163 ARG QB 1 164 TYR H . . 3.820 3.258 2.036 3.733 . 0 0 "[ . 1 . 2]" 1 1154 1 164 TYR H 1 165 LYS H . . 5.070 4.142 4.036 4.424 . 0 0 "[ . 1 . 2]" 1 1155 1 162 ALA H 1 164 TYR H . . 4.660 4.092 3.934 4.502 . 0 0 "[ . 1 . 2]" 1 1156 1 160 GLU HA 1 163 ARG H . . 4.930 3.327 3.108 3.512 . 0 0 "[ . 1 . 2]" 1 1157 1 162 ALA MB 1 163 ARG H . . 3.640 2.453 2.301 2.573 . 0 0 "[ . 1 . 2]" 1 1158 1 69 VAL MG1 1 163 ARG H . . 4.090 3.949 3.275 4.697 0.607 13 1 "[ . 1 + . 2]" 1 1159 1 21 LEU QD 1 163 ARG H . . 4.840 4.976 4.895 5.067 0.227 10 0 "[ . 1 . 2]" 1 1160 1 18 ILE MG 1 163 ARG H . . 4.340 4.597 4.458 4.704 0.364 11 0 "[ . 1 . 2]" 1 1161 1 161 ALA H 1 163 ARG H . . 5.000 4.103 3.849 4.322 . 0 0 "[ . 1 . 2]" 1 1162 1 163 ARG H 1 164 TYR H . . 3.710 2.660 2.585 2.837 . 0 0 "[ . 1 . 2]" 1 1163 1 54 ASN H 1 55 TYR H . . 4.620 4.594 4.582 4.615 . 0 0 "[ . 1 . 2]" 1 1164 1 191 SER H 1 193 SER H . . 5.400 4.758 4.506 5.002 . 0 0 "[ . 1 . 2]" 1 1165 1 93 LYS H 1 94 TYR H . . 3.350 2.571 2.553 2.598 . 0 0 "[ . 1 . 2]" 1 1166 1 94 TYR H 1 95 VAL H . . 2.810 2.127 2.061 2.163 . 0 0 "[ . 1 . 2]" 1 1167 1 94 TYR H 1 94 TYR QD . . 3.510 2.527 2.239 2.661 . 0 0 "[ . 1 . 2]" 1 1168 1 94 TYR H 1 94 TYR QE . . 4.120 4.421 4.374 4.469 0.349 12 0 "[ . 1 . 2]" 1 1169 1 91 ALA H 1 92 ALA H . . 2.990 2.836 2.806 2.861 . 0 0 "[ . 1 . 2]" 1 1170 1 245 ASN H 1 246 MET H . . 3.570 2.232 2.135 2.350 . 0 0 "[ . 1 . 2]" 1 1171 1 244 ASN H 1 245 ASN H . . 5.040 2.481 2.441 2.534 . 0 0 "[ . 1 . 2]" 1 1172 1 32 TYR H 1 33 ASP H . . 3.390 2.383 2.336 2.421 . 0 0 "[ . 1 . 2]" 1 1173 1 30 LYS H 1 31 LEU H . . 3.820 4.023 3.948 4.069 0.249 2 0 "[ . 1 . 2]" 1 1174 1 104 THR H 1 105 LEU H . . 4.730 4.448 4.395 4.474 . 0 0 "[ . 1 . 2]" 1 1175 1 61 SER H 1 62 VAL H . . 4.780 4.496 4.459 4.550 . 0 0 "[ . 1 . 2]" 1 1176 1 33 ASP H 1 34 ILE H . . 3.610 2.688 2.639 2.774 . 0 0 "[ . 1 . 2]" 1 1177 1 10 THR H 1 11 SER H . . 4.980 4.359 4.343 4.382 . 0 0 "[ . 1 . 2]" 1 1178 1 62 VAL H 1 63 ALA H . . 4.900 4.392 4.346 4.409 . 0 0 "[ . 1 . 2]" 1 1179 1 178 THR H 1 179 PHE H . . 4.390 4.392 4.347 4.479 0.089 18 0 "[ . 1 . 2]" 1 1180 1 175 VAL H 1 176 ASP H . . 3.220 2.708 2.631 2.787 . 0 0 "[ . 1 . 2]" 1 1181 1 174 ARG H 1 175 VAL H . . 4.140 3.369 3.227 3.533 . 0 0 "[ . 1 . 2]" 1 1182 1 175 VAL H 1 177 LYS H . . 4.090 4.115 3.665 4.294 0.204 12 0 "[ . 1 . 2]" 1 1183 1 22 ARG H 1 23 LYS H . . 3.550 2.492 2.436 2.541 . 0 0 "[ . 1 . 2]" 1 1184 1 84 ASN H 1 107 TYR H . . 3.680 3.341 3.213 3.449 . 0 0 "[ . 1 . 2]" 1 1185 1 82 PHE H 1 83 PHE H . . 4.980 4.217 4.179 4.257 . 0 0 "[ . 1 . 2]" 1 1186 1 81 TYR H 1 82 PHE H . . 5.060 4.331 4.302 4.524 . 0 0 "[ . 1 . 2]" 1 1187 1 80 SER H 1 81 TYR H . . 4.640 4.498 4.409 4.519 . 0 0 "[ . 1 . 2]" 1 1188 1 159 SER H 1 160 GLU H . . 3.970 2.890 2.677 2.976 . 0 0 "[ . 1 . 2]" 1 1189 1 239 LEU H 1 240 LEU H . . 4.940 4.421 4.359 4.466 . 0 0 "[ . 1 . 2]" 1 1190 1 23 LYS H 1 24 ALA H . . 3.050 2.552 2.527 2.588 . 0 0 "[ . 1 . 2]" 1 1191 1 187 SER H 1 188 LEU H . . 4.000 2.686 2.602 2.886 . 0 0 "[ . 1 . 2]" 1 1192 1 121 ILE H 1 122 ARG H . . 4.980 4.587 4.570 4.612 . 0 0 "[ . 1 . 2]" 1 1193 1 193 SER H 1 194 ALA H . . 3.850 2.619 2.506 2.780 . 0 0 "[ . 1 . 2]" 1 1194 1 188 LEU H 1 190 ASN H . . 4.550 4.158 3.940 4.392 . 0 0 "[ . 1 . 2]" 1 1195 1 89 THR H 1 90 GLU H . . 2.950 2.733 2.690 2.821 . 0 0 "[ . 1 . 2]" 1 1196 1 219 GLN H 1 221 GLN H . . 3.280 3.494 3.299 3.588 0.308 8 0 "[ . 1 . 2]" 1 1197 1 214 VAL H 1 215 LEU H . . 4.230 4.333 4.312 4.369 0.139 10 0 "[ . 1 . 2]" 1 1198 1 213 VAL H 1 225 ILE H . . 4.560 3.825 3.610 4.346 . 0 0 "[ . 1 . 2]" 1 1199 1 97 LYS H 1 98 ASP H . . 3.500 2.704 2.657 2.773 . 0 0 "[ . 1 . 2]" 1 1200 1 182 SER H 1 183 LEU H . . 4.890 4.609 4.575 4.633 . 0 0 "[ . 1 . 2]" 1 1201 1 38 ARG H 1 39 SER H . . 4.650 4.342 4.230 4.527 . 0 0 "[ . 1 . 2]" 1 1202 1 66 VAL H 1 67 THR H . . 4.060 2.599 2.541 2.683 . 0 0 "[ . 1 . 2]" 1 1203 1 48 ALA H 1 66 VAL H . . 4.930 4.089 3.988 4.161 . 0 0 "[ . 1 . 2]" 1 1204 1 65 ASP H 1 66 VAL H . . 4.150 4.392 4.348 4.446 0.296 14 0 "[ . 1 . 2]" 1 1205 1 49 LEU H 1 50 ILE H . . 5.060 4.489 4.452 4.515 . 0 0 "[ . 1 . 2]" 1 1206 1 127 LEU H 1 128 GLY H . . 5.310 4.511 4.338 4.583 . 0 0 "[ . 1 . 2]" 1 1207 1 32 TYR H 1 34 ILE H . . 4.190 4.153 4.083 4.233 0.043 18 0 "[ . 1 . 2]" 1 1208 1 50 ILE H 1 51 HIS H . . 4.730 4.428 4.376 4.548 . 0 0 "[ . 1 . 2]" 1 1209 1 51 HIS H 1 52 LEU H . . 4.850 4.445 4.154 4.521 . 0 0 "[ . 1 . 2]" 1 1210 1 52 LEU H 1 60 ILE H . . 4.350 2.368 2.236 2.494 . 0 0 "[ . 1 . 2]" 1 1211 1 60 ILE H 1 61 SER H . . 4.180 4.224 4.201 4.248 0.068 18 0 "[ . 1 . 2]" 1 1212 1 59 THR H 1 60 ILE H . . 4.780 4.557 4.544 4.568 . 0 0 "[ . 1 . 2]" 1 1213 1 58 GLU H 1 59 THR H . . 4.260 4.303 4.275 4.340 0.080 12 0 "[ . 1 . 2]" 1 1214 1 53 THR H 1 54 ASN H . . 4.350 4.430 4.379 4.472 0.122 9 0 "[ . 1 . 2]" 1 1215 1 52 LEU H 1 53 THR H . . 5.090 3.938 3.890 4.002 . 0 0 "[ . 1 . 2]" 1 1216 1 73 GLY H 1 74 TYR H . . 3.910 4.243 4.192 4.283 0.373 12 0 "[ . 1 . 2]" 1 1217 1 71 VAL H 1 72 MET H . . 4.840 4.558 4.532 4.580 . 0 0 "[ . 1 . 2]" 1 1218 1 43 GLY H 1 44 SER H . . 4.900 2.843 2.782 2.969 . 0 0 "[ . 1 . 2]" 1 1219 1 188 LEU H 1 189 GLU H . . 4.150 2.749 2.512 2.841 . 0 0 "[ . 1 . 2]" 1 1220 1 182 SER H 1 184 ALA H . . 5.420 4.834 4.607 5.024 . 0 0 "[ . 1 . 2]" 1 1221 1 209 PHE QD 1 211 THR H . . 4.430 4.016 3.750 4.636 0.206 1 0 "[ . 1 . 2]" 1 1222 1 173 LYS H 1 174 ARG H . . 3.140 2.506 2.457 2.538 . 0 0 "[ . 1 . 2]" 1 1223 1 128 GLY H 1 129 LEU H . . 6.140 4.386 4.348 4.447 . 0 0 "[ . 1 . 2]" 1 1224 1 36 LEU H 1 37 LEU H . . 4.540 4.283 4.194 4.368 . 0 0 "[ . 1 . 2]" 1 1225 1 215 LEU H 1 216 ILE H . . 5.040 4.449 4.370 4.492 . 0 0 "[ . 1 . 2]" 1 1226 1 224 THR H 1 225 ILE H . . 4.930 4.500 4.402 4.567 . 0 0 "[ . 1 . 2]" 1 1227 1 223 VAL H 1 224 THR H . . 4.130 4.333 4.236 4.449 0.319 7 0 "[ . 1 . 2]" 1 1228 1 225 ILE H 1 226 THR H . . 5.480 4.042 3.936 4.091 . 0 0 "[ . 1 . 2]" 1 1229 1 152 MET H 1 154 LEU H . . 5.050 3.970 3.881 4.110 . 0 0 "[ . 1 . 2]" 1 1230 1 7 SER H 1 55 TYR H . . 5.600 5.213 5.067 5.320 . 0 0 "[ . 1 . 2]" 1 1231 1 63 ALA H 1 64 ILE H . . 4.510 4.370 4.340 4.548 0.038 5 0 "[ . 1 . 2]" 1 1232 1 65 ASP H 1 70 TYR H . . 4.360 3.818 3.702 3.939 . 0 0 "[ . 1 . 2]" 1 1233 1 217 ASN H 1 220 ASN H . . 4.760 4.349 3.903 4.892 0.132 12 0 "[ . 1 . 2]" 1 1234 1 215 LEU H 1 225 ILE H . . 5.070 4.000 3.792 4.179 . 0 0 "[ . 1 . 2]" 1 1235 1 214 VAL H 1 225 ILE H . . 5.410 5.017 4.854 5.408 . 0 0 "[ . 1 . 2]" 1 1236 1 40 THR H 1 41 LEU H . . 4.870 4.363 4.126 4.466 . 0 0 "[ . 1 . 2]" 1 1237 1 31 LEU H 1 32 TYR QD . . 5.300 5.044 4.872 5.569 0.269 20 0 "[ . 1 . 2]" 1 1238 1 67 THR H 1 70 TYR H . . 5.440 5.085 4.867 5.405 . 0 0 "[ . 1 . 2]" 1 1239 1 209 PHE HZ 1 213 VAL H . . 4.690 5.118 4.923 5.577 0.887 17 4 "[ *. *1 . + -2]" 1 1240 1 10 THR HA 1 11 SER H . . 3.550 2.553 2.427 2.627 . 0 0 "[ . 1 . 2]" 1 1241 1 15 GLY HA2 1 16 VAL H . . 3.370 3.549 3.539 3.562 0.192 20 0 "[ . 1 . 2]" 1 1242 1 32 TYR HA 1 33 ASP H . . 3.110 2.911 2.845 2.965 . 0 0 "[ . 1 . 2]" 1 1243 1 33 ASP HA 1 34 ILE H . . 3.630 3.321 3.285 3.373 . 0 0 "[ . 1 . 2]" 1 1244 1 56 ALA MB 1 57 ASP H . . 3.050 3.261 3.223 3.306 0.256 18 0 "[ . 1 . 2]" 1 1245 1 59 THR HA 1 60 ILE H . . 3.440 2.272 2.235 2.314 . 0 0 "[ . 1 . 2]" 1 1246 1 66 VAL HA 1 67 THR H . . 4.800 3.417 3.396 3.439 . 0 0 "[ . 1 . 2]" 1 1247 1 67 THR HA 1 68 ASN H . . 5.280 3.403 3.369 3.433 . 0 0 "[ . 1 . 2]" 1 1248 1 92 ALA HA 1 93 LYS H . . 3.820 3.493 3.465 3.521 . 0 0 "[ . 1 . 2]" 1 1249 1 93 LYS HA 1 94 TYR H . . 4.180 3.427 3.400 3.456 . 0 0 "[ . 1 . 2]" 1 1250 1 100 LYS H 1 100 LYS HB2 . . 3.240 2.431 2.384 2.498 . 0 0 "[ . 1 . 2]" 1 1251 1 163 ARG HA 1 164 TYR H . . 4.070 3.481 3.413 3.599 . 0 0 "[ . 1 . 2]" 1 1252 1 167 ILE HA 1 168 GLU H . . 5.070 3.524 3.513 3.579 . 0 0 "[ . 1 . 2]" 1 1253 1 243 ARG H 1 243 ARG HA . . 3.020 2.792 2.751 2.827 . 0 0 "[ . 1 . 2]" 1 1254 1 172 GLY HA3 1 173 LYS H . . 3.760 2.985 2.947 3.011 . 0 0 "[ . 1 . 2]" 1 1255 1 174 ARG HA 1 175 VAL H . . 3.190 2.585 2.459 2.714 . 0 0 "[ . 1 . 2]" 1 1256 1 222 ARG HA 1 223 VAL H . . 3.310 2.131 2.073 2.211 . 0 0 "[ . 1 . 2]" 1 1257 1 205 ASN HA 1 206 ASN H . . 5.280 2.930 2.861 2.978 . 0 0 "[ . 1 . 2]" 1 1258 1 203 SER HA 1 204 THR H . . 3.520 3.529 3.520 3.540 0.020 13 0 "[ . 1 . 2]" 1 1259 1 226 THR HA 1 227 ASN H . . 3.790 3.344 3.255 3.409 . 0 0 "[ . 1 . 2]" 1 1260 1 243 ARG H 1 243 ARG HG2 . . 3.380 3.102 2.032 3.538 0.158 7 0 "[ . 1 . 2]" 1 1261 1 244 ASN H 1 244 ASN HD22 . . 5.790 5.028 3.797 5.816 0.026 2 0 "[ . 1 . 2]" 1 1262 1 244 ASN H 1 244 ASN HD21 . . 4.730 4.389 2.378 4.735 0.005 5 0 "[ . 1 . 2]" 1 1263 1 225 ILE H 1 225 ILE HG12 . . 4.570 2.669 2.567 2.828 . 0 0 "[ . 1 . 2]" 1 1264 1 195 LEU H 1 195 LEU HB2 . . 3.290 2.334 2.136 2.496 . 0 0 "[ . 1 . 2]" 1 1265 1 195 LEU H 1 195 LEU HB3 . . 3.170 2.705 2.436 3.568 0.398 15 0 "[ . 1 . 2]" 1 1266 1 133 ASP H 1 134 SER H . . 3.180 2.759 2.737 2.785 . 0 0 "[ . 1 . 2]" 1 1267 1 144 ALA H 1 146 SER H . . 5.770 4.349 4.256 4.556 . 0 0 "[ . 1 . 2]" 1 1268 1 166 PHE H 1 167 ILE H . . 4.860 2.658 2.590 2.716 . 0 0 "[ . 1 . 2]" 1 1269 1 164 TYR H 1 238 ALA H . . 4.660 4.204 4.028 5.106 0.446 3 0 "[ . 1 . 2]" 1 1270 1 37 LEU H 1 38 ARG H . . 4.760 4.634 4.529 4.683 . 0 0 "[ . 1 . 2]" 1 1271 1 28 GLU H 1 38 ARG H . . 6.110 3.834 3.400 4.280 . 0 0 "[ . 1 . 2]" 1 1272 1 28 GLU H 1 36 LEU H . . 5.670 4.750 4.328 5.028 . 0 0 "[ . 1 . 2]" 1 1273 1 204 THR H 1 204 THR HB . . 3.930 2.850 2.790 2.912 . 0 0 "[ . 1 . 2]" 1 1274 1 90 GLU H 1 90 GLU HA . . 3.070 2.779 2.771 2.789 . 0 0 "[ . 1 . 2]" 1 1275 1 3 SER H 1 51 HIS HD2 . . 5.060 4.845 4.496 5.079 0.019 19 0 "[ . 1 . 2]" 1 1276 1 3 SER H 1 50 ILE HA . . 4.970 4.663 4.578 4.751 . 0 0 "[ . 1 . 2]" 1 1277 1 4 PHE H 1 53 THR H . . 4.350 3.711 3.544 3.833 . 0 0 "[ . 1 . 2]" 1 1278 1 4 PHE H 1 51 HIS HA . . 5.050 5.029 4.967 5.093 0.043 15 0 "[ . 1 . 2]" 1 1279 1 4 PHE H 1 51 HIS HB2 . . 4.150 3.515 3.375 3.644 . 0 0 "[ . 1 . 2]" 1 1280 1 5 ARG H 1 52 LEU HA . . 5.260 5.335 5.145 5.461 0.201 19 0 "[ . 1 . 2]" 1 1281 1 5 ARG H 1 5 ARG HD3 . . 4.210 3.607 3.385 3.808 . 0 0 "[ . 1 . 2]" 1 1282 1 5 ARG H 1 6 LEU H . . 4.580 4.483 4.420 4.510 . 0 0 "[ . 1 . 2]" 1 1283 1 6 LEU H 1 53 THR HA . . 5.450 4.702 4.629 4.780 . 0 0 "[ . 1 . 2]" 1 1284 1 5 ARG HD2 1 6 LEU H . . 5.410 4.859 4.512 5.042 . 0 0 "[ . 1 . 2]" 1 1285 1 5 ARG H 1 7 SER H . . 5.470 5.391 5.291 5.515 0.045 2 0 "[ . 1 . 2]" 1 1286 1 7 SER H 1 55 TYR QE . . 4.700 4.670 4.547 4.752 0.052 6 0 "[ . 1 . 2]" 1 1287 1 8 GLY H 1 55 TYR QD . . 5.250 3.764 3.398 3.942 . 0 0 "[ . 1 . 2]" 1 1288 1 8 GLY H 1 55 TYR QE . . 5.420 3.526 2.834 3.787 . 0 0 "[ . 1 . 2]" 1 1289 1 8 GLY H 1 9 ALA MB . . 5.160 4.138 4.059 4.215 . 0 0 "[ . 1 . 2]" 1 1290 1 9 ALA H 1 55 TYR QD . . 4.900 4.431 4.196 4.621 . 0 0 "[ . 1 . 2]" 1 1291 1 6 LEU QD 1 9 ALA H . . 4.050 4.235 4.184 4.301 0.251 8 0 "[ . 1 . 2]" 1 1292 1 23 LYS H 1 23 LYS HG2 . . 3.570 3.527 3.455 3.626 0.056 1 0 "[ . 1 . 2]" 1 1293 1 23 LYS H 1 23 LYS QE . . 4.670 4.582 4.264 5.136 0.466 9 0 "[ . 1 . 2]" 1 1294 1 21 LEU H 1 21 LEU QD . . 3.800 3.616 3.599 3.632 . 0 0 "[ . 1 . 2]" 1 1295 1 21 LEU H 1 21 LEU HA . . 3.060 2.784 2.777 2.794 . 0 0 "[ . 1 . 2]" 1 1296 1 17 PHE QD 1 20 ASN H . . 4.850 4.932 4.847 5.048 0.198 8 0 "[ . 1 . 2]" 1 1297 1 10 THR HA 1 14 TYR H . . 5.030 4.919 4.838 5.043 0.013 17 0 "[ . 1 . 2]" 1 1298 1 14 TYR H 1 16 VAL HB . . 5.390 4.837 4.700 4.987 . 0 0 "[ . 1 . 2]" 1 1299 1 15 GLY H 1 18 ILE HB . . 4.950 5.310 5.243 5.379 0.429 11 0 "[ . 1 . 2]" 1 1300 1 17 PHE H 1 18 ILE HB . . 4.940 4.818 4.740 4.921 . 0 0 "[ . 1 . 2]" 1 1301 1 17 PHE H 1 18 ILE MD . . 5.010 5.145 5.092 5.187 0.177 5 0 "[ . 1 . 2]" 1 1302 1 19 SER H 1 22 ARG HD2 . . 4.670 4.574 4.281 4.808 0.138 1 0 "[ . 1 . 2]" 1 1303 1 22 ARG H 1 22 ARG HD2 . . 4.010 3.774 3.593 4.311 0.301 1 0 "[ . 1 . 2]" 1 1304 1 20 ASN QB 1 22 ARG H . . 5.140 4.730 4.684 4.854 . 0 0 "[ . 1 . 2]" 1 1305 1 21 LEU H 1 24 ALA H . . 4.930 4.702 4.660 4.756 . 0 0 "[ . 1 . 2]" 1 1306 1 21 LEU QD 1 24 ALA H . . 4.130 4.157 3.964 4.220 0.090 1 0 "[ . 1 . 2]" 1 1307 1 22 ARG H 1 25 LEU H . . 5.510 4.991 4.881 5.229 . 0 0 "[ . 1 . 2]" 1 1308 1 21 LEU HA 1 25 LEU H . . 4.940 4.643 4.519 4.965 0.025 2 0 "[ . 1 . 2]" 1 1309 1 132 LEU HA 1 133 ASP H . . 3.370 3.524 3.512 3.534 0.164 18 0 "[ . 1 . 2]" 1 1310 1 171 ILE HA 1 172 GLY H . . 4.940 3.536 3.521 3.546 . 0 0 "[ . 1 . 2]" 1 1311 1 37 LEU H 1 240 LEU H . . 4.710 3.738 3.451 3.940 . 0 0 "[ . 1 . 2]" 1 1312 1 238 ALA H 1 239 LEU H . . 3.530 2.734 1.861 2.820 . 0 0 "[ . 1 . 2]" 1 1313 1 13 SER H 1 16 VAL H . . 5.290 4.570 4.510 4.629 . 0 0 "[ . 1 . 2]" 1 1314 1 13 SER H 1 15 GLY H . . 5.700 4.041 3.876 4.112 . 0 0 "[ . 1 . 2]" 1 1315 1 32 TYR QD 1 34 ILE H . . 4.700 4.754 3.573 4.912 0.212 9 0 "[ . 1 . 2]" 1 1316 1 31 LEU H 1 31 LEU HG . . 3.560 3.725 3.597 3.981 0.421 17 0 "[ . 1 . 2]" 1 1317 1 27 TYR H 1 38 ARG H . . 4.340 4.227 3.853 4.532 0.192 20 0 "[ . 1 . 2]" 1 1318 1 28 GLU H 1 37 LEU HA . . 4.850 3.798 3.580 4.075 . 0 0 "[ . 1 . 2]" 1 1319 1 29 ARG H 1 35 PRO HA . . 4.840 4.772 4.659 4.896 0.056 13 0 "[ . 1 . 2]" 1 1320 1 185 ILE H 1 185 ILE HB . . 3.360 2.450 2.386 2.518 . 0 0 "[ . 1 . 2]" 1 1321 1 185 ILE H 1 185 ILE HG12 . . 3.230 3.241 3.157 3.313 0.083 2 0 "[ . 1 . 2]" 1 1322 1 185 ILE H 1 185 ILE HG13 . . 3.170 2.094 2.014 2.162 . 0 0 "[ . 1 . 2]" 1 1323 1 185 ILE H 1 185 ILE MG . . 3.510 3.726 3.707 3.743 0.233 14 0 "[ . 1 . 2]" 1 1324 1 230 ALA H 1 233 VAL H . . 5.570 5.051 4.485 5.632 0.062 20 0 "[ . 1 . 2]" 1 1325 1 13 SER H 1 14 TYR H . . 3.330 2.465 2.406 2.527 . 0 0 "[ . 1 . 2]" 1 1326 1 13 SER H 1 16 VAL HB . . 5.300 5.005 4.866 5.128 . 0 0 "[ . 1 . 2]" 1 1327 1 9 ALA MB 1 13 SER H . . 5.410 5.456 5.178 5.610 0.200 2 0 "[ . 1 . 2]" 1 1328 1 13 SER H 1 14 TYR QD . . 5.660 6.042 5.973 6.139 0.479 4 0 "[ . 1 . 2]" 1 1329 1 228 VAL HA 1 230 ALA H . . 4.870 3.358 3.177 3.554 . 0 0 "[ . 1 . 2]" 1 1330 1 85 GLU H 1 107 TYR H . . 5.360 5.813 5.594 6.851 1.491 17 2 "[ . 1 - . + 2]" 1 1331 1 84 ASN H 1 105 LEU HB3 . . 4.670 3.853 3.581 4.516 . 0 0 "[ . 1 . 2]" 1 1332 1 84 ASN H 1 104 THR MG . . 3.870 3.930 3.767 4.037 0.167 9 0 "[ . 1 . 2]" 1 1333 1 84 ASN H 1 105 LEU HB2 . . 4.360 3.075 2.694 3.242 . 0 0 "[ . 1 . 2]" 1 1334 1 84 ASN H 1 108 SER HA . . 4.000 2.564 2.435 2.885 . 0 0 "[ . 1 . 2]" 1 1335 1 84 ASN H 1 107 TYR HA . . 5.080 4.610 4.456 4.894 . 0 0 "[ . 1 . 2]" 1 1336 1 61 SER HB3 1 75 ARG H . . 4.980 4.506 4.330 4.758 . 0 0 "[ . 1 . 2]" 1 1337 1 60 ILE HB 1 75 ARG H . . 5.200 3.376 3.173 3.705 . 0 0 "[ . 1 . 2]" 1 1338 1 75 ARG H 1 75 ARG HD3 . . 4.920 4.971 4.830 5.054 0.134 19 0 "[ . 1 . 2]" 1 1339 1 75 ARG H 1 75 ARG HD2 . . 4.970 5.269 5.122 5.358 0.388 19 0 "[ . 1 . 2]" 1 1340 1 71 VAL HA 1 73 GLY H . . 3.770 3.686 3.630 3.758 . 0 0 "[ . 1 . 2]" 1 1341 1 67 THR H 1 69 VAL HA . . 5.420 5.100 4.831 5.328 . 0 0 "[ . 1 . 2]" 1 1342 1 46 ARG HA 1 67 THR H . . 5.950 4.069 3.865 4.366 . 0 0 "[ . 1 . 2]" 1 1343 1 60 ILE H 1 60 ILE HB . . 3.810 3.929 3.915 3.943 0.133 18 0 "[ . 1 . 2]" 1 1344 1 49 LEU H 1 49 LEU HB2 . . 3.540 2.477 2.431 2.501 . 0 0 "[ . 1 . 2]" 1 1345 1 163 ARG H 1 163 ARG HB2 . . 4.000 3.021 2.339 3.612 . 0 0 "[ . 1 . 2]" 1 1346 1 155 ILE H 1 155 ILE HG12 . . 4.030 3.409 3.277 3.552 . 0 0 "[ . 1 . 2]" 1 1347 1 153 VAL H 1 153 VAL HB . . 3.480 3.563 2.529 3.632 0.152 15 0 "[ . 1 . 2]" 1 1348 1 140 PHE HB3 1 141 TYR H . . 3.410 2.771 2.697 2.846 . 0 0 "[ . 1 . 2]" 1 1349 1 127 LEU H 1 127 LEU HG . . 5.320 4.231 2.704 4.940 . 0 0 "[ . 1 . 2]" 1 1350 1 127 LEU H 1 127 LEU QD . . 4.790 3.221 2.243 3.768 . 0 0 "[ . 1 . 2]" 1 1351 1 123 GLU H 1 123 GLU HG2 . . 3.900 3.770 3.495 4.290 0.390 18 0 "[ . 1 . 2]" 1 1352 1 121 ILE H 1 121 ILE MD . . 3.470 3.650 3.606 3.687 0.217 18 0 "[ . 1 . 2]" 1 1353 1 120 LYS H 1 120 LYS HB3 . . 2.840 2.991 2.944 3.017 0.177 6 0 "[ . 1 . 2]" 1 1354 1 114 LEU H 1 114 LEU MD2 . . 3.310 3.087 2.975 3.220 . 0 0 "[ . 1 . 2]" 1 1355 1 112 GLU H 1 112 GLU HB2 . . 3.250 2.532 2.476 2.593 . 0 0 "[ . 1 . 2]" 1 1356 1 85 GLU HB3 1 109 GLY H . . 4.090 3.711 2.803 4.599 0.509 1 1 "[+ . 1 . 2]" 1 1357 1 108 SER H 1 108 SER HB3 . . 3.960 3.622 3.581 3.916 . 0 0 "[ . 1 . 2]" 1 1358 1 105 LEU H 1 105 LEU HB3 . . 4.040 3.428 3.381 3.558 . 0 0 "[ . 1 . 2]" 1 1359 1 105 LEU H 1 105 LEU QD . . 3.460 2.524 2.377 2.933 . 0 0 "[ . 1 . 2]" 1 1360 1 102 LYS H 1 102 LYS HE3 . . 5.440 5.030 4.917 5.148 . 0 0 "[ . 1 . 2]" 1 1361 1 102 LYS H 1 102 LYS HE2 . . 5.160 5.106 5.035 5.219 0.059 14 0 "[ . 1 . 2]" 1 1362 1 102 LYS H 1 102 LYS HD3 . . 2.900 2.804 2.707 2.933 0.033 14 0 "[ . 1 . 2]" 1 1363 1 100 LYS H 1 100 LYS QE . . 4.970 4.361 3.771 4.675 . 0 0 "[ . 1 . 2]" 1 1364 1 100 LYS H 1 100 LYS QD . . 3.540 3.529 3.365 3.824 0.284 11 0 "[ . 1 . 2]" 1 1365 1 97 LYS H 1 97 LYS HD3 . . 3.860 3.978 3.897 4.084 0.224 14 0 "[ . 1 . 2]" 1 1366 1 94 TYR H 1 94 TYR QB . . 3.820 2.561 2.494 2.634 . 0 0 "[ . 1 . 2]" 1 1367 1 216 ILE H 1 216 ILE HB . . 3.430 2.563 2.458 2.629 . 0 0 "[ . 1 . 2]" 1 1368 1 214 VAL H 1 214 VAL QG . . 3.370 1.957 1.863 2.229 . 0 0 "[ . 1 . 2]" 1 1369 1 213 VAL H 1 213 VAL HB . . 3.400 2.558 2.495 2.716 . 0 0 "[ . 1 . 2]" 1 1370 1 213 VAL H 1 213 VAL QG . . 2.940 2.125 1.891 2.264 . 0 0 "[ . 1 . 2]" 1 1371 1 208 GLN H 1 208 GLN HB3 . . 3.710 3.586 3.503 3.667 . 0 0 "[ . 1 . 2]" 1 1372 1 208 GLN H 1 208 GLN HG3 . . 3.810 3.880 3.639 4.086 0.276 20 0 "[ . 1 . 2]" 1 1373 1 201 ILE H 1 201 ILE HG12 . . 3.840 3.480 3.386 3.557 . 0 0 "[ . 1 . 2]" 1 1374 1 201 ILE H 1 201 ILE HG13 . . 3.580 2.062 1.975 2.168 . 0 0 "[ . 1 . 2]" 1 1375 1 199 ILE H 1 199 ILE HB . . 3.770 2.384 2.273 2.557 . 0 0 "[ . 1 . 2]" 1 1376 1 198 GLN H 1 198 GLN QG . . 3.810 2.477 2.342 3.281 . 0 0 "[ . 1 . 2]" 1 1377 1 173 LYS H 1 173 LYS HB2 . . 3.150 2.404 2.244 3.500 0.350 2 0 "[ . 1 . 2]" 1 1378 1 173 LYS H 1 173 LYS QE . . 4.210 4.467 4.172 4.670 0.460 13 0 "[ . 1 . 2]" 1 1379 1 173 LYS H 1 173 LYS QD . . 3.430 3.544 3.283 3.776 0.346 7 0 "[ . 1 . 2]" 1 1380 1 173 LYS H 1 173 LYS QG . . 3.100 2.458 2.294 2.640 . 0 0 "[ . 1 . 2]" 1 1381 1 169 GLN H 1 169 GLN HG2 . . 3.790 3.484 3.374 3.543 . 0 0 "[ . 1 . 2]" 1 1382 1 2 VAL H 1 3 SER HA . . 4.900 5.084 4.763 5.206 0.306 9 0 "[ . 1 . 2]" 1 1383 1 2 VAL H 1 50 ILE HA . . 3.250 2.776 2.484 2.997 . 0 0 "[ . 1 . 2]" 1 1384 1 2 VAL H 1 50 ILE H . . 4.580 4.537 4.415 4.694 0.114 11 0 "[ . 1 . 2]" 1 1385 1 3 SER H 1 21 LEU QD . . 5.480 5.465 5.351 5.539 0.059 3 0 "[ . 1 . 2]" 1 1386 1 3 SER H 1 24 ALA MB . . 5.250 5.650 5.403 6.100 0.850 2 4 "[ + * * 1- . 2]" 1 1387 1 4 PHE H 1 52 LEU H . . 5.310 4.690 4.617 4.743 . 0 0 "[ . 1 . 2]" 1 1388 1 5 ARG H 1 17 PHE HB2 . . 5.330 5.568 5.431 5.714 0.384 8 0 "[ . 1 . 2]" 1 1389 1 6 LEU H 1 55 TYR H . . 5.700 5.060 4.890 5.290 . 0 0 "[ . 1 . 2]" 1 1390 1 6 LEU H 1 54 ASN H . . 5.200 4.775 4.686 4.889 . 0 0 "[ . 1 . 2]" 1 1391 1 10 THR H 1 129 LEU QD . . 5.730 3.240 2.757 4.050 . 0 0 "[ . 1 . 2]" 1 1392 1 11 SER H 1 13 SER H . . 5.780 4.070 3.787 4.203 . 0 0 "[ . 1 . 2]" 1 1393 1 16 VAL HB 1 19 SER H . . 5.280 5.622 5.580 5.684 0.404 11 0 "[ . 1 . 2]" 1 1394 1 19 SER H 1 22 ARG H . . 4.660 4.637 4.578 4.717 0.057 1 0 "[ . 1 . 2]" 1 1395 1 18 ILE MD 1 20 ASN H . . 4.050 5.554 5.513 5.592 1.542 2 20 [*+***************-**] 1 1396 1 38 ARG H 1 38 ARG QD . . 4.930 4.142 3.709 4.528 . 0 0 "[ . 1 . 2]" 1 1397 1 36 LEU H 1 36 LEU HB2 . . 4.050 2.633 2.204 2.781 . 0 0 "[ . 1 . 2]" 1 1398 1 36 LEU H 1 36 LEU QD . . 4.560 3.692 2.433 3.805 . 0 0 "[ . 1 . 2]" 1 1399 1 54 ASN H 1 54 ASN HB2 . . 4.400 3.666 3.626 3.685 . 0 0 "[ . 1 . 2]" 1 1400 1 17 PHE H 1 18 ILE H . . 3.570 2.704 2.645 2.781 . 0 0 "[ . 1 . 2]" 1 1401 1 18 ILE MD 1 22 ARG H . . 5.230 5.169 5.105 5.252 0.022 3 0 "[ . 1 . 2]" 1 1402 1 28 GLU H 1 36 LEU HG . . 4.870 4.239 3.722 5.307 0.437 10 0 "[ . 1 . 2]" 1 1403 1 30 LYS H 1 30 LYS HE2 . . 5.590 4.604 3.905 4.968 . 0 0 "[ . 1 . 2]" 1 1404 1 30 LYS H 1 35 PRO HA . . 5.320 4.987 4.862 5.198 . 0 0 "[ . 1 . 2]" 1 1405 1 30 LYS H 1 33 ASP H . . 5.530 5.206 5.121 5.273 . 0 0 "[ . 1 . 2]" 1 1406 1 33 ASP H 1 34 ILE HB . . 5.120 4.929 4.718 5.145 0.025 20 0 "[ . 1 . 2]" 1 1407 1 32 TYR H 1 33 ASP HB2 . . 5.060 5.244 5.075 5.317 0.257 20 0 "[ . 1 . 2]" 1 1408 1 30 LYS HA 1 32 TYR H . . 5.220 5.586 5.451 5.657 0.437 16 0 "[ . 1 . 2]" 1 1409 1 31 LEU H 1 32 TYR H . . 4.590 4.280 4.201 4.317 . 0 0 "[ . 1 . 2]" 1 1410 1 30 LYS HA 1 33 ASP H . . 5.200 4.626 4.519 4.667 . 0 0 "[ . 1 . 2]" 1 1411 1 30 LYS HG2 1 33 ASP H . . 4.940 4.746 4.522 4.930 . 0 0 "[ . 1 . 2]" 1 1412 1 30 LYS HG2 1 34 ILE H . . 5.010 5.370 5.270 5.447 0.437 5 0 "[ . 1 . 2]" 1 1413 1 33 ASP HB2 1 34 ILE H . . 4.440 4.290 4.245 4.360 . 0 0 "[ . 1 . 2]" 1 1414 1 33 ASP HB3 1 34 ILE H . . 4.040 3.369 3.313 3.438 . 0 0 "[ . 1 . 2]" 1 1415 1 30 LYS HA 1 36 LEU H . . 4.150 2.176 2.099 2.572 . 0 0 "[ . 1 . 2]" 1 1416 1 27 TYR HB2 1 36 LEU H . . 4.840 3.037 2.655 3.388 . 0 0 "[ . 1 . 2]" 1 1417 1 27 TYR HB3 1 36 LEU H . . 5.100 4.298 3.953 4.717 . 0 0 "[ . 1 . 2]" 1 1418 1 37 LEU H 1 241 PRO HA . . 4.630 3.712 2.515 4.663 0.033 3 0 "[ . 1 . 2]" 1 1419 1 36 LEU QD 1 37 LEU H . . 3.870 2.845 2.525 3.501 . 0 0 "[ . 1 . 2]" 1 1420 1 38 ARG H 1 41 LEU HG . . 5.660 4.923 4.656 5.235 . 0 0 "[ . 1 . 2]" 1 1421 1 27 TYR HA 1 38 ARG H . . 5.380 2.440 1.992 2.930 . 0 0 "[ . 1 . 2]" 1 1422 1 39 SER H 1 242 ASN HB2 . . 5.230 4.538 3.160 5.373 0.143 16 0 "[ . 1 . 2]" 1 1423 1 39 SER H 1 242 ASN HB3 . . 5.100 4.408 3.445 4.773 . 0 0 "[ . 1 . 2]" 1 1424 1 28 GLU HG2 1 39 SER H . . 5.150 3.990 3.449 5.177 0.027 20 0 "[ . 1 . 2]" 1 1425 1 39 SER H 1 41 LEU QD . . 5.000 4.723 4.622 4.913 . 0 0 "[ . 1 . 2]" 1 1426 1 39 SER H 1 41 LEU HG . . 5.360 4.765 4.611 5.286 . 0 0 "[ . 1 . 2]" 1 1427 1 40 THR H 1 41 LEU HG . . 5.630 4.088 3.916 4.310 . 0 0 "[ . 1 . 2]" 1 1428 1 40 THR H 1 41 LEU QD . . 5.590 4.407 4.301 4.535 . 0 0 "[ . 1 . 2]" 1 1429 1 38 ARG QD 1 40 THR H . . 5.530 4.688 3.134 5.365 . 0 0 "[ . 1 . 2]" 1 1430 1 39 SER HB2 1 40 THR H . . 4.330 3.499 3.182 3.851 . 0 0 "[ . 1 . 2]" 1 1431 1 41 LEU H 1 43 GLY H . . 5.590 6.054 5.879 6.329 0.739 6 5 "[ *-+* 1 .* 2]" 1 1432 1 42 PRO HB3 1 43 GLY H . . 4.920 3.377 3.226 3.481 . 0 0 "[ . 1 . 2]" 1 1433 1 42 PRO HB2 1 43 GLY H . . 5.450 3.594 3.382 3.697 . 0 0 "[ . 1 . 2]" 1 1434 1 42 PRO QD 1 45 GLN H . . 4.900 3.724 3.521 3.952 . 0 0 "[ . 1 . 2]" 1 1435 1 46 ARG H 1 47 TYR HA . . 5.740 5.288 5.237 5.328 . 0 0 "[ . 1 . 2]" 1 1436 1 44 SER H 1 47 TYR H . . 5.930 5.802 5.462 5.987 0.057 4 0 "[ . 1 . 2]" 1 1437 1 45 GLN H 1 47 TYR H . . 3.900 4.194 3.968 4.312 0.412 5 0 "[ . 1 . 2]" 1 1438 1 48 ALA H 1 66 VAL HA . . 4.900 5.094 5.043 5.137 0.237 15 0 "[ . 1 . 2]" 1 1439 1 47 TYR HA 1 49 LEU H . . 5.690 6.077 5.994 6.152 0.462 16 0 "[ . 1 . 2]" 1 1440 1 50 ILE H 1 61 SER HA . . 4.770 4.313 4.191 4.516 . 0 0 "[ . 1 . 2]" 1 1441 1 50 ILE H 1 64 ILE H . . 4.930 4.082 3.973 4.625 . 0 0 "[ . 1 . 2]" 1 1442 1 51 HIS H 1 62 VAL H . . 5.970 4.587 4.353 4.667 . 0 0 "[ . 1 . 2]" 1 1443 1 51 HIS H 1 52 LEU HA . . 4.860 5.018 4.480 5.140 0.280 11 0 "[ . 1 . 2]" 1 1444 1 2 VAL HB 1 51 HIS H . . 4.800 3.689 3.545 4.003 . 0 0 "[ . 1 . 2]" 1 1445 1 50 ILE HG13 1 51 HIS H . . 4.980 5.000 4.835 5.061 0.081 16 0 "[ . 1 . 2]" 1 1446 1 3 SER HA 1 53 THR H . . 5.400 5.546 5.410 5.619 0.219 16 0 "[ . 1 . 2]" 1 1447 1 5 ARG H 1 53 THR H . . 5.160 4.728 4.530 4.817 . 0 0 "[ . 1 . 2]" 1 1448 1 6 LEU H 1 53 THR H . . 4.170 3.654 3.453 3.807 . 0 0 "[ . 1 . 2]" 1 1449 1 53 THR H 1 59 THR MG . . 4.550 3.213 3.056 3.448 . 0 0 "[ . 1 . 2]" 1 1450 1 54 ASN H 1 58 GLU HG3 . . 5.010 5.098 4.469 5.451 0.441 4 0 "[ . 1 . 2]" 1 1451 1 54 ASN H 1 136 ILE HB . . 4.980 4.125 4.029 4.253 . 0 0 "[ . 1 . 2]" 1 1452 1 54 ASN H 1 54 ASN HD22 . . 5.210 4.339 4.151 4.922 . 0 0 "[ . 1 . 2]" 1 1453 1 54 ASN H 1 56 ALA H . . 5.150 4.543 4.473 4.624 . 0 0 "[ . 1 . 2]" 1 1454 1 54 ASN H 1 54 ASN HD21 . . 5.270 4.175 3.996 4.778 . 0 0 "[ . 1 . 2]" 1 1455 1 54 ASN HD21 1 55 TYR H . . 5.970 4.583 3.651 4.840 . 0 0 "[ . 1 . 2]" 1 1456 1 53 THR HA 1 57 ASP H . . 5.630 5.015 4.950 5.082 . 0 0 "[ . 1 . 2]" 1 1457 1 53 THR HB 1 57 ASP H . . 5.130 5.332 5.256 5.378 0.248 4 0 "[ . 1 . 2]" 1 1458 1 57 ASP H 1 58 GLU HG3 . . 4.930 4.638 3.557 5.244 0.314 12 0 "[ . 1 . 2]" 1 1459 1 58 GLU H 1 59 THR HA . . 5.500 5.120 5.078 5.164 . 0 0 "[ . 1 . 2]" 1 1460 1 54 ASN HD22 1 58 GLU H . . 4.830 3.469 3.311 3.724 . 0 0 "[ . 1 . 2]" 1 1461 1 55 TYR H 1 58 GLU H . . 5.610 5.360 5.263 5.444 . 0 0 "[ . 1 . 2]" 1 1462 1 54 ASN H 1 59 THR H . . 5.280 4.646 4.530 4.707 . 0 0 "[ . 1 . 2]" 1 1463 1 53 THR HA 1 59 THR H . . 4.900 3.841 3.746 3.903 . 0 0 "[ . 1 . 2]" 1 1464 1 59 THR HB 1 60 ILE H . . 4.200 3.712 3.575 3.870 . 0 0 "[ . 1 . 2]" 1 1465 1 61 SER H 1 74 TYR HA . . 4.810 4.871 4.679 4.955 0.145 10 0 "[ . 1 . 2]" 1 1466 1 61 SER H 1 76 ALA HA . . 4.910 4.150 3.951 4.306 . 0 0 "[ . 1 . 2]" 1 1467 1 61 SER H 1 62 VAL HA . . 5.130 5.100 5.060 5.195 0.065 19 0 "[ . 1 . 2]" 1 1468 1 61 SER HB3 1 62 VAL H . . 4.950 3.338 3.147 3.470 . 0 0 "[ . 1 . 2]" 1 1469 1 50 ILE HA 1 62 VAL H . . 5.560 4.171 4.126 4.231 . 0 0 "[ . 1 . 2]" 1 1470 1 50 ILE H 1 63 ALA H . . 4.940 4.785 4.698 4.865 . 0 0 "[ . 1 . 2]" 1 1471 1 63 ALA H 1 71 VAL HA . . 5.070 5.297 5.259 5.373 0.303 8 0 "[ . 1 . 2]" 1 1472 1 61 SER HB2 1 63 ALA H . . 5.350 5.626 5.442 5.711 0.361 15 0 "[ . 1 . 2]" 1 1473 1 62 VAL HB 1 63 ALA H . . 4.860 4.164 4.121 4.195 . 0 0 "[ . 1 . 2]" 1 1474 1 63 ALA H 1 95 VAL QG . . 5.370 4.469 4.372 4.591 . 0 0 "[ . 1 . 2]" 1 1475 1 47 TYR HB3 1 64 ILE H . . 4.970 3.813 3.688 4.706 . 0 0 "[ . 1 . 2]" 1 1476 1 64 ILE H 1 71 VAL HA . . 5.860 4.866 4.700 4.928 . 0 0 "[ . 1 . 2]" 1 1477 1 47 TYR HA 1 64 ILE H . . 4.950 4.264 4.019 4.429 . 0 0 "[ . 1 . 2]" 1 1478 1 49 LEU H 1 64 ILE H . . 5.520 4.699 4.579 5.087 . 0 0 "[ . 1 . 2]" 1 1479 1 65 ASP H 1 69 VAL H . . 5.060 5.012 4.810 5.163 0.103 10 0 "[ . 1 . 2]" 1 1480 1 47 TYR HA 1 65 ASP H . . 5.900 4.523 4.475 4.587 . 0 0 "[ . 1 . 2]" 1 1481 1 46 ARG HA 1 66 VAL H . . 5.530 3.565 3.408 3.795 . 0 0 "[ . 1 . 2]" 1 1482 1 47 TYR HA 1 66 VAL H . . 4.640 2.607 2.513 2.687 . 0 0 "[ . 1 . 2]" 1 1483 1 65 ASP HA 1 67 THR H . . 5.120 3.700 3.597 3.760 . 0 0 "[ . 1 . 2]" 1 1484 1 67 THR H 1 68 ASN HB2 . . 5.240 4.754 4.590 4.853 . 0 0 "[ . 1 . 2]" 1 1485 1 46 ARG QG 1 67 THR H . . 5.260 3.927 3.195 4.358 . 0 0 "[ . 1 . 2]" 1 1486 1 25 LEU QD 1 68 ASN H . . 5.800 4.479 4.307 4.662 . 0 0 "[ . 1 . 2]" 1 1487 1 66 VAL HA 1 68 ASN H . . 5.060 3.953 3.820 4.126 . 0 0 "[ . 1 . 2]" 1 1488 1 66 VAL HA 1 69 VAL H . . 5.340 3.246 3.131 3.352 . 0 0 "[ . 1 . 2]" 1 1489 1 66 VAL QG 1 69 VAL H . . 4.510 4.381 4.327 4.439 . 0 0 "[ . 1 . 2]" 1 1490 1 64 ILE HA 1 70 TYR H . . 4.920 5.203 5.114 5.286 0.366 15 0 "[ . 1 . 2]" 1 1491 1 70 TYR QD 1 71 VAL H . . 4.960 3.508 3.032 4.040 . 0 0 "[ . 1 . 2]" 1 1492 1 72 MET H 1 73 GLY HA2 . . 5.290 4.570 4.520 4.633 . 0 0 "[ . 1 . 2]" 1 1493 1 63 ALA H 1 74 TYR H . . 4.900 4.090 4.002 4.230 . 0 0 "[ . 1 . 2]" 1 1494 1 60 ILE MD 1 75 ARG H . . 5.100 4.410 4.104 4.735 . 0 0 "[ . 1 . 2]" 1 1495 1 63 ALA H 1 72 MET H . . 5.090 4.199 4.116 4.272 . 0 0 "[ . 1 . 2]" 1 1496 1 61 SER HB2 1 75 ARG H . . 5.670 3.271 2.945 3.598 . 0 0 "[ . 1 . 2]" 1 1497 1 76 ALA H 1 80 SER QB . . 5.370 4.264 4.193 4.396 . 0 0 "[ . 1 . 2]" 1 1498 1 75 ARG HG2 1 77 GLY H . . 5.820 3.109 2.975 3.191 . 0 0 "[ . 1 . 2]" 1 1499 1 60 ILE HA 1 77 GLY H . . 5.040 4.432 4.257 4.572 . 0 0 "[ . 1 . 2]" 1 1500 1 77 GLY H 1 79 THR H . . 4.870 4.605 4.545 4.666 . 0 0 "[ . 1 . 2]" 1 1501 1 80 SER H 1 100 LYS H . . 4.820 4.869 4.796 4.984 0.164 3 0 "[ . 1 . 2]" 1 1502 1 81 TYR H 1 82 PHE QE . . 5.460 3.938 3.778 4.752 . 0 0 "[ . 1 . 2]" 1 1503 1 81 TYR H 1 103 VAL H . . 5.460 4.137 4.044 4.764 . 0 0 "[ . 1 . 2]" 1 1504 1 74 TYR H 1 82 PHE H . . 5.210 4.689 4.594 4.774 . 0 0 "[ . 1 . 2]" 1 1505 1 74 TYR H 1 83 PHE H . . 5.140 5.424 5.340 5.502 0.362 6 0 "[ . 1 . 2]" 1 1506 1 83 PHE H 1 151 LEU MD1 . . 5.990 5.411 5.225 5.830 . 0 0 "[ . 1 . 2]" 1 1507 1 84 ASN H 1 105 LEU H . . 5.880 3.898 3.782 4.018 . 0 0 "[ . 1 . 2]" 1 1508 1 83 PHE HB2 1 88 ALA H . . 5.120 4.050 3.798 4.331 . 0 0 "[ . 1 . 2]" 1 1509 1 87 SER HA 1 89 THR H . . 4.220 4.487 4.373 4.587 0.367 17 0 "[ . 1 . 2]" 1 1510 1 83 PHE HB2 1 89 THR H . . 5.110 5.448 5.338 5.574 0.464 13 0 "[ . 1 . 2]" 1 1511 1 89 THR HA 1 90 GLU H . . 3.670 3.563 3.549 3.585 . 0 0 "[ . 1 . 2]" 1 1512 1 89 THR HA 1 92 ALA H . . 3.660 3.202 3.076 3.287 . 0 0 "[ . 1 . 2]" 1 1513 1 92 ALA H 1 95 VAL QG . . 3.950 3.876 3.742 3.964 0.014 13 0 "[ . 1 . 2]" 1 1514 1 93 LYS H 1 94 TYR QB . . 5.020 4.706 4.611 4.772 . 0 0 "[ . 1 . 2]" 1 1515 1 90 GLU HA 1 93 LYS H . . 4.060 3.585 3.433 3.775 . 0 0 "[ . 1 . 2]" 1 1516 1 93 LYS H 1 94 TYR QD . . 3.840 3.530 3.139 3.721 . 0 0 "[ . 1 . 2]" 1 1517 1 44 SER HA 1 94 TYR H . . 5.100 5.450 5.304 6.290 1.190 5 1 "[ + 1 . 2]" 1 1518 1 91 ALA HA 1 94 TYR H . . 3.970 3.672 3.583 3.751 . 0 0 "[ . 1 . 2]" 1 1519 1 93 LYS HB2 1 94 TYR H . . 3.990 3.154 3.052 3.235 . 0 0 "[ . 1 . 2]" 1 1520 1 94 TYR H 1 95 VAL QG . . 3.310 3.227 3.163 3.261 . 0 0 "[ . 1 . 2]" 1 1521 1 91 ALA MB 1 95 VAL H . . 4.110 4.171 4.039 4.299 0.189 20 0 "[ . 1 . 2]" 1 1522 1 94 TYR QD 1 95 VAL H . . 3.670 3.741 3.660 3.819 0.149 7 0 "[ . 1 . 2]" 1 1523 1 95 VAL H 1 97 LYS H . . 4.970 5.181 5.114 5.268 0.298 5 0 "[ . 1 . 2]" 1 1524 1 96 PHE H 1 97 LYS HA . . 4.920 5.244 5.204 5.275 0.355 15 0 "[ . 1 . 2]" 1 1525 1 95 VAL QG 1 97 LYS H . . 4.880 4.510 4.480 4.539 . 0 0 "[ . 1 . 2]" 1 1526 1 97 LYS H 1 98 ASP HB2 . . 5.130 5.049 4.933 5.159 0.029 16 0 "[ . 1 . 2]" 1 1527 1 96 PHE HB2 1 97 LYS H . . 5.100 4.224 4.208 4.262 . 0 0 "[ . 1 . 2]" 1 1528 1 80 SER QB 1 101 ARG H . . 5.310 4.743 3.950 4.947 . 0 0 "[ . 1 . 2]" 1 1529 1 80 SER H 1 102 LYS H . . 4.990 4.796 4.675 4.854 . 0 0 "[ . 1 . 2]" 1 1530 1 82 PHE QD 1 103 VAL H . . 5.070 3.516 2.683 3.883 . 0 0 "[ . 1 . 2]" 1 1531 1 105 LEU H 1 106 PRO HD3 . . 5.110 4.579 4.543 4.628 . 0 0 "[ . 1 . 2]" 1 1532 1 107 TYR H 1 108 SER HA . . 4.250 4.583 4.492 4.615 0.365 11 0 "[ . 1 . 2]" 1 1533 1 107 TYR H 1 107 TYR QD . . 3.110 3.357 3.249 3.390 0.280 20 0 "[ . 1 . 2]" 1 1534 1 108 SER H 1 114 LEU HA . . 5.070 5.477 4.448 5.950 0.880 14 3 "[ . 1 * +. -2]" 1 1535 1 84 ASN HB3 1 108 SER H . . 5.470 3.757 3.399 4.880 . 0 0 "[ . 1 . 2]" 1 1536 1 108 SER H 1 114 LEU MD2 . . 5.220 4.319 3.184 4.666 . 0 0 "[ . 1 . 2]" 1 1537 1 84 ASN HB3 1 109 GLY H . . 5.180 5.442 5.086 5.866 0.686 16 1 "[ . 1 .+ 2]" 1 1538 1 110 ASN H 1 113 ARG H . . 3.920 4.174 4.094 4.245 0.325 16 0 "[ . 1 . 2]" 1 1539 1 112 GLU H 1 114 LEU HG . . 5.710 4.939 4.765 5.272 . 0 0 "[ . 1 . 2]" 1 1540 1 110 ASN HB3 1 112 GLU H . . 4.590 4.576 4.431 4.765 0.175 3 0 "[ . 1 . 2]" 1 1541 1 112 GLU H 1 114 LEU H . . 4.930 4.054 3.939 4.160 . 0 0 "[ . 1 . 2]" 1 1542 1 110 ASN HA 1 113 ARG H . . 5.280 4.913 4.852 4.993 . 0 0 "[ . 1 . 2]" 1 1543 1 107 TYR HB2 1 116 ILE H . . 5.810 6.141 6.047 6.248 0.438 19 0 "[ . 1 . 2]" 1 1544 1 115 GLN H 1 119 GLY H . . 5.390 5.819 5.710 6.001 0.611 15 2 "[ - 1 + 2]" 1 1545 1 119 GLY H 1 120 LYS HB2 . . 5.020 5.128 5.024 5.236 0.216 15 0 "[ . 1 . 2]" 1 1546 1 120 LYS H 1 121 ILE MG . . 4.050 4.436 4.352 4.536 0.486 11 0 "[ . 1 . 2]" 1 1547 1 121 ILE H 1 124 ASN HB2 . . 4.910 3.164 2.915 3.675 . 0 0 "[ . 1 . 2]" 1 1548 1 120 LYS QE 1 121 ILE H . . 5.190 5.014 4.802 5.384 0.194 10 0 "[ . 1 . 2]" 1 1549 1 120 LYS HB2 1 121 ILE H . . 3.670 4.149 4.083 4.237 0.567 16 6 "[- * . **1 * .+ 2]" 1 1550 1 121 ILE HA 1 123 GLU H . . 5.220 4.301 3.994 4.485 . 0 0 "[ . 1 . 2]" 1 1551 1 124 ASN H 1 125 ILE HA . . 4.790 4.723 4.658 4.793 0.003 4 0 "[ . 1 . 2]" 1 1552 1 125 ILE H 1 180 LEU HA . . 5.180 4.441 4.295 4.716 . 0 0 "[ . 1 . 2]" 1 1553 1 127 LEU H 1 181 PRO QD . . 5.090 3.200 2.735 3.851 . 0 0 "[ . 1 . 2]" 1 1554 1 127 LEU H 1 178 THR HA . . 5.090 4.656 3.996 5.045 . 0 0 "[ . 1 . 2]" 1 1555 1 121 ILE HB 1 124 ASN H . . 4.410 4.202 4.106 4.320 . 0 0 "[ . 1 . 2]" 1 1556 1 122 ARG H 1 125 ILE H . . 5.420 5.080 4.939 5.246 . 0 0 "[ . 1 . 2]" 1 1557 1 127 LEU H 1 179 PHE HA . . 5.150 4.388 4.035 4.569 . 0 0 "[ . 1 . 2]" 1 1558 1 129 LEU H 1 175 VAL H . . 5.590 4.676 4.521 4.843 . 0 0 "[ . 1 . 2]" 1 1559 1 129 LEU H 1 131 ALA H . . 5.310 3.954 3.890 4.058 . 0 0 "[ . 1 . 2]" 1 1560 1 131 ALA H 1 134 SER H . . 4.880 4.507 4.450 4.575 . 0 0 "[ . 1 . 2]" 1 1561 1 131 ALA H 1 178 THR HA . . 5.460 5.213 4.775 5.443 . 0 0 "[ . 1 . 2]" 1 1562 1 128 GLY HA2 1 131 ALA H . . 5.610 4.629 4.561 4.702 . 0 0 "[ . 1 . 2]" 1 1563 1 127 LEU HA 1 131 ALA H . . 5.180 4.975 4.767 5.196 0.016 5 0 "[ . 1 . 2]" 1 1564 1 131 ALA H 1 171 ILE MG . . 4.780 4.924 4.781 4.986 0.206 7 0 "[ . 1 . 2]" 1 1565 1 55 TYR QE 1 133 ASP H . . 4.990 4.992 4.753 5.197 0.207 8 0 "[ . 1 . 2]" 1 1566 1 55 TYR H 1 134 SER H . . 5.550 5.932 5.877 6.004 0.454 18 0 "[ . 1 . 2]" 1 1567 1 135 ALA H 1 136 ILE HA . . 5.070 5.298 5.267 5.331 0.261 9 0 "[ . 1 . 2]" 1 1568 1 136 ILE H 1 137 THR HA . . 5.500 5.259 5.207 5.329 . 0 0 "[ . 1 . 2]" 1 1569 1 136 ILE H 1 139 LEU QB . . 4.480 4.642 4.602 4.678 0.198 19 0 "[ . 1 . 2]" 1 1570 1 136 ILE H 1 139 LEU HG . . 5.750 4.946 4.877 4.998 . 0 0 "[ . 1 . 2]" 1 1571 1 137 THR H 1 140 PHE H . . 5.280 4.667 4.613 4.713 . 0 0 "[ . 1 . 2]" 1 1572 1 136 ILE HA 1 138 THR H . . 5.290 4.622 4.540 4.745 . 0 0 "[ . 1 . 2]" 1 1573 1 138 THR H 1 140 PHE H . . 5.210 4.237 4.159 4.305 . 0 0 "[ . 1 . 2]" 1 1574 1 139 LEU H 1 142 TYR H . . 5.050 4.712 4.653 4.753 . 0 0 "[ . 1 . 2]" 1 1575 1 138 THR HA 1 139 LEU H . . 3.530 3.542 3.533 3.548 0.018 6 0 "[ . 1 . 2]" 1 1576 1 136 ILE H 1 140 PHE H . . 5.290 5.626 5.559 5.674 0.384 5 0 "[ . 1 . 2]" 1 1577 1 140 PHE H 1 141 TYR HA . . 5.160 5.283 5.258 5.307 0.147 18 0 "[ . 1 . 2]" 1 1578 1 136 ILE HA 1 140 PHE H . . 5.130 3.550 3.356 3.666 . 0 0 "[ . 1 . 2]" 1 1579 1 141 TYR H 1 141 TYR QD . . 3.300 3.103 2.703 3.433 0.133 17 0 "[ . 1 . 2]" 1 1580 1 142 TYR HB2 1 143 ASN H . . 4.050 4.545 4.522 4.560 0.510 17 6 "[- * **1 * + 2]" 1 1581 1 141 TYR HB3 1 143 ASN H . . 5.170 4.306 3.978 4.481 . 0 0 "[ . 1 . 2]" 1 1582 1 142 TYR QE 1 144 ALA H . . 5.090 4.514 4.404 4.671 . 0 0 "[ . 1 . 2]" 1 1583 1 142 TYR QD 1 144 ALA H . . 5.050 4.182 3.999 4.350 . 0 0 "[ . 1 . 2]" 1 1584 1 144 ALA HA 1 146 SER H . . 4.500 3.772 3.377 4.601 0.101 17 0 "[ . 1 . 2]" 1 1585 1 146 SER HA 1 148 ALA H . . 4.490 3.859 3.605 4.135 . 0 0 "[ . 1 . 2]" 1 1586 1 144 ALA HA 1 148 ALA H . . 5.440 4.117 3.625 4.585 . 0 0 "[ . 1 . 2]" 1 1587 1 146 SER HA 1 150 ALA H . . 5.060 4.862 4.424 5.244 0.184 8 0 "[ . 1 . 2]" 1 1588 1 139 LEU HG 1 150 ALA H . . 4.940 5.267 5.196 5.345 0.405 9 0 "[ . 1 . 2]" 1 1589 1 151 LEU H 1 152 MET HG3 . . 5.560 4.654 4.382 6.134 0.574 10 1 "[ . + . 2]" 1 1590 1 149 SER H 1 152 MET H . . 5.590 4.681 4.573 4.784 . 0 0 "[ . 1 . 2]" 1 1591 1 151 LEU H 1 153 VAL H . . 4.480 4.399 4.145 4.472 . 0 0 "[ . 1 . 2]" 1 1592 1 150 ALA HA 1 153 VAL H . . 3.620 3.477 3.303 3.549 . 0 0 "[ . 1 . 2]" 1 1593 1 152 MET HG3 1 153 VAL H . . 5.170 4.374 4.167 4.863 . 0 0 "[ . 1 . 2]" 1 1594 1 152 MET HB3 1 153 VAL H . . 4.560 3.428 3.266 3.608 . 0 0 "[ . 1 . 2]" 1 1595 1 153 VAL HA 1 154 LEU H . . 4.830 3.499 3.485 3.538 . 0 0 "[ . 1 . 2]" 1 1596 1 151 LEU H 1 154 LEU H . . 5.500 4.686 4.551 4.879 . 0 0 "[ . 1 . 2]" 1 1597 1 152 MET HA 1 155 ILE H . . 4.900 3.535 3.366 3.688 . 0 0 "[ . 1 . 2]" 1 1598 1 154 LEU HA 1 155 ILE H . . 4.940 3.578 3.556 3.591 . 0 0 "[ . 1 . 2]" 1 1599 1 156 GLN H 1 157 SER HA . . 5.080 5.251 5.183 5.305 0.225 7 0 "[ . 1 . 2]" 1 1600 1 153 VAL H 1 156 GLN H . . 5.080 5.001 4.807 5.107 0.027 18 0 "[ . 1 . 2]" 1 1601 1 157 SER H 1 158 THR HA . . 4.990 5.246 5.223 5.281 0.291 12 0 "[ . 1 . 2]" 1 1602 1 21 LEU QD 1 158 THR H . . 4.850 4.585 4.471 4.725 . 0 0 "[ . 1 . 2]" 1 1603 1 159 SER H 1 161 ALA H . . 5.010 4.328 4.226 4.459 . 0 0 "[ . 1 . 2]" 1 1604 1 156 GLN HA 1 160 GLU H . . 4.020 2.819 2.640 3.024 . 0 0 "[ . 1 . 2]" 1 1605 1 155 ILE MG 1 160 GLU H . . 3.150 3.303 3.209 3.476 0.326 4 0 "[ . 1 . 2]" 1 1606 1 18 ILE MG 1 161 ALA H . . 5.040 4.430 4.273 4.587 . 0 0 "[ . 1 . 2]" 1 1607 1 157 SER HA 1 161 ALA H . . 4.890 4.379 4.195 4.660 . 0 0 "[ . 1 . 2]" 1 1608 1 160 GLU HA 1 161 ALA H . . 4.790 3.537 3.506 3.552 . 0 0 "[ . 1 . 2]" 1 1609 1 159 SER H 1 162 ALA H . . 5.160 4.667 4.577 4.775 . 0 0 "[ . 1 . 2]" 1 1610 1 158 THR HA 1 162 ALA H . . 4.820 4.107 3.970 4.328 . 0 0 "[ . 1 . 2]" 1 1611 1 166 PHE QD 1 167 ILE H . . 5.170 3.473 3.304 3.718 . 0 0 "[ . 1 . 2]" 1 1612 1 166 PHE HA 1 167 ILE H . . 4.900 3.530 3.507 3.544 . 0 0 "[ . 1 . 2]" 1 1613 1 166 PHE HB3 1 167 ILE H . . 4.950 2.479 2.334 2.705 . 0 0 "[ . 1 . 2]" 1 1614 1 167 ILE H 1 167 ILE HG12 . . 4.890 3.262 3.191 3.418 . 0 0 "[ . 1 . 2]" 1 1615 1 161 ALA MB 1 167 ILE H . . 5.310 4.982 4.845 5.086 . 0 0 "[ . 1 . 2]" 1 1616 1 166 PHE HA 1 168 GLU H . . 4.900 4.485 4.392 4.721 . 0 0 "[ . 1 . 2]" 1 1617 1 167 ILE MG 1 170 GLN H . . 4.960 4.872 4.675 5.010 0.050 20 0 "[ . 1 . 2]" 1 1618 1 169 GLN HG2 1 170 GLN H . . 4.800 5.004 4.920 5.102 0.302 6 0 "[ . 1 . 2]" 1 1619 1 169 GLN HG3 1 170 GLN H . . 5.460 4.302 4.187 4.365 . 0 0 "[ . 1 . 2]" 1 1620 1 169 GLN HA 1 170 GLN H . . 4.870 3.548 3.503 3.566 . 0 0 "[ . 1 . 2]" 1 1621 1 169 GLN H 1 170 GLN H . . 4.160 2.759 2.610 2.860 . 0 0 "[ . 1 . 2]" 1 1622 1 171 ILE H 1 174 ARG H . . 5.510 5.181 5.039 5.409 . 0 0 "[ . 1 . 2]" 1 1623 1 169 GLN HA 1 171 ILE H . . 5.170 4.585 4.401 4.726 . 0 0 "[ . 1 . 2]" 1 1624 1 14 TYR QD 1 172 GLY H . . 5.680 3.472 3.262 3.763 . 0 0 "[ . 1 . 2]" 1 1625 1 170 GLN H 1 172 GLY H . . 5.200 4.181 4.067 4.320 . 0 0 "[ . 1 . 2]" 1 1626 1 171 ILE HA 1 174 ARG H . . 4.800 3.745 3.632 3.934 . 0 0 "[ . 1 . 2]" 1 1627 1 129 LEU H 1 174 ARG H . . 5.560 4.319 4.124 4.493 . 0 0 "[ . 1 . 2]" 1 1628 1 129 LEU H 1 177 LYS H . . 5.060 4.701 4.512 5.152 0.092 5 0 "[ . 1 . 2]" 1 1629 1 177 LYS H 1 178 THR HA . . 5.360 4.636 4.552 5.298 . 0 0 "[ . 1 . 2]" 1 1630 1 178 THR H 1 179 PHE QD . . 4.940 5.087 4.712 5.262 0.322 18 0 "[ . 1 . 2]" 1 1631 1 128 GLY HA2 1 179 PHE H . . 5.070 5.004 4.755 5.189 0.119 1 0 "[ . 1 . 2]" 1 1632 1 131 ALA MB 1 179 PHE H . . 5.140 4.671 4.155 4.826 . 0 0 "[ . 1 . 2]" 1 1633 1 182 SER H 1 185 ILE HA . . 4.910 5.249 5.175 5.309 0.399 19 0 "[ . 1 . 2]" 1 1634 1 184 ALA H 1 185 ILE HG13 . . 5.220 4.283 4.186 4.397 . 0 0 "[ . 1 . 2]" 1 1635 1 185 ILE H 1 187 SER H . . 5.140 4.121 4.059 4.224 . 0 0 "[ . 1 . 2]" 1 1636 1 183 LEU H 1 185 ILE H . . 6.040 4.396 4.328 4.502 . 0 0 "[ . 1 . 2]" 1 1637 1 185 ILE HA 1 186 ILE H . . 5.120 3.532 3.519 3.544 . 0 0 "[ . 1 . 2]" 1 1638 1 187 SER H 1 189 GLU H . . 5.450 4.355 4.123 4.578 . 0 0 "[ . 1 . 2]" 1 1639 1 188 LEU H 1 188 LEU HG . . 3.550 2.230 2.013 3.281 . 0 0 "[ . 1 . 2]" 1 1640 1 189 GLU H 1 190 ASN HA . . 5.190 5.344 5.210 5.423 0.233 9 0 "[ . 1 . 2]" 1 1641 1 167 ILE MD 1 189 GLU H . . 4.130 3.239 2.967 3.894 . 0 0 "[ . 1 . 2]" 1 1642 1 185 ILE MG 1 189 GLU H . . 4.350 4.425 4.207 4.597 0.247 2 0 "[ . 1 . 2]" 1 1643 1 188 LEU HG 1 189 GLU H . . 4.140 4.187 2.418 4.407 0.267 4 0 "[ . 1 . 2]" 1 1644 1 188 LEU QB 1 189 GLU H . . 5.010 2.478 2.316 3.575 . 0 0 "[ . 1 . 2]" 1 1645 1 197 LYS H 1 241 PRO QD . . 4.900 4.224 3.591 4.486 . 0 0 "[ . 1 . 2]" 1 1646 1 195 LEU H 1 197 LYS H . . 5.560 4.172 4.076 4.255 . 0 0 "[ . 1 . 2]" 1 1647 1 194 ALA HA 1 198 GLN H . . 4.990 4.224 3.897 4.535 . 0 0 "[ . 1 . 2]" 1 1648 1 197 LYS HA 1 198 GLN H . . 3.720 3.522 3.488 3.560 . 0 0 "[ . 1 . 2]" 1 1649 1 197 LYS HB3 1 198 GLN H . . 3.600 2.543 2.372 2.768 . 0 0 "[ . 1 . 2]" 1 1650 1 199 ILE H 1 209 PHE HZ . . 5.090 4.809 4.403 5.084 . 0 0 "[ . 1 . 2]" 1 1651 1 199 ILE HA 1 200 GLN H . . 4.890 3.535 3.515 3.564 . 0 0 "[ . 1 . 2]" 1 1652 1 201 ILE H 1 243 ARG QD . . 5.470 4.218 2.830 5.807 0.337 8 0 "[ . 1 . 2]" 1 1653 1 199 ILE HA 1 201 ILE H . . 5.820 4.770 4.694 4.838 . 0 0 "[ . 1 . 2]" 1 1654 1 202 ALA H 1 209 PHE QD . . 5.610 5.298 4.730 5.495 . 0 0 "[ . 1 . 2]" 1 1655 1 202 ALA H 1 209 PHE HA . . 5.270 4.657 4.292 4.944 . 0 0 "[ . 1 . 2]" 1 1656 1 202 ALA H 1 205 ASN HB3 . . 5.170 4.413 4.262 4.520 . 0 0 "[ . 1 . 2]" 1 1657 1 203 SER H 1 205 ASN HB3 . . 5.130 4.915 4.874 4.961 . 0 0 "[ . 1 . 2]" 1 1658 1 199 ILE HA 1 203 SER H . . 5.230 3.965 3.768 4.167 . 0 0 "[ . 1 . 2]" 1 1659 1 201 ILE H 1 203 SER H . . 4.910 4.126 4.053 4.231 . 0 0 "[ . 1 . 2]" 1 1660 1 204 THR H 1 207 GLY H . . 4.860 4.883 4.836 4.935 0.075 16 0 "[ . 1 . 2]" 1 1661 1 205 ASN H 1 206 ASN HB2 . . 4.970 5.192 5.131 5.248 0.278 9 0 "[ . 1 . 2]" 1 1662 1 205 ASN H 1 207 GLY HA3 . . 5.200 5.577 5.499 5.753 0.553 7 1 "[ . + 1 . 2]" 1 1663 1 205 ASN HA 1 207 GLY H . . 4.900 4.334 4.278 4.403 . 0 0 "[ . 1 . 2]" 1 1664 1 205 ASN HD21 1 208 GLN H . . 4.610 3.624 3.504 3.747 . 0 0 "[ . 1 . 2]" 1 1665 1 205 ASN HA 1 208 GLN H . . 5.580 4.664 4.550 4.756 . 0 0 "[ . 1 . 2]" 1 1666 1 209 PHE H 1 228 VAL MG2 . . 5.120 5.639 5.402 5.970 0.850 20 8 "[ * * ** *.-* +]" 1 1667 1 202 ALA MB 1 209 PHE H . . 4.820 4.053 3.767 4.400 . 0 0 "[ . 1 . 2]" 1 1668 1 209 PHE HB3 1 211 THR H . . 4.220 2.738 2.434 3.574 . 0 0 "[ . 1 . 2]" 1 1669 1 209 PHE HA 1 211 THR H . . 4.080 3.643 3.317 4.357 0.277 1 0 "[ . 1 . 2]" 1 1670 1 212 PRO HA 1 213 VAL H . . 3.360 2.142 2.132 2.164 . 0 0 "[ . 1 . 2]" 1 1671 1 214 VAL H 1 225 ILE HB . . 5.300 5.560 5.393 5.727 0.427 2 0 "[ . 1 . 2]" 1 1672 1 213 VAL H 1 215 LEU H . . 5.920 6.178 6.138 6.251 0.331 15 0 "[ . 1 . 2]" 1 1673 1 187 SER H 1 216 ILE H . . 4.940 4.879 4.655 4.977 0.037 14 0 "[ . 1 . 2]" 1 1674 1 216 ILE HA 1 217 ASN H . . 3.790 2.127 2.105 2.152 . 0 0 "[ . 1 . 2]" 1 1675 1 184 ALA MB 1 219 GLN H . . 4.410 4.185 3.975 4.440 0.030 11 0 "[ . 1 . 2]" 1 1676 1 217 ASN H 1 219 GLN H . . 5.280 4.314 4.075 4.510 . 0 0 "[ . 1 . 2]" 1 1677 1 184 ALA MB 1 221 GLN H . . 4.970 4.988 4.744 5.213 0.243 13 0 "[ . 1 . 2]" 1 1678 1 221 GLN H 1 221 GLN HE21 . . 5.350 4.159 4.002 4.344 . 0 0 "[ . 1 . 2]" 1 1679 1 217 ASN HB3 1 219 GLN H . . 4.710 2.939 2.492 4.234 . 0 0 "[ . 1 . 2]" 1 1680 1 217 ASN HB2 1 219 GLN H . . 4.640 4.361 3.502 4.693 0.053 2 0 "[ . 1 . 2]" 1 1681 1 217 ASN HB3 1 221 GLN H . . 5.480 3.581 3.076 4.593 . 0 0 "[ . 1 . 2]" 1 1682 1 217 ASN HB3 1 223 VAL H . . 5.380 5.434 4.020 5.690 0.310 19 0 "[ . 1 . 2]" 1 1683 1 214 VAL HA 1 225 ILE H . . 5.230 3.485 3.298 3.779 . 0 0 "[ . 1 . 2]" 1 1684 1 224 THR HB 1 225 ILE H . . 5.330 4.264 4.146 4.373 . 0 0 "[ . 1 . 2]" 1 1685 1 213 VAL HB 1 225 ILE H . . 5.040 4.744 4.319 5.507 0.467 4 0 "[ . 1 . 2]" 1 1686 1 225 ILE H 1 225 ILE HG13 . . 4.990 4.048 3.967 4.159 . 0 0 "[ . 1 . 2]" 1 1687 1 209 PHE QD 1 227 ASN H . . 4.760 4.268 3.935 4.545 . 0 0 "[ . 1 . 2]" 1 1688 1 227 ASN H 1 229 ASP H . . 5.760 4.494 4.222 4.995 . 0 0 "[ . 1 . 2]" 1 1689 1 225 ILE HB 1 227 ASN H . . 4.970 4.856 4.577 5.034 0.064 18 0 "[ . 1 . 2]" 1 1690 1 230 ALA H 1 234 THR MG . . 5.000 4.248 3.863 4.635 . 0 0 "[ . 1 . 2]" 1 1691 1 232 VAL HB 1 233 VAL H . . 5.060 3.633 2.506 4.087 . 0 0 "[ . 1 . 2]" 1 1692 1 192 TRP H 1 194 ALA H . . 5.030 4.351 4.172 4.584 . 0 0 "[ . 1 . 2]" 1 1693 1 193 SER H 1 194 ALA MB . . 5.560 4.326 4.198 4.518 . 0 0 "[ . 1 . 2]" 1 1694 1 194 ALA H 1 213 VAL QG . . 3.900 3.892 3.713 4.141 0.241 2 0 "[ . 1 . 2]" 1 1695 1 194 ALA H 1 196 SER H . . 4.280 4.214 4.095 4.308 0.028 18 0 "[ . 1 . 2]" 1 1696 1 196 SER H 1 198 GLN H . . 5.640 3.998 3.895 4.126 . 0 0 "[ . 1 . 2]" 1 1697 1 196 SER H 1 241 PRO QD . . 4.870 4.296 4.082 4.462 . 0 0 "[ . 1 . 2]" 1 1698 1 36 LEU QD 1 242 ASN H . . 4.940 3.424 2.711 3.881 . 0 0 "[ . 1 . 2]" 1 1699 1 243 ARG HB2 1 244 ASN H . . 5.080 3.137 2.813 4.075 . 0 0 "[ . 1 . 2]" 1 1700 1 242 ASN HB2 1 244 ASN H . . 5.110 3.469 2.604 4.577 . 0 0 "[ . 1 . 2]" 1 1701 1 39 SER HA 1 245 ASN H . . 5.480 5.606 5.054 5.840 0.360 19 0 "[ . 1 . 2]" 1 1702 1 19 SER H 1 19 SER HA . . 3.090 2.782 2.777 2.788 . 0 0 "[ . 1 . 2]" 1 1703 1 10 THR H 1 10 THR HB . . 4.330 3.882 3.857 3.910 . 0 0 "[ . 1 . 2]" 1 1704 1 7 SER HB3 1 8 GLY H . . 4.230 4.334 4.293 4.373 0.143 16 0 "[ . 1 . 2]" 1 1705 1 28 GLU H 1 28 GLU HG3 . . 4.340 3.206 2.917 3.497 . 0 0 "[ . 1 . 2]" 1 1706 1 28 GLU HG3 1 29 ARG H . . 3.930 2.993 2.659 3.253 . 0 0 "[ . 1 . 2]" 1 1707 1 32 TYR H 1 32 TYR HB3 . . 4.370 4.069 3.181 4.133 . 0 0 "[ . 1 . 2]" 1 1708 1 32 TYR HB3 1 33 ASP H . . 4.590 4.378 4.071 4.432 . 0 0 "[ . 1 . 2]" 1 1709 1 233 VAL H 1 233 VAL MG1 . . 3.590 3.759 3.739 3.784 0.194 8 0 "[ . 1 . 2]" 1 1710 1 242 ASN H 1 242 ASN QD . . 5.020 3.830 2.516 4.294 . 0 0 "[ . 1 . 2]" 1 1711 1 36 LEU QD 1 242 ASN QD . . 5.300 2.299 1.911 3.104 . 0 0 "[ . 1 . 2]" 1 1712 1 121 ILE H 1 124 ASN QD . . 4.280 2.926 2.753 3.084 . 0 0 "[ . 1 . 2]" 1 1713 1 244 ASN HD21 1 245 ASN H . . 5.930 5.127 3.632 5.901 . 0 0 "[ . 1 . 2]" 1 1714 1 242 ASN HB2 1 245 ASN H . . 5.200 3.033 2.429 4.792 . 0 0 "[ . 1 . 2]" 1 1715 1 31 LEU QD 1 200 GLN QE . . 4.600 3.283 2.869 3.883 . 0 0 "[ . 1 . 2]" 1 1716 1 36 LEU QD 1 200 GLN QE . . 4.710 2.208 1.766 2.818 . 0 0 "[ . 1 . 2]" 1 1717 1 200 GLN QE 1 241 PRO QD . . 4.680 3.555 2.410 4.137 . 0 0 "[ . 1 . 2]" 1 1718 1 200 GLN H 1 200 GLN QE . . 5.020 4.108 3.228 4.629 . 0 0 "[ . 1 . 2]" 1 1719 1 200 GLN QE 1 243 ARG H . . 3.770 2.816 2.135 3.164 . 0 0 "[ . 1 . 2]" 1 1720 1 200 GLN HA 1 200 GLN QE . . 5.330 4.632 4.285 4.880 . 0 0 "[ . 1 . 2]" 1 1721 1 200 GLN HB3 1 200 GLN QE . . 4.530 3.863 3.749 4.213 . 0 0 "[ . 1 . 2]" 1 1722 1 221 GLN H 1 221 GLN HE22 . . 5.320 5.631 5.458 5.764 0.444 13 0 "[ . 1 . 2]" 1 1723 1 221 GLN HB2 1 221 GLN HE22 . . 4.490 4.334 4.242 4.437 . 0 0 "[ . 1 . 2]" 1 1724 1 221 GLN HB3 1 221 GLN HE22 . . 4.290 3.820 3.768 3.883 . 0 0 "[ . 1 . 2]" 1 1725 1 221 GLN HB2 1 221 GLN HE21 . . 4.510 3.828 3.761 3.932 . 0 0 "[ . 1 . 2]" 1 1726 1 169 GLN HB2 1 169 GLN QE . . 4.390 3.340 1.783 3.745 . 0 0 "[ . 1 . 2]" 1 1727 1 84 ASN H 1 84 ASN HD21 . . 5.470 4.545 4.340 4.673 . 0 0 "[ . 1 . 2]" 1 1728 1 84 ASN H 1 84 ASN HD22 . . 5.980 5.735 5.638 5.797 . 0 0 "[ . 1 . 2]" 1 1729 1 84 ASN HD21 1 106 PRO HA . . 5.160 3.848 3.129 4.878 . 0 0 "[ . 1 . 2]" 1 1730 1 84 ASN HD22 1 104 THR MG . . 4.810 3.429 2.913 4.659 . 0 0 "[ . 1 . 2]" 1 1731 1 219 GLN HA 1 219 GLN HE22 . . 4.510 4.274 3.113 4.971 0.461 1 0 "[ . 1 . 2]" 1 1732 1 201 ILE MG 1 205 ASN HD21 . . 5.050 3.019 2.650 3.325 . 0 0 "[ . 1 . 2]" 1 1733 1 205 ASN H 1 205 ASN HD21 . . 4.850 5.000 4.969 5.019 0.169 12 0 "[ . 1 . 2]" 1 1734 1 202 ALA HA 1 205 ASN HD21 . . 5.020 3.133 3.081 3.193 . 0 0 "[ . 1 . 2]" 1 1735 1 205 ASN HA 1 205 ASN HD22 . . 5.010 4.609 4.566 4.645 . 0 0 "[ . 1 . 2]" 1 1736 1 227 ASN HA 1 227 ASN HD22 . . 5.140 4.711 3.779 5.371 0.231 16 0 "[ . 1 . 2]" 1 1737 1 45 GLN QB 1 45 GLN HE22 . . 4.800 3.169 3.144 3.190 . 0 0 "[ . 1 . 2]" 1 1738 1 42 PRO QD 1 45 GLN HE22 . . 5.050 2.840 2.665 3.001 . 0 0 "[ . 1 . 2]" 1 1739 1 45 GLN HE22 1 45 GLN QG . . 3.800 3.473 3.464 3.481 . 0 0 "[ . 1 . 2]" 1 1740 1 110 ASN H 1 110 ASN QD . . 3.810 2.377 2.254 2.498 . 0 0 "[ . 1 . 2]" 1 1741 1 110 ASN QD 1 113 ARG H . . 4.620 3.585 3.448 3.697 . 0 0 "[ . 1 . 2]" 1 1742 1 110 ASN QD 1 112 GLU H . . 5.360 4.915 4.842 5.016 . 0 0 "[ . 1 . 2]" 1 1743 1 143 ASN H 1 143 ASN HD21 . . 4.460 3.069 2.374 3.952 . 0 0 "[ . 1 . 2]" 1 1744 1 138 THR MG 1 143 ASN HD21 . . 5.260 3.005 2.479 4.244 . 0 0 "[ . 1 . 2]" 1 1745 1 138 THR MG 1 143 ASN HD22 . . 5.240 4.377 4.044 4.980 . 0 0 "[ . 1 . 2]" 1 1746 1 227 ASN H 1 227 ASN HD22 . . 5.490 4.510 3.479 6.087 0.597 9 1 "[ . +1 . 2]" 1 1747 1 3 SER H 1 3 SER QB . . 3.040 3.130 3.101 3.154 0.114 4 0 "[ . 1 . 2]" 1 1748 1 22 ARG H 1 22 ARG HB3 . . 3.380 3.543 2.790 3.591 0.211 3 0 "[ . 1 . 2]" 1 1749 1 30 LYS H 1 30 LYS HE3 . . 4.850 4.713 3.767 5.197 0.347 13 0 "[ . 1 . 2]" 1 1750 1 58 GLU H 1 58 GLU HB2 . . 3.440 2.712 2.540 2.914 . 0 0 "[ . 1 . 2]" 1 1751 1 223 VAL H 1 223 VAL MG2 . . 2.640 2.221 2.014 2.350 . 0 0 "[ . 1 . 2]" 1 1752 1 72 MET H 1 72 MET QG . . 4.460 2.605 2.306 2.792 . 0 0 "[ . 1 . 2]" 1 1753 1 85 GLU H 1 85 GLU QG . . 2.700 2.041 1.808 2.610 . 0 0 "[ . 1 . 2]" 1 1754 1 93 LYS H 1 93 LYS HB3 . . 3.360 3.562 3.537 3.571 0.211 1 0 "[ . 1 . 2]" 1 1755 1 93 LYS H 1 93 LYS HB2 . . 3.110 2.569 2.401 2.692 . 0 0 "[ . 1 . 2]" 1 1756 1 93 LYS H 1 93 LYS HE3 . . 4.740 4.615 3.964 5.095 0.355 12 0 "[ . 1 . 2]" 1 1757 1 114 LEU H 1 114 LEU HG . . 3.130 2.157 2.048 2.307 . 0 0 "[ . 1 . 2]" 1 1758 1 115 GLN H 1 115 GLN HB3 . . 4.360 3.190 2.418 3.593 . 0 0 "[ . 1 . 2]" 1 1759 1 115 GLN H 1 115 GLN HG3 . . 4.060 3.125 2.278 4.418 0.358 10 0 "[ . 1 . 2]" 1 1760 1 115 GLN H 1 115 GLN HG2 . . 4.180 3.941 3.591 4.410 0.230 5 0 "[ . 1 . 2]" 1 1761 1 125 ILE H 1 125 ILE MD . . 3.120 3.044 2.896 3.171 0.051 18 0 "[ . 1 . 2]" 1 1762 1 171 ILE H 1 171 ILE HG12 . . 4.290 3.555 3.360 3.778 . 0 0 "[ . 1 . 2]" 1 1763 1 175 VAL H 1 175 VAL QG . . 2.880 1.805 1.636 1.956 . 0 0 "[ . 1 . 2]" 1 1764 1 182 SER H 1 182 SER HB2 . . 3.490 2.736 2.515 3.595 0.105 7 0 "[ . 1 . 2]" 1 1765 1 182 SER H 1 182 SER HB3 . . 3.380 3.033 2.349 3.606 0.226 15 0 "[ . 1 . 2]" 1 1766 1 189 GLU H 1 189 GLU HG2 . . 4.760 3.408 1.980 4.545 . 0 0 "[ . 1 . 2]" 1 1767 1 189 GLU H 1 189 GLU HG3 . . 4.730 2.899 1.849 4.583 . 0 0 "[ . 1 . 2]" 1 1768 1 199 ILE H 1 199 ILE HG12 . . 3.940 3.791 3.381 4.083 0.143 19 0 "[ . 1 . 2]" 1 1769 1 200 GLN H 1 200 GLN HG3 . . 3.330 2.381 1.896 3.750 0.420 9 0 "[ . 1 . 2]" 1 1770 1 203 SER H 1 203 SER HB2 . . 3.170 2.420 2.343 2.488 . 0 0 "[ . 1 . 2]" 1 1771 1 189 GLU H 1 190 ASN H . . 3.800 2.734 2.569 2.849 . 0 0 "[ . 1 . 2]" 1 1772 1 192 TRP H 1 192 TRP HB3 . . 3.110 2.748 2.489 2.837 . 0 0 "[ . 1 . 2]" 1 1773 1 239 LEU H 1 239 LEU HG . . 3.810 3.107 2.916 3.240 . 0 0 "[ . 1 . 2]" 1 1774 1 246 MET H 1 246 MET HG3 . . 3.440 2.565 2.305 2.719 . 0 0 "[ . 1 . 2]" 1 1775 1 2 VAL H 1 50 ILE HG13 . . 4.330 4.484 4.344 4.671 0.341 8 0 "[ . 1 . 2]" 1 1776 1 6 LEU H 1 7 SER HB2 . . 4.890 4.749 4.699 4.816 . 0 0 "[ . 1 . 2]" 1 1777 1 5 ARG HD2 1 7 SER H . . 5.030 4.891 4.262 5.256 0.226 16 0 "[ . 1 . 2]" 1 1778 1 5 ARG HD3 1 7 SER H . . 5.040 5.089 3.930 5.383 0.343 17 0 "[ . 1 . 2]" 1 1779 1 17 PHE HA 1 18 ILE H . . 5.180 3.551 3.541 3.563 . 0 0 "[ . 1 . 2]" 1 1780 1 18 ILE HG12 1 19 SER H . . 4.560 4.141 4.119 4.163 . 0 0 "[ . 1 . 2]" 1 1781 1 21 LEU HB2 1 22 ARG H . . 3.600 3.812 3.778 3.851 0.251 7 0 "[ . 1 . 2]" 1 1782 1 22 ARG H 1 23 LYS HA . . 5.190 5.127 5.078 5.165 . 0 0 "[ . 1 . 2]" 1 1783 1 18 ILE MG 1 23 LYS H . . 5.760 5.834 5.762 5.894 0.134 3 0 "[ . 1 . 2]" 1 1784 1 22 ARG HA 1 24 ALA H . . 4.630 4.144 3.854 4.279 . 0 0 "[ . 1 . 2]" 1 1785 1 29 ARG H 1 37 LEU HA . . 5.070 5.199 4.948 5.456 0.386 12 0 "[ . 1 . 2]" 1 1786 1 30 LYS H 1 33 ASP HA . . 5.200 5.263 5.103 5.431 0.231 20 0 "[ . 1 . 2]" 1 1787 1 36 LEU HA 1 37 LEU H . . 4.410 2.162 2.119 2.254 . 0 0 "[ . 1 . 2]" 1 1788 1 49 LEU H 1 95 VAL QG . . 5.480 4.099 3.913 4.640 . 0 0 "[ . 1 . 2]" 1 1789 1 57 ASP H 1 58 GLU HB3 . . 5.760 5.930 5.872 5.995 0.235 2 0 "[ . 1 . 2]" 1 1790 1 63 ALA H 1 74 TYR HB2 . . 5.070 4.544 4.311 5.281 0.211 19 0 "[ . 1 . 2]" 1 1791 1 64 ILE H 1 95 VAL QG . . 5.490 4.005 3.759 4.202 . 0 0 "[ . 1 . 2]" 1 1792 1 71 VAL HB 1 72 MET H . . 4.920 4.055 4.004 4.110 . 0 0 "[ . 1 . 2]" 1 1793 1 75 ARG HA 1 77 GLY H . . 5.220 5.487 5.437 5.540 0.320 5 0 "[ . 1 . 2]" 1 1794 1 96 PHE QD 1 97 LYS H . . 4.710 4.595 4.494 4.652 . 0 0 "[ . 1 . 2]" 1 1795 1 108 SER HB3 1 110 ASN H . . 3.940 3.139 3.032 3.303 . 0 0 "[ . 1 . 2]" 1 1796 1 115 GLN H 1 117 ALA H . . 4.660 4.303 4.168 4.391 . 0 0 "[ . 1 . 2]" 1 1797 1 121 ILE H 1 121 ILE HB . . 4.080 3.610 3.592 3.625 . 0 0 "[ . 1 . 2]" 1 1798 1 122 ARG H 1 124 ASN H . . 5.230 4.184 4.127 4.265 . 0 0 "[ . 1 . 2]" 1 1799 1 125 ILE H 1 180 LEU MD2 . . 4.450 3.605 3.268 4.773 0.323 10 0 "[ . 1 . 2]" 1 1800 1 132 LEU H 1 134 SER H . . 4.790 4.189 4.131 4.228 . 0 0 "[ . 1 . 2]" 1 1801 1 137 THR H 1 140 PHE QB . . 5.360 4.749 4.663 4.835 . 0 0 "[ . 1 . 2]" 1 1802 1 54 ASN HB3 1 137 THR H . . 5.390 3.578 3.352 3.904 . 0 0 "[ . 1 . 2]" 1 1803 1 138 THR H 1 139 LEU HG . . 4.330 4.506 4.444 4.552 0.222 4 0 "[ . 1 . 2]" 1 1804 1 137 THR HA 1 139 LEU H . . 4.920 4.820 4.777 4.870 . 0 0 "[ . 1 . 2]" 1 1805 1 137 THR HA 1 140 PHE H . . 4.340 3.951 3.860 4.143 . 0 0 "[ . 1 . 2]" 1 1806 1 143 ASN QB 1 146 SER H . . 4.000 3.136 2.791 3.324 . 0 0 "[ . 1 . 2]" 1 1807 1 148 ALA H 1 151 LEU H . . 5.310 4.713 4.632 4.803 . 0 0 "[ . 1 . 2]" 1 1808 1 154 LEU HA 1 157 SER H . . 4.300 3.438 3.331 3.608 . 0 0 "[ . 1 . 2]" 1 1809 1 157 SER H 1 159 SER H . . 5.410 5.045 4.926 5.145 . 0 0 "[ . 1 . 2]" 1 1810 1 155 ILE H 1 157 SER H . . 5.700 4.133 4.060 4.251 . 0 0 "[ . 1 . 2]" 1 1811 1 18 ILE MD 1 158 THR H . . 5.300 4.246 4.115 4.476 . 0 0 "[ . 1 . 2]" 1 1812 1 164 TYR H 1 166 PHE H . . 5.250 5.324 5.171 5.437 0.187 15 0 "[ . 1 . 2]" 1 1813 1 160 GLU HA 1 164 TYR H . . 4.590 4.338 3.717 4.600 0.010 13 0 "[ . 1 . 2]" 1 1814 1 164 TYR H 1 167 ILE HB . . 3.950 3.936 3.746 4.098 0.148 16 0 "[ . 1 . 2]" 1 1815 1 18 ILE MG 1 164 TYR H . . 4.920 4.740 4.577 5.315 0.395 1 0 "[ . 1 . 2]" 1 1816 1 18 ILE MG 1 168 GLU H . . 5.320 4.639 4.370 4.862 . 0 0 "[ . 1 . 2]" 1 1817 1 18 ILE MG 1 169 GLN H . . 5.640 5.722 5.586 5.831 0.191 12 0 "[ . 1 . 2]" 1 1818 1 167 ILE MG 1 169 GLN H . . 5.340 5.233 4.837 5.315 . 0 0 "[ . 1 . 2]" 1 1819 1 168 GLU HA 1 171 ILE H . . 5.060 3.974 3.715 4.105 . 0 0 "[ . 1 . 2]" 1 1820 1 171 ILE H 1 172 GLY HA3 . . 5.110 4.864 4.796 4.942 . 0 0 "[ . 1 . 2]" 1 1821 1 188 LEU QB 1 190 ASN H . . 5.550 4.594 4.372 5.078 . 0 0 "[ . 1 . 2]" 1 1822 1 191 SER H 1 213 VAL QG . . 4.580 4.808 4.589 4.985 0.405 7 0 "[ . 1 . 2]" 1 1823 1 194 ALA MB 1 196 SER H . . 4.490 4.565 4.502 4.653 0.163 3 0 "[ . 1 . 2]" 1 1824 1 201 ILE HA 1 202 ALA H . . 4.280 3.533 3.521 3.547 . 0 0 "[ . 1 . 2]" 1 1825 1 203 SER H 1 228 VAL MG1 . . 4.810 4.220 3.867 5.250 0.440 16 0 "[ . 1 . 2]" 1 1826 1 200 GLN HB3 1 203 SER H . . 5.130 5.363 5.236 5.503 0.373 16 0 "[ . 1 . 2]" 1 1827 1 208 GLN H 1 228 VAL MG1 . . 4.980 4.784 4.537 4.952 . 0 0 "[ . 1 . 2]" 1 1828 1 240 LEU H 1 241 PRO QD . . 5.440 4.222 4.087 4.321 . 0 0 "[ . 1 . 2]" 1 1829 1 243 ARG H 1 245 ASN H . . 4.880 4.131 3.961 4.370 . 0 0 "[ . 1 . 2]" 1 1830 1 243 ARG QD 1 244 ASN H . . 5.180 5.208 4.560 5.580 0.400 3 0 "[ . 1 . 2]" 1 1831 1 192 TRP HA 1 192 TRP HE1 . . 4.840 4.750 4.654 4.943 0.103 15 0 "[ . 1 . 2]" 1 1832 1 163 ARG HA 1 192 TRP HE1 . . 4.530 3.131 2.843 3.642 . 0 0 "[ . 1 . 2]" 1 1833 1 192 TRP HE1 1 241 PRO QD . . 4.440 3.041 2.797 3.539 . 0 0 "[ . 1 . 2]" 1 1834 1 192 TRP HE1 1 239 LEU HB3 . . 3.860 4.068 3.818 4.256 0.396 18 0 "[ . 1 . 2]" 1 1835 1 163 ARG HB3 1 192 TRP HE1 . . 3.720 3.087 2.430 3.748 0.028 4 0 "[ . 1 . 2]" 1 1836 1 192 TRP HE1 1 240 LEU HA . . 4.580 3.510 2.690 3.785 . 0 0 "[ . 1 . 2]" 1 1837 1 192 TRP HE1 1 238 ALA H . . 5.400 5.205 4.243 5.541 0.141 2 0 "[ . 1 . 2]" 1 1838 1 192 TRP HE1 1 240 LEU H . . 6.000 4.767 4.434 5.085 . 0 0 "[ . 1 . 2]" 1 1839 1 27 TYR QD 1 30 LYS H . . 4.810 4.772 4.512 5.066 0.256 9 0 "[ . 1 . 2]" 1 1840 1 164 TYR H 1 168 GLU H . . 4.750 4.651 4.441 4.932 0.182 6 0 "[ . 1 . 2]" 1 1841 1 209 PHE H 1 209 PHE QE . . 5.540 4.642 4.496 4.782 . 0 0 "[ . 1 . 2]" 1 1842 1 83 PHE QD 1 84 ASN H . . 4.790 3.332 3.168 3.487 . 0 0 "[ . 1 . 2]" 1 1843 1 81 TYR H 1 81 TYR HB2 . . 4.110 2.868 2.570 2.929 . 0 0 "[ . 1 . 2]" 1 1844 1 81 TYR H 1 81 TYR HB3 . . 4.260 3.879 3.660 3.906 . 0 0 "[ . 1 . 2]" 1 1845 1 166 PHE H 1 169 GLN HB2 . . 5.450 5.458 5.286 5.593 0.143 17 0 "[ . 1 . 2]" 1 1846 1 166 PHE H 1 188 LEU QD . . 5.170 3.741 3.487 4.193 . 0 0 "[ . 1 . 2]" 1 1847 1 166 PHE H 1 166 PHE QD . . 5.320 4.191 4.179 4.203 . 0 0 "[ . 1 . 2]" 1 1848 1 164 TYR HA 1 166 PHE H . . 5.020 3.733 3.470 4.001 . 0 0 "[ . 1 . 2]" 1 1849 1 165 LYS H 1 166 PHE H . . 5.760 2.562 2.485 2.660 . 0 0 "[ . 1 . 2]" 1 1850 1 165 LYS H 1 166 PHE HA . . 5.750 5.156 5.095 5.232 . 0 0 "[ . 1 . 2]" 1 1851 1 165 LYS H 1 238 ALA H . . 6.050 2.894 2.338 4.574 . 0 0 "[ . 1 . 2]" 1 1852 1 164 TYR HA 1 165 LYS H . . 4.730 2.109 2.070 2.151 . 0 0 "[ . 1 . 2]" 1 1853 1 5 ARG H 1 5 ARG QG . . 3.320 2.028 1.725 2.193 . 0 0 "[ . 1 . 2]" 1 1854 1 38 ARG HA 1 39 SER H . . 3.050 2.135 2.056 2.211 . 0 0 "[ . 1 . 2]" 1 1855 1 44 SER H 1 44 SER QB . . 3.260 2.530 2.274 2.764 . 0 0 "[ . 1 . 2]" 1 1856 1 111 TYR HA 1 112 GLU H . . 4.420 3.499 3.467 3.541 . 0 0 "[ . 1 . 2]" 1 1857 1 111 TYR HB3 1 112 GLU H . . 3.970 3.855 3.627 4.040 0.070 5 0 "[ . 1 . 2]" 1 1858 1 130 PRO HB3 1 131 ALA H . . 4.300 4.245 4.202 4.276 . 0 0 "[ . 1 . 2]" 1 1859 1 130 PRO HD2 1 131 ALA H . . 4.530 2.989 2.918 3.045 . 0 0 "[ . 1 . 2]" 1 1860 1 145 ASN HA 1 146 SER H . . 3.770 3.441 3.350 3.551 . 0 0 "[ . 1 . 2]" 1 1861 1 212 PRO HD2 1 213 VAL H . . 4.970 5.276 5.205 5.339 0.369 14 0 "[ . 1 . 2]" 1 1862 1 228 VAL MG2 1 229 ASP H . . 3.970 3.208 2.697 4.271 0.301 16 0 "[ . 1 . 2]" 1 1863 1 232 VAL HA 1 233 VAL H . . 4.900 3.468 3.423 3.543 . 0 0 "[ . 1 . 2]" 1 1864 1 237 ILE HB 1 238 ALA H . . 5.010 4.483 3.824 4.589 . 0 0 "[ . 1 . 2]" 1 1865 1 54 ASN HD21 1 137 THR H . . 4.680 2.919 2.645 3.341 . 0 0 "[ . 1 . 2]" 1 1866 1 68 ASN HB3 1 69 VAL H . . 5.890 3.539 3.420 3.685 . 0 0 "[ . 1 . 2]" 1 1867 1 18 ILE H 1 18 ILE HG13 . . 4.050 3.641 3.621 3.662 . 0 0 "[ . 1 . 2]" 1 1868 1 18 ILE H 1 18 ILE HG12 . . 4.310 2.180 2.156 2.212 . 0 0 "[ . 1 . 2]" 1 1869 1 165 LYS H 1 236 ASN H . . 5.170 5.453 5.306 5.570 0.400 3 0 "[ . 1 . 2]" 1 1870 1 233 VAL H 1 236 ASN H . . 5.240 4.695 4.402 4.923 . 0 0 "[ . 1 . 2]" 1 1871 1 236 ASN H 1 236 ASN HA . . 3.030 2.935 2.916 2.948 . 0 0 "[ . 1 . 2]" 1 1872 1 232 VAL HA 1 236 ASN H . . 3.830 4.000 3.019 4.263 0.433 6 0 "[ . 1 . 2]" 1 1873 1 236 ASN H 1 237 ILE HB . . 4.040 4.435 4.247 4.880 0.840 18 3 "[ -. 1 . +*2]" 1 1874 1 236 ASN H 1 237 ILE MG . . 3.720 3.426 2.998 3.736 0.016 7 0 "[ . 1 . 2]" 1 1875 1 227 ASN H 1 228 VAL H . . 5.800 4.393 4.350 4.425 . 0 0 "[ . 1 . 2]" 1 1876 1 228 VAL H 1 229 ASP H . . 4.000 2.599 2.326 2.796 . 0 0 "[ . 1 . 2]" 1 1877 1 227 ASN HA 1 228 VAL H . . 4.700 2.247 2.134 2.358 . 0 0 "[ . 1 . 2]" 1 1878 1 228 VAL H 1 228 VAL MG2 . . 3.450 1.993 1.843 3.693 0.243 16 0 "[ . 1 . 2]" 1 1879 1 235 SER H 1 236 ASN H . . 3.030 2.348 1.863 2.446 . 0 0 "[ . 1 . 2]" 1 1880 1 235 SER H 1 237 ILE H . . 5.670 3.978 3.631 4.438 . 0 0 "[ . 1 . 2]" 1 1881 1 233 VAL H 1 235 SER H . . 4.920 3.919 3.731 4.253 . 0 0 "[ . 1 . 2]" 1 1882 1 235 SER H 1 235 SER HB2 . . 3.780 2.683 2.500 3.295 . 0 0 "[ . 1 . 2]" 1 1883 1 235 SER H 1 235 SER HB3 . . 3.880 2.940 2.473 3.912 0.032 4 0 "[ . 1 . 2]" 1 1884 1 234 THR MG 1 235 SER H . . 4.410 4.051 2.242 4.304 . 0 0 "[ . 1 . 2]" 1 1885 1 234 THR H 1 236 ASN H . . 6.030 4.068 3.883 4.200 . 0 0 "[ . 1 . 2]" 1 1886 1 236 ASN H 1 237 ILE H . . 3.520 2.137 2.021 2.334 . 0 0 "[ . 1 . 2]" 1 1887 1 237 ILE H 1 237 ILE MG . . 3.430 2.045 1.914 2.341 . 0 0 "[ . 1 . 2]" 1 1888 1 12 SER QB 1 13 SER H . . 3.230 2.715 2.537 3.349 0.119 7 0 "[ . 1 . 2]" 1 1889 1 220 ASN QB 1 220 ASN HD22 . . 3.400 3.201 3.183 3.241 . 0 0 "[ . 1 . 2]" 1 1890 1 167 ILE H 1 170 GLN H . . 5.030 4.862 4.798 4.939 . 0 0 "[ . 1 . 2]" 1 1891 1 166 PHE HA 1 170 GLN H . . 5.300 4.160 3.967 4.324 . 0 0 "[ . 1 . 2]" 1 1892 1 52 LEU H 1 60 ILE MD . . 5.010 5.145 4.948 5.257 0.247 3 0 "[ . 1 . 2]" 1 1893 1 74 TYR H 1 81 TYR HB3 . . 4.250 4.247 3.918 4.375 0.125 5 0 "[ . 1 . 2]" 1 1894 1 75 ARG HG3 1 79 THR H . . 4.200 4.362 4.239 4.451 0.251 19 0 "[ . 1 . 2]" 1 1895 1 83 PHE HB3 1 85 GLU H . . 4.550 2.781 2.348 4.211 . 0 0 "[ . 1 . 2]" 1 1896 1 105 LEU H 1 105 LEU HB2 . . 3.770 2.158 2.056 2.514 . 0 0 "[ . 1 . 2]" 1 1897 1 108 SER H 1 113 ARG QG . . 4.140 2.839 2.493 3.367 . 0 0 "[ . 1 . 2]" 1 1898 1 117 ALA HA 1 118 ALA H . . 3.700 3.525 3.514 3.537 . 0 0 "[ . 1 . 2]" 1 1899 1 120 LYS HB3 1 121 ILE H . . 3.680 3.936 3.880 3.984 0.304 17 0 "[ . 1 . 2]" 1 1900 1 129 LEU H 1 175 VAL HA . . 4.730 3.440 3.122 3.831 . 0 0 "[ . 1 . 2]" 1 1901 1 131 ALA H 1 153 VAL QG . . 4.710 4.782 4.602 4.842 0.132 2 0 "[ . 1 . 2]" 1 1902 1 134 SER QB 1 136 ILE H . . 4.390 4.718 4.641 4.774 0.384 17 0 "[ . 1 . 2]" 1 1903 1 138 THR HA 1 141 TYR H . . 3.800 3.728 3.602 3.845 0.045 12 0 "[ . 1 . 2]" 1 1904 1 149 SER HA 1 152 MET H . . 3.850 3.236 3.097 3.367 . 0 0 "[ . 1 . 2]" 1 1905 1 158 THR H 1 171 ILE MG . . 4.880 5.261 5.198 5.321 0.441 5 0 "[ . 1 . 2]" 1 1906 1 203 SER H 1 207 GLY HA2 . . 4.810 4.578 4.444 4.777 . 0 0 "[ . 1 . 2]" 1 1907 1 219 GLN HA 1 219 GLN HE21 . . 4.230 3.111 2.483 4.107 . 0 0 "[ . 1 . 2]" 1 1908 1 227 ASN H 1 230 ALA H . . 5.010 4.576 4.418 4.859 . 0 0 "[ . 1 . 2]" 1 1909 1 244 ASN HB3 1 244 ASN HD22 . . 3.460 3.537 3.448 4.024 0.564 15 1 "[ . 1 + 2]" 1 1910 1 244 ASN HB2 1 244 ASN HD22 . . 3.580 3.744 3.458 4.019 0.439 20 0 "[ . 1 . 2]" 1 1911 1 67 THR HA 1 245 ASN HD21 . . 4.540 4.074 3.489 4.487 . 0 0 "[ . 1 . 2]" 1 1912 1 161 ALA MB 1 162 ALA H . . 3.110 2.466 2.408 2.550 . 0 0 "[ . 1 . 2]" 1 1913 1 108 SER HB3 1 109 GLY H . . 3.850 2.463 2.283 2.660 . 0 0 "[ . 1 . 2]" 1 1914 1 194 ALA MB 1 197 LYS H . . 4.480 4.799 4.737 4.850 0.370 17 0 "[ . 1 . 2]" 1 1915 1 48 ALA MB 1 66 VAL H . . 4.540 4.529 4.400 4.592 0.052 13 0 "[ . 1 . 2]" 1 1916 1 161 ALA MB 1 164 TYR H . . 4.120 4.397 4.264 4.707 0.587 6 2 "[- .+ 1 . 2]" 1 1917 1 114 LEU MD2 1 118 ALA H . . 4.980 5.214 5.083 5.356 0.376 5 0 "[ . 1 . 2]" 1 1918 1 76 ALA H 1 79 THR HB . . 4.840 3.800 3.614 4.019 . 0 0 "[ . 1 . 2]" 1 1919 1 76 ALA H 1 77 GLY HA2 . . 4.880 5.156 5.118 5.195 0.315 20 0 "[ . 1 . 2]" 1 1920 1 207 GLY H 1 228 VAL MG2 . . 4.350 4.074 3.993 4.658 0.308 16 0 "[ . 1 . 2]" 1 1921 1 36 LEU HB2 1 242 ASN QD . . 5.940 5.080 3.723 5.763 . 0 0 "[ . 1 . 2]" 1 1922 1 96 PHE HB3 1 98 ASP H . . 5.330 4.603 4.508 4.741 . 0 0 "[ . 1 . 2]" 1 1923 1 61 SER H 1 76 ALA MB . . 4.830 4.800 4.562 4.946 0.116 17 0 "[ . 1 . 2]" 1 1924 1 19 SER H 1 21 LEU HB3 . . 4.600 4.712 4.681 4.761 0.161 17 0 "[ . 1 . 2]" 1 1925 1 156 GLN HB2 1 158 THR H . . 4.850 4.766 4.652 4.946 0.096 12 0 "[ . 1 . 2]" 1 1926 1 218 ALA HA 1 219 GLN HE22 . . 5.450 4.921 4.557 5.657 0.207 5 0 "[ . 1 . 2]" 1 1927 1 14 TYR H 1 17 PHE HB3 . . 5.110 4.734 4.650 4.799 . 0 0 "[ . 1 . 2]" 1 1928 1 209 PHE QD 1 226 THR H . . 5.620 5.214 5.157 5.297 . 0 0 "[ . 1 . 2]" 1 1929 1 234 THR H 1 235 SER HB2 . . 4.980 4.969 4.585 5.169 0.189 19 0 "[ . 1 . 2]" 1 1930 1 97 LYS HB2 1 99 ALA H . . 4.400 4.748 4.680 4.794 0.394 1 0 "[ . 1 . 2]" 1 1931 1 229 ASP H 1 234 THR MG . . 4.790 4.834 4.413 4.972 0.182 6 0 "[ . 1 . 2]" 1 1932 1 107 TYR HB2 1 114 LEU H . . 4.680 4.260 3.972 4.572 . 0 0 "[ . 1 . 2]" 1 1933 1 75 ARG HD3 1 96 PHE H . . 5.420 5.519 5.382 5.634 0.214 5 0 "[ . 1 . 2]" 1 1934 1 187 SER H 1 216 ILE HB . . 4.610 3.732 3.605 3.888 . 0 0 "[ . 1 . 2]" 1 1935 1 55 TYR H 1 56 ALA MB . . 4.110 4.325 4.304 4.349 0.239 18 0 "[ . 1 . 2]" 1 1936 1 166 PHE HA 1 169 GLN QE . . 5.940 3.413 2.136 4.351 . 0 0 "[ . 1 . 2]" 1 1937 1 169 GLN HA 1 169 GLN QE . . 5.740 4.675 4.363 4.791 . 0 0 "[ . 1 . 2]" 1 1938 1 169 GLN H 1 170 GLN HB2 . . 4.970 4.874 4.730 5.035 0.065 11 0 "[ . 1 . 2]" 1 1939 1 65 ASP H 1 72 MET HB3 . . 5.790 5.498 5.236 5.693 . 0 0 "[ . 1 . 2]" 1 1940 1 80 SER QB 1 103 VAL H . . 5.440 4.127 3.435 4.473 . 0 0 "[ . 1 . 2]" 1 1941 1 17 PHE HA 1 19 SER H . . 4.960 4.554 4.515 4.653 . 0 0 "[ . 1 . 2]" 1 1942 1 174 ARG QB 1 179 PHE H . . 5.460 4.295 4.111 4.529 . 0 0 "[ . 1 . 2]" 1 1943 1 71 VAL H 1 155 ILE MD . . 5.280 3.733 3.475 4.005 . 0 0 "[ . 1 . 2]" 1 1944 1 64 ILE MG 1 71 VAL H . . 4.800 3.983 3.787 4.150 . 0 0 "[ . 1 . 2]" 1 1945 1 68 ASN HA 1 69 VAL H . . 5.200 3.248 3.174 3.304 . 0 0 "[ . 1 . 2]" 1 1946 1 154 LEU HA 1 156 GLN H . . 5.000 4.547 4.299 4.714 . 0 0 "[ . 1 . 2]" 1 1947 1 64 ILE H 1 72 MET QG . . 5.620 4.907 3.970 5.504 . 0 0 "[ . 1 . 2]" 1 1948 1 113 ARG H 1 114 LEU HG . . 4.760 4.126 4.025 4.314 . 0 0 "[ . 1 . 2]" 1 1949 1 132 LEU H 1 133 ASP HB3 . . 5.010 4.585 4.498 4.735 . 0 0 "[ . 1 . 2]" 1 1950 1 230 ALA MB 1 234 THR H . . 6.000 4.048 3.689 4.436 . 0 0 "[ . 1 . 2]" 1 1951 1 127 LEU HA 1 179 PHE H . . 5.240 4.495 4.363 4.599 . 0 0 "[ . 1 . 2]" 1 1952 1 233 VAL HA 1 236 ASN H . . 4.150 3.964 3.530 4.340 0.190 18 0 "[ . 1 . 2]" 1 1953 1 65 ASP H 1 69 VAL HA . . 5.190 4.755 4.631 4.900 . 0 0 "[ . 1 . 2]" 1 1954 1 125 ILE H 1 181 PRO HG2 . . 4.500 4.267 4.100 4.385 . 0 0 "[ . 1 . 2]" 1 1955 1 227 ASN HD21 1 229 ASP H . . 5.900 4.587 3.189 5.514 . 0 0 "[ . 1 . 2]" 1 1956 1 161 ALA HA 1 167 ILE H . . 4.910 3.997 3.856 4.086 . 0 0 "[ . 1 . 2]" 1 1957 1 209 PHE H 1 227 ASN H . . 5.040 4.925 4.520 5.341 0.301 16 0 "[ . 1 . 2]" 1 1958 1 66 VAL H 1 68 ASN H . . 4.870 4.233 4.132 4.392 . 0 0 "[ . 1 . 2]" 1 1959 1 154 LEU H 1 156 GLN H . . 5.470 4.191 4.025 4.411 . 0 0 "[ . 1 . 2]" 1 1960 1 60 ILE HA 1 75 ARG H . . 5.100 4.467 4.325 4.670 . 0 0 "[ . 1 . 2]" 1 1961 1 68 ASN HD22 1 70 TYR H . . 5.040 5.062 4.657 5.465 0.425 2 0 "[ . 1 . 2]" 1 1962 1 39 SER HA 1 242 ASN H . . 5.230 5.170 4.571 5.477 0.247 16 0 "[ . 1 . 2]" 1 1963 1 65 ASP HB3 1 66 VAL H . . 5.000 4.317 4.265 4.387 . 0 0 "[ . 1 . 2]" 1 1964 1 60 ILE MD 1 140 PHE H . . 4.910 3.087 2.854 3.163 . 0 0 "[ . 1 . 2]" 1 1965 1 225 ILE HB 1 226 THR H . . 5.340 4.377 4.338 4.406 . 0 0 "[ . 1 . 2]" 1 1966 1 219 GLN QG 1 221 GLN HE21 . . 4.450 3.426 3.184 3.792 . 0 0 "[ . 1 . 2]" 1 1967 1 167 ILE H 1 188 LEU QD . . 4.920 3.064 2.873 3.428 . 0 0 "[ . 1 . 2]" 1 1968 1 61 SER H 1 75 ARG HD3 . . 5.080 4.326 4.041 4.514 . 0 0 "[ . 1 . 2]" 1 1969 1 153 VAL HA 1 156 GLN H . . 4.950 3.846 3.684 4.087 . 0 0 "[ . 1 . 2]" 1 1970 1 42 PRO QD 1 45 GLN HE21 . . 5.070 2.424 1.846 2.888 . 0 0 "[ . 1 . 2]" 1 1971 1 10 THR HB 1 13 SER H . . 4.730 3.632 3.390 3.877 . 0 0 "[ . 1 . 2]" 1 1972 1 218 ALA HA 1 220 ASN H . . 3.950 3.534 3.360 3.690 . 0 0 "[ . 1 . 2]" 1 1973 1 96 PHE HA 1 98 ASP H . . 4.260 3.261 3.177 3.421 . 0 0 "[ . 1 . 2]" 1 1974 1 170 GLN HA 1 173 LYS H . . 4.110 3.886 3.648 4.167 0.057 4 0 "[ . 1 . 2]" 1 1975 1 234 THR HA 1 235 SER H . . 4.550 3.504 3.429 3.556 . 0 0 "[ . 1 . 2]" 1 1976 1 48 ALA H 1 64 ILE HB . . 4.390 2.992 2.888 3.329 . 0 0 "[ . 1 . 2]" 1 1977 1 81 TYR HB3 1 82 PHE H . . 4.210 2.846 2.754 2.917 . 0 0 "[ . 1 . 2]" 1 1978 1 219 GLN HB3 1 221 GLN HE22 . . 3.880 3.693 3.163 4.683 0.803 2 2 "[ + . 1 - . 2]" 1 1979 1 164 TYR HA 1 238 ALA H . . 5.040 2.067 1.829 3.463 . 0 0 "[ . 1 . 2]" 1 1980 1 39 SER HB3 1 242 ASN QD . . 5.570 3.117 2.206 4.682 . 0 0 "[ . 1 . 2]" 1 1981 1 132 LEU HB3 1 133 ASP H . . 4.260 3.581 3.314 3.652 . 0 0 "[ . 1 . 2]" 1 1982 1 2 VAL HA 1 3 SER H . . 2.610 2.337 2.267 2.397 . 0 0 "[ . 1 . 2]" 1 1983 1 93 LYS HA 1 93 LYS HB2 . . 2.910 3.008 3.004 3.014 0.104 20 0 "[ . 1 . 2]" 1 1984 1 124 ASN HA 1 180 LEU MD2 . . 2.740 2.535 2.311 2.825 0.085 7 0 "[ . 1 . 2]" 1 1985 1 124 ASN HA 1 180 LEU MD1 . . 2.710 2.345 2.059 2.975 0.265 19 0 "[ . 1 . 2]" 1 1986 1 2 VAL HB 1 50 ILE MG . . 2.660 2.643 2.328 2.834 0.174 2 0 "[ . 1 . 2]" 1 1987 1 50 ILE HB 1 50 ILE MG . . 2.410 2.121 2.118 2.124 . 0 0 "[ . 1 . 2]" 1 1988 1 17 PHE HZ 1 50 ILE MG . . 2.360 2.212 2.031 2.378 0.018 5 0 "[ . 1 . 2]" 1 1989 1 50 ILE HA 1 50 ILE MG . . 2.770 2.380 2.354 2.398 . 0 0 "[ . 1 . 2]" 1 1990 1 18 ILE MD 1 161 ALA MB . . 2.880 2.104 2.011 2.207 . 0 0 "[ . 1 . 2]" 1 1991 1 117 ALA HA 1 117 ALA MB . . 2.200 2.126 2.123 2.129 . 0 0 "[ . 1 . 2]" 1 1992 1 114 LEU HA 1 117 ALA MB . . 2.820 2.884 2.788 2.953 0.133 16 0 "[ . 1 . 2]" 1 1993 1 117 ALA H 1 117 ALA MB . . 2.520 2.228 2.222 2.235 . 0 0 "[ . 1 . 2]" 1 1994 1 107 TYR QD 1 117 ALA MB . . 2.790 2.156 1.972 2.393 . 0 0 "[ . 1 . 2]" 1 1995 1 50 ILE MD 1 158 THR HB . . 2.690 2.649 2.475 2.837 0.147 5 0 "[ . 1 . 2]" 1 1996 1 181 PRO HA 1 185 ILE MD . . 3.040 2.064 1.981 2.164 . 0 0 "[ . 1 . 2]" 1 1997 1 103 VAL HA 1 103 VAL MG1 . . 2.580 2.420 2.397 2.441 . 0 0 "[ . 1 . 2]" 1 1998 1 81 TYR HA 1 103 VAL MG1 . . 3.240 3.449 3.380 3.488 0.248 2 0 "[ . 1 . 2]" 1 1999 1 139 LEU HG 1 150 ALA MB . . 3.040 2.164 2.084 2.242 . 0 0 "[ . 1 . 2]" 1 2000 1 194 ALA MB 1 195 LEU H . . 2.730 2.312 2.212 2.393 . 0 0 "[ . 1 . 2]" 1 2001 1 194 ALA H 1 194 ALA MB . . 2.290 2.246 2.228 2.271 . 0 0 "[ . 1 . 2]" 1 2002 1 150 ALA H 1 150 ALA MB . . 2.730 2.196 2.190 2.205 . 0 0 "[ . 1 . 2]" 1 2003 1 226 THR H 1 226 THR MG . . 2.690 2.840 2.751 2.936 0.246 16 0 "[ . 1 . 2]" 1 2004 1 34 ILE MG 1 239 LEU HA . . 2.800 2.633 2.286 2.935 0.135 4 0 "[ . 1 . 2]" 1 2005 1 34 ILE MG 1 35 PRO HD2 . . 3.120 2.583 2.409 2.708 . 0 0 "[ . 1 . 2]" 1 2006 1 34 ILE MG 1 240 LEU H . . 2.870 2.660 2.437 2.971 0.101 3 0 "[ . 1 . 2]" 1 2007 1 224 THR H 1 224 THR HB . . 3.000 2.456 2.394 2.516 . 0 0 "[ . 1 . 2]" 1 2008 1 213 VAL HA 1 213 VAL HB . . 3.060 2.877 2.417 3.025 . 0 0 "[ . 1 . 2]" 1 2009 1 213 VAL HA 1 213 VAL QG . . 2.240 2.160 2.091 2.322 0.082 4 0 "[ . 1 . 2]" 1 2010 1 213 VAL HA 1 214 VAL H . . 2.780 2.147 2.125 2.188 . 0 0 "[ . 1 . 2]" 1 2011 1 223 VAL HA 1 223 VAL HB . . 2.900 2.441 2.418 2.484 . 0 0 "[ . 1 . 2]" 1 2012 1 71 VAL HB 1 155 ILE MD . . 2.510 2.556 2.491 2.637 0.127 5 0 "[ . 1 . 2]" 1 2013 1 155 ILE HB 1 155 ILE MD . . 2.240 2.370 2.353 2.387 0.147 5 0 "[ . 1 . 2]" 1 2014 1 155 ILE H 1 155 ILE MD . . 3.210 3.460 3.439 3.494 0.284 5 0 "[ . 1 . 2]" 1 2015 1 83 PHE QE 1 155 ILE MD . . 2.930 2.998 2.830 3.072 0.142 9 0 "[ . 1 . 2]" 1 2016 1 2 VAL MG2 1 24 ALA MB . . 2.070 1.861 1.832 1.894 . 0 0 "[ . 1 . 2]" 1 2017 1 24 ALA HA 1 24 ALA MB . . 2.170 2.133 2.129 2.137 . 0 0 "[ . 1 . 2]" 1 2018 1 21 LEU HA 1 24 ALA MB . . 2.740 2.940 2.863 2.991 0.251 16 0 "[ . 1 . 2]" 1 2019 1 24 ALA H 1 24 ALA MB . . 2.420 2.232 2.223 2.253 . 0 0 "[ . 1 . 2]" 1 2020 1 24 ALA MB 1 25 LEU H . . 2.930 2.581 2.489 2.641 . 0 0 "[ . 1 . 2]" 1 2021 1 39 SER HA 1 39 SER HB2 . . 2.740 2.535 2.430 2.622 . 0 0 "[ . 1 . 2]" 1 2022 1 92 ALA HA 1 95 VAL QG . . 2.660 2.552 2.297 2.714 0.054 19 0 "[ . 1 . 2]" 1 2023 1 94 TYR QB 1 95 VAL QG . . 3.250 2.722 2.652 2.819 . 0 0 "[ . 1 . 2]" 1 2024 1 47 TYR QB 1 95 VAL QG . . 2.470 2.096 1.934 2.485 0.015 5 0 "[ . 1 . 2]" 1 2025 1 63 ALA MB 1 95 VAL QG . . 2.180 1.896 1.828 2.004 . 0 0 "[ . 1 . 2]" 1 2026 1 49 LEU QD 1 95 VAL QG . . 2.380 1.869 1.812 1.902 . 0 0 "[ . 1 . 2]" 1 2027 1 82 PHE QE 1 95 VAL QG . . 2.450 2.165 1.904 2.470 0.020 11 0 "[ . 1 . 2]" 1 2028 1 223 VAL HA 1 223 VAL MG1 . . 2.300 2.358 2.296 2.401 0.101 5 0 "[ . 1 . 2]" 1 2029 1 217 ASN HB3 1 223 VAL MG1 . . 3.140 2.758 1.884 2.940 . 0 0 "[ . 1 . 2]" 1 2030 1 223 VAL HB 1 223 VAL MG1 . . 2.070 2.124 2.123 2.127 0.057 10 0 "[ . 1 . 2]" 1 2031 1 176 ASP HA 1 176 ASP HB2 . . 3.130 3.005 2.968 3.020 . 0 0 "[ . 1 . 2]" 1 2032 1 55 TYR HA 1 55 TYR QD . . 2.940 2.040 1.972 2.121 . 0 0 "[ . 1 . 2]" 1 2033 1 127 LEU HA 1 131 ALA MB . . 2.890 2.511 2.336 2.698 . 0 0 "[ . 1 . 2]" 1 2034 1 217 ASN HB2 1 223 VAL MG2 . . 2.740 2.647 2.234 3.515 0.775 7 1 "[ . + 1 . 2]" 1 2035 1 223 VAL HB 1 223 VAL MG2 . . 2.180 2.129 2.126 2.131 . 0 0 "[ . 1 . 2]" 1 2036 1 148 ALA HA 1 148 ALA MB . . 2.400 2.126 2.122 2.131 . 0 0 "[ . 1 . 2]" 1 2037 1 148 ALA MB 1 149 SER H . . 2.430 2.278 2.219 2.368 . 0 0 "[ . 1 . 2]" 1 2038 1 183 LEU QD 1 183 LEU HG . . 2.040 1.887 1.884 1.894 . 0 0 "[ . 1 . 2]" 1 2039 1 67 THR HA 1 67 THR MG . . 3.120 2.450 2.362 2.544 . 0 0 "[ . 1 . 2]" 1 2040 1 177 LYS QB 1 177 LYS QD . . 3.260 2.263 2.161 2.334 . 0 0 "[ . 1 . 2]" 1 2041 1 202 ALA MB 1 205 ASN HB3 . . 3.510 3.458 3.373 3.526 0.016 2 0 "[ . 1 . 2]" 1 2042 1 202 ALA H 1 202 ALA MB . . 2.890 2.204 2.181 2.234 . 0 0 "[ . 1 . 2]" 1 2043 1 202 ALA MB 1 209 PHE QD . . 2.940 2.903 2.425 3.054 0.114 9 0 "[ . 1 . 2]" 1 2044 1 31 LEU QB 1 31 LEU QD . . 2.880 1.907 1.878 2.053 . 0 0 "[ . 1 . 2]" 1 2045 1 36 LEU HA 1 36 LEU QD . . 2.760 2.077 1.973 2.158 . 0 0 "[ . 1 . 2]" 1 2046 1 95 VAL HA 1 95 VAL HB . . 2.910 2.519 2.498 2.545 . 0 0 "[ . 1 . 2]" 1 2047 1 95 VAL HA 1 95 VAL QG . . 2.480 2.219 2.200 2.238 . 0 0 "[ . 1 . 2]" 1 2048 1 95 VAL HA 1 96 PHE H . . 3.100 2.367 2.329 2.414 . 0 0 "[ . 1 . 2]" 1 2049 1 28 GLU HA 1 38 ARG QD . . 3.280 2.973 2.293 3.602 0.322 16 0 "[ . 1 . 2]" 1 2050 1 40 THR HA 1 40 THR HB . . 2.790 2.496 2.441 2.566 . 0 0 "[ . 1 . 2]" 1 2051 1 21 LEU HA 1 21 LEU QD . . 2.510 1.972 1.936 2.003 . 0 0 "[ . 1 . 2]" 1 2052 1 2 VAL HB 1 21 LEU QD . . 3.120 3.080 2.877 3.168 0.048 18 0 "[ . 1 . 2]" 1 2053 1 21 LEU HB2 1 21 LEU QD . . 2.620 2.080 2.074 2.086 . 0 0 "[ . 1 . 2]" 1 2054 1 130 PRO HA 1 133 ASP HB2 . . 3.480 3.277 3.043 3.493 0.013 15 0 "[ . 1 . 2]" 1 2055 1 226 THR HB 1 226 THR MG . . 2.250 2.128 2.124 2.131 . 0 0 "[ . 1 . 2]" 1 2056 1 225 ILE MG 1 230 ALA MB . . 2.390 2.468 2.221 2.644 0.254 2 0 "[ . 1 . 2]" 1 2057 1 245 ASN HA 1 245 ASN HB3 . . 3.100 2.561 2.480 2.627 . 0 0 "[ . 1 . 2]" 1 2058 1 9 ALA H 1 9 ALA MB . . 2.630 2.231 2.205 2.248 . 0 0 "[ . 1 . 2]" 1 2059 1 62 VAL HA 1 63 ALA H . . 3.310 2.137 2.101 2.188 . 0 0 "[ . 1 . 2]" 1 2060 1 49 LEU QD 1 49 LEU HG . . 2.190 1.884 1.882 1.887 . 0 0 "[ . 1 . 2]" 1 2061 1 184 ALA HA 1 184 ALA MB . . 2.420 2.133 2.130 2.136 . 0 0 "[ . 1 . 2]" 1 2062 1 184 ALA HA 1 216 ILE MG . . 3.500 2.848 2.313 3.242 . 0 0 "[ . 1 . 2]" 1 2063 1 195 LEU HB3 1 195 LEU MD1 . . 3.090 3.027 2.385 3.184 0.094 14 0 "[ . 1 . 2]" 1 2064 1 101 ARG HA 1 101 ARG HG2 . . 3.450 3.576 2.892 3.860 0.410 7 0 "[ . 1 . 2]" 1 2065 1 3 SER HA 1 52 LEU QD . . 3.310 3.585 3.431 4.311 1.001 11 1 "[ . 1+ . 2]" 1 2066 1 134 SER H 1 134 SER HB2 . . 2.920 2.429 2.074 2.522 . 0 0 "[ . 1 . 2]" 1 2067 1 58 GLU HA 1 59 THR H . . 2.910 2.149 2.123 2.163 . 0 0 "[ . 1 . 2]" 1 2068 1 23 LYS HA 1 23 LYS HG3 . . 3.280 3.026 2.916 3.070 . 0 0 "[ . 1 . 2]" 1 2069 1 23 LYS QE 1 23 LYS HG3 . . 3.300 2.682 2.319 3.482 0.182 11 0 "[ . 1 . 2]" 1 2070 1 226 THR HA 1 226 THR MG . . 2.270 2.265 2.232 2.308 0.038 10 0 "[ . 1 . 2]" 1 2071 1 195 LEU HB2 1 195 LEU MD1 . . 3.190 2.361 2.246 3.203 0.013 10 0 "[ . 1 . 2]" 1 2072 1 97 LYS HA 1 97 LYS HG2 . . 2.660 2.994 2.920 3.047 0.387 11 0 "[ . 1 . 2]" 1 2073 1 6 LEU QD 1 133 ASP HA . . 2.630 2.736 2.013 2.861 0.231 15 0 "[ . 1 . 2]" 1 2074 1 99 ALA HA 1 99 ALA MB . . 2.360 2.120 2.118 2.123 . 0 0 "[ . 1 . 2]" 1 2075 1 80 SER QB 1 99 ALA MB . . 2.790 2.160 1.937 2.329 . 0 0 "[ . 1 . 2]" 1 2076 1 99 ALA H 1 99 ALA MB . . 2.510 2.276 2.261 2.289 . 0 0 "[ . 1 . 2]" 1 2077 1 245 ASN HA 1 245 ASN HB2 . . 2.960 2.991 2.967 3.015 0.055 14 0 "[ . 1 . 2]" 1 2078 1 30 LYS HA 1 35 PRO HA . . 3.500 3.021 2.862 3.152 . 0 0 "[ . 1 . 2]" 1 2079 1 60 ILE MD 1 60 ILE MG . . 2.320 1.975 1.938 2.003 . 0 0 "[ . 1 . 2]" 1 2080 1 60 ILE MG 1 140 PHE HB3 . . 3.060 3.430 3.384 3.515 0.455 1 0 "[ . 1 . 2]" 1 2081 1 60 ILE MG 1 140 PHE QD . . 2.910 1.879 1.809 1.961 . 0 0 "[ . 1 . 2]" 1 2082 1 60 ILE HA 1 60 ILE MG . . 2.940 2.351 2.315 2.371 . 0 0 "[ . 1 . 2]" 1 2083 1 112 GLU HA 1 112 GLU HB3 . . 2.740 3.003 2.999 3.006 0.266 5 0 "[ . 1 . 2]" 1 2084 1 112 GLU HB3 1 113 ARG H . . 3.190 2.390 2.331 2.460 . 0 0 "[ . 1 . 2]" 1 2085 1 144 ALA HA 1 144 ALA MB . . 2.320 2.120 2.111 2.125 . 0 0 "[ . 1 . 2]" 1 2086 1 29 ARG HA 1 29 ARG HG3 . . 3.350 3.603 3.546 3.732 0.382 9 0 "[ . 1 . 2]" 1 2087 1 195 LEU MD1 1 195 LEU HG . . 2.210 2.127 2.116 2.132 . 0 0 "[ . 1 . 2]" 1 2088 1 201 ILE HA 1 201 ILE MG . . 2.550 2.471 2.418 2.525 . 0 0 "[ . 1 . 2]" 1 2089 1 201 ILE MG 1 205 ASN HB3 . . 3.230 3.227 2.989 3.423 0.193 7 0 "[ . 1 . 2]" 1 2090 1 201 ILE MG 1 202 ALA H . . 3.430 3.115 3.003 3.245 . 0 0 "[ . 1 . 2]" 1 2091 1 201 ILE MG 1 210 GLU H . . 2.800 2.975 2.827 3.094 0.294 5 0 "[ . 1 . 2]" 1 2092 1 237 ILE HA 1 237 ILE MD . . 3.140 2.187 1.962 3.080 . 0 0 "[ . 1 . 2]" 1 2093 1 34 ILE H 1 34 ILE MD . . 2.930 2.702 1.862 2.945 0.015 1 0 "[ . 1 . 2]" 1 2094 1 92 ALA MB 1 102 LYS HE3 . . 3.420 3.713 3.445 4.069 0.649 19 5 "[ ** . 1 .*- +2]" 1 2095 1 246 MET HB3 1 246 MET HG2 . . 2.930 2.433 2.391 2.470 . 0 0 "[ . 1 . 2]" 1 2096 1 155 ILE HA 1 155 ILE MG . . 2.780 2.431 2.371 2.521 . 0 0 "[ . 1 . 2]" 1 2097 1 97 LYS H 1 97 LYS HG3 . . 2.860 3.276 3.196 3.364 0.504 16 2 "[ -. 1 .+ 2]" 1 2098 1 194 ALA HA 1 194 ALA MB . . 2.370 2.128 2.123 2.134 . 0 0 "[ . 1 . 2]" 1 2099 1 14 TYR QE 1 168 GLU HA . . 3.420 2.237 1.932 2.587 . 0 0 "[ . 1 . 2]" 1 2100 1 18 ILE MD 1 18 ILE MG . . 2.610 2.007 1.988 2.030 . 0 0 "[ . 1 . 2]" 1 2101 1 18 ILE MG 1 168 GLU QG . . 3.180 2.962 2.725 3.345 0.165 14 0 "[ . 1 . 2]" 1 2102 1 18 ILE HG13 1 18 ILE MG . . 2.880 2.320 2.312 2.327 . 0 0 "[ . 1 . 2]" 1 2103 1 171 ILE HA 1 171 ILE MG . . 3.100 2.485 2.449 2.525 . 0 0 "[ . 1 . 2]" 1 2104 1 171 ILE MD 1 171 ILE MG . . 2.300 2.134 2.041 2.179 . 0 0 "[ . 1 . 2]" 1 2105 1 128 GLY H 1 171 ILE MG . . 2.930 2.224 2.029 2.388 . 0 0 "[ . 1 . 2]" 1 2106 1 14 TYR QE 1 171 ILE MG . . 3.160 2.912 2.725 3.036 . 0 0 "[ . 1 . 2]" 1 2107 1 211 THR HA 1 212 PRO HD3 . . 3.290 1.900 1.830 2.039 . 0 0 "[ . 1 . 2]" 1 2108 1 161 ALA HA 1 167 ILE MG . . 2.860 2.896 2.541 3.048 0.188 16 0 "[ . 1 . 2]" 1 2109 1 167 ILE HA 1 167 ILE MG . . 2.930 2.351 2.308 2.414 . 0 0 "[ . 1 . 2]" 1 2110 1 75 ARG HA 1 80 SER QB . . 3.410 3.202 3.091 3.607 0.197 11 0 "[ . 1 . 2]" 1 2111 1 100 LYS HA 1 100 LYS QD . . 3.100 2.046 1.954 2.114 . 0 0 "[ . 1 . 2]" 1 2112 1 18 ILE MG 1 162 ALA HA . . 3.440 2.180 1.929 2.444 . 0 0 "[ . 1 . 2]" 1 2113 1 157 SER HA 1 171 ILE MD . . 2.820 1.707 1.680 1.735 . 0 0 "[ . 1 . 2]" 1 2114 1 168 GLU HA 1 171 ILE MD . . 3.030 3.180 2.840 3.339 0.309 16 0 "[ . 1 . 2]" 1 2115 1 162 ALA HA 1 162 ALA MB . . 2.570 2.128 2.125 2.131 . 0 0 "[ . 1 . 2]" 1 2116 1 137 THR HB 1 137 THR MG . . 2.490 2.134 2.132 2.137 . 0 0 "[ . 1 . 2]" 1 2117 1 181 PRO HA 1 185 ILE MG . . 3.340 3.441 3.312 3.526 0.186 9 0 "[ . 1 . 2]" 1 2118 1 181 PRO QB 1 185 ILE MG . . 2.700 2.193 2.044 2.399 . 0 0 "[ . 1 . 2]" 1 2119 1 129 LEU HA 1 129 LEU HG . . 2.860 3.223 2.897 3.672 0.812 7 7 "[* **.*+ 1 - . * 2]" 1 2120 1 129 LEU HG 1 175 VAL HA . . 2.660 2.583 2.139 2.882 0.222 13 0 "[ . 1 . 2]" 1 2121 1 244 ASN HA 1 244 ASN HB3 . . 3.060 2.715 2.442 3.030 . 0 0 "[ . 1 . 2]" 1 2122 1 234 THR HA 1 234 THR MG . . 3.010 2.298 2.177 3.194 0.184 12 0 "[ . 1 . 2]" 1 2123 1 246 MET HA 1 246 MET HB3 . . 2.440 2.491 2.424 2.530 0.090 8 0 "[ . 1 . 2]" 1 2124 1 246 MET HA 1 247 ALA H . . 2.640 2.777 2.312 3.496 0.856 15 4 "[ . *1 + -* 2]" 1 2125 1 79 THR HA 1 80 SER H . . 2.870 2.135 2.096 2.168 . 0 0 "[ . 1 . 2]" 1 2126 1 183 LEU QB 1 216 ILE MG . . 2.790 1.891 1.770 2.053 . 0 0 "[ . 1 . 2]" 1 2127 1 122 ARG HA 1 125 ILE HB . . 3.090 2.136 1.810 2.581 . 0 0 "[ . 1 . 2]" 1 2128 1 60 ILE MD 1 136 ILE HA . . 3.200 1.925 1.841 2.010 . 0 0 "[ . 1 . 2]" 1 2129 1 60 ILE HB 1 60 ILE MD . . 2.980 2.342 2.325 2.362 . 0 0 "[ . 1 . 2]" 1 2130 1 78 ASP HB3 1 100 LYS HG3 . . 3.420 3.198 2.571 3.583 0.163 2 0 "[ . 1 . 2]" 1 2131 1 120 LYS HA 1 120 LYS HB2 . . 2.960 2.515 2.488 2.551 . 0 0 "[ . 1 . 2]" 1 2132 1 25 LEU HA 1 25 LEU HG . . 3.380 3.437 3.349 3.572 0.192 2 0 "[ . 1 . 2]" 1 2133 1 94 TYR HA 1 97 LYS HD3 . . 3.410 2.302 2.188 2.473 . 0 0 "[ . 1 . 2]" 1 2134 1 50 ILE MD 1 50 ILE HG13 . . 2.230 2.114 2.111 2.117 . 0 0 "[ . 1 . 2]" 1 2135 1 50 ILE H 1 50 ILE MD . . 3.110 3.516 3.436 3.567 0.457 16 0 "[ . 1 . 2]" 1 2136 1 40 THR HA 1 41 LEU H . . 3.010 2.125 2.091 2.224 . 0 0 "[ . 1 . 2]" 1 2137 1 199 ILE HA 1 202 ALA MB . . 2.880 2.563 2.372 2.762 . 0 0 "[ . 1 . 2]" 1 2138 1 224 THR HA 1 224 THR MG . . 2.350 2.413 2.370 2.465 0.115 6 0 "[ . 1 . 2]" 1 2139 1 224 THR HB 1 224 THR MG . . 2.210 2.132 2.129 2.135 . 0 0 "[ . 1 . 2]" 1 2140 1 224 THR MG 1 225 ILE H . . 2.990 2.780 2.622 3.056 0.066 7 0 "[ . 1 . 2]" 1 2141 1 224 THR MG 1 226 THR H . . 2.740 3.094 2.959 3.175 0.435 8 0 "[ . 1 . 2]" 1 2142 1 18 ILE MD 1 21 LEU HB3 . . 3.000 3.319 3.278 3.377 0.377 3 0 "[ . 1 . 2]" 1 2143 1 14 TYR QE 1 18 ILE MD . . 2.850 2.755 2.480 2.931 0.081 1 0 "[ . 1 . 2]" 1 2144 1 90 GLU QB 1 90 GLU HG3 . . 2.640 2.314 2.256 2.353 . 0 0 "[ . 1 . 2]" 1 2145 1 90 GLU H 1 90 GLU HG3 . . 3.390 2.651 2.375 3.426 0.036 9 0 "[ . 1 . 2]" 1 2146 1 95 VAL HB 1 95 VAL QG . . 2.230 1.887 1.885 1.889 . 0 0 "[ . 1 . 2]" 1 2147 1 90 GLU HA 1 90 GLU HG2 . . 3.310 2.658 2.245 3.768 0.458 9 0 "[ . 1 . 2]" 1 2148 1 90 GLU HA 1 90 GLU QB . . 2.730 2.377 2.164 2.455 . 0 0 "[ . 1 . 2]" 1 2149 1 90 GLU H 1 90 GLU HG2 . . 3.270 3.280 2.039 3.630 0.360 5 0 "[ . 1 . 2]" 1 2150 1 97 LYS QE 1 97 LYS HG2 . . 3.490 3.429 3.297 3.507 0.017 3 0 "[ . 1 . 2]" 1 2151 1 97 LYS HD2 1 97 LYS HG2 . . 2.520 2.467 2.429 2.503 . 0 0 "[ . 1 . 2]" 1 2152 1 45 GLN HA 1 45 GLN QG . . 3.140 2.389 2.356 2.418 . 0 0 "[ . 1 . 2]" 1 2153 1 115 GLN HA 1 118 ALA MB . . 3.310 2.523 2.386 2.717 . 0 0 "[ . 1 . 2]" 1 2154 1 225 ILE HA 1 225 ILE MG . . 2.710 2.359 2.324 2.395 . 0 0 "[ . 1 . 2]" 1 2155 1 88 ALA HA 1 91 ALA MB . . 2.830 2.281 2.071 2.466 . 0 0 "[ . 1 . 2]" 1 2156 1 82 PHE QD 1 88 ALA HA . . 3.440 3.141 2.968 3.360 . 0 0 "[ . 1 . 2]" 1 2157 1 219 GLN HB2 1 219 GLN QG . . 2.650 2.345 2.145 2.445 . 0 0 "[ . 1 . 2]" 1 2158 1 94 TYR HA 1 97 LYS QE . . 3.340 3.693 3.457 4.098 0.758 14 3 "[ . * 1 +. - 2]" 1 2159 1 97 LYS HA 1 97 LYS QE . . 3.220 3.052 2.695 3.269 0.049 19 0 "[ . 1 . 2]" 1 2160 1 191 SER HA 1 194 ALA MB . . 3.330 2.793 2.509 3.210 . 0 0 "[ . 1 . 2]" 1 2161 1 98 ASP HA 1 98 ASP HB3 . . 2.770 3.014 3.010 3.018 0.248 20 0 "[ . 1 . 2]" 1 2162 1 41 LEU HA 1 42 PRO QD . . 3.250 1.938 1.865 2.015 . 0 0 "[ . 1 . 2]" 1 2163 1 215 LEU HA 1 215 LEU HG . . 2.450 2.800 2.672 2.910 0.460 9 0 "[ . 1 . 2]" 1 2164 1 56 ALA H 1 56 ALA MB . . 2.400 2.219 2.191 2.253 . 0 0 "[ . 1 . 2]" 1 2165 1 69 VAL HA 1 69 VAL MG1 . . 3.070 2.437 2.238 2.662 . 0 0 "[ . 1 . 2]" 1 2166 1 25 LEU QD 1 69 VAL MG1 . . 3.050 1.935 1.780 2.224 . 0 0 "[ . 1 . 2]" 1 2167 1 69 VAL HB 1 69 VAL MG1 . . 2.580 2.123 2.118 2.128 . 0 0 "[ . 1 . 2]" 1 2168 1 168 GLU QG 1 169 GLN HG3 . . 2.840 3.000 2.245 3.173 0.333 19 0 "[ . 1 . 2]" 1 2169 1 120 LYS HA 1 121 ILE MG . . 2.930 3.223 3.163 3.307 0.377 16 0 "[ . 1 . 2]" 1 2170 1 121 ILE HA 1 121 ILE MG . . 2.580 2.365 2.346 2.398 . 0 0 "[ . 1 . 2]" 1 2171 1 121 ILE HB 1 121 ILE MG . . 2.330 2.124 2.120 2.129 . 0 0 "[ . 1 . 2]" 1 2172 1 2 VAL HA 1 2 VAL MG2 . . 2.390 2.552 2.504 2.605 0.215 5 0 "[ . 1 . 2]" 1 2173 1 2 VAL MG2 1 21 LEU HA . . 2.370 1.789 1.743 1.871 . 0 0 "[ . 1 . 2]" 1 2174 1 2 VAL HB 1 2 VAL MG2 . . 2.210 2.110 2.104 2.117 . 0 0 "[ . 1 . 2]" 1 2175 1 2 VAL MG2 1 50 ILE HA . . 3.090 3.545 3.411 3.810 0.720 2 5 "[-+ . * 1* . *]" 1 2176 1 175 VAL H 1 175 VAL HB . . 3.250 3.136 2.467 3.582 0.332 5 0 "[ . 1 . 2]" 1 2177 1 238 ALA HA 1 238 ALA MB . . 2.480 2.118 2.112 2.127 . 0 0 "[ . 1 . 2]" 1 2178 1 162 ALA HA 1 238 ALA MB . . 3.350 3.700 3.502 4.168 0.818 6 2 "[- .+ 1 . 2]" 1 2179 1 22 ARG HD3 1 238 ALA MB . . 3.240 2.783 2.466 3.204 . 0 0 "[ . 1 . 2]" 1 2180 1 238 ALA MB 1 239 LEU H . . 3.320 2.433 2.209 2.776 . 0 0 "[ . 1 . 2]" 1 2181 1 84 ASN HA 1 104 THR MG . . 2.340 1.959 1.768 2.201 . 0 0 "[ . 1 . 2]" 1 2182 1 104 THR HB 1 104 THR MG . . 2.420 2.135 2.133 2.138 . 0 0 "[ . 1 . 2]" 1 2183 1 97 LYS HB2 1 97 LYS HG3 . . 2.970 2.352 2.318 2.401 . 0 0 "[ . 1 . 2]" 1 2184 1 107 TYR HA 1 108 SER H . . 3.030 2.248 2.176 2.881 . 0 0 "[ . 1 . 2]" 1 2185 1 209 PHE HA 1 209 PHE QD . . 3.340 2.699 2.405 2.835 . 0 0 "[ . 1 . 2]" 1 2186 1 233 VAL HA 1 233 VAL MG1 . . 2.450 2.422 2.378 2.469 0.019 14 0 "[ . 1 . 2]" 1 2187 1 92 ALA MB 1 102 LYS HE2 . . 3.130 3.266 3.030 3.449 0.319 17 0 "[ . 1 . 2]" 1 2188 1 92 ALA MB 1 102 LYS QB . . 2.670 2.896 2.778 3.079 0.409 8 0 "[ . 1 . 2]" 1 2189 1 92 ALA MB 1 102 LYS HG2 . . 2.750 1.845 1.784 1.926 . 0 0 "[ . 1 . 2]" 1 2190 1 92 ALA H 1 92 ALA MB . . 2.340 2.182 2.164 2.204 . 0 0 "[ . 1 . 2]" 1 2191 1 82 PHE QD 1 92 ALA MB . . 2.880 2.839 2.680 2.901 0.021 15 0 "[ . 1 . 2]" 1 2192 1 52 LEU HA 1 52 LEU HG . . 2.340 2.620 2.544 2.648 0.308 20 0 "[ . 1 . 2]" 1 2193 1 113 ARG HA 1 113 ARG QD . . 3.140 1.955 1.868 2.124 . 0 0 "[ . 1 . 2]" 1 2194 1 94 TYR HA 1 94 TYR QD . . 3.160 2.915 2.810 3.150 . 0 0 "[ . 1 . 2]" 1 2195 1 211 THR HA 1 211 THR MG . . 2.290 2.358 2.324 2.392 0.102 10 0 "[ . 1 . 2]" 1 2196 1 158 THR HA 1 158 THR MG . . 2.870 2.302 2.280 2.329 . 0 0 "[ . 1 . 2]" 1 2197 1 246 MET HA 1 246 MET HG3 . . 2.810 3.011 2.955 3.109 0.299 9 0 "[ . 1 . 2]" 1 2198 1 163 ARG HA 1 239 LEU HG . . 3.400 3.102 2.479 3.487 0.087 5 0 "[ . 1 . 2]" 1 2199 1 225 ILE HA 1 225 ILE HB . . 2.900 3.017 3.014 3.021 0.121 2 0 "[ . 1 . 2]" 1 2200 1 66 VAL H 1 66 VAL HA . . 2.590 2.823 2.807 2.834 0.244 1 0 "[ . 1 . 2]" 1 2201 1 89 THR HA 1 89 THR MG . . 2.380 2.193 2.167 2.221 . 0 0 "[ . 1 . 2]" 1 2202 1 89 THR HA 1 92 ALA MB . . 3.140 2.518 2.351 2.672 . 0 0 "[ . 1 . 2]" 1 2203 1 212 PRO HD2 1 212 PRO HG2 . . 3.130 2.330 2.321 2.340 . 0 0 "[ . 1 . 2]" 1 2204 1 36 LEU QD 1 242 ASN HA . . 2.680 2.098 1.821 2.591 . 0 0 "[ . 1 . 2]" 1 2205 1 70 TYR HA 1 71 VAL H . . 3.360 2.183 2.119 2.250 . 0 0 "[ . 1 . 2]" 1 2206 1 76 ALA MB 1 140 PHE HA . . 2.590 2.182 2.011 2.373 . 0 0 "[ . 1 . 2]" 1 2207 1 76 ALA MB 1 140 PHE HB2 . . 3.220 3.411 3.316 3.515 0.295 8 0 "[ . 1 . 2]" 1 2208 1 60 ILE HB 1 76 ALA MB . . 3.430 3.537 3.393 3.604 0.174 17 0 "[ . 1 . 2]" 1 2209 1 199 ILE MG 1 200 GLN HA . . 3.070 3.141 2.917 3.340 0.270 6 0 "[ . 1 . 2]" 1 2210 1 199 ILE HB 1 199 ILE MG . . 2.600 2.127 2.121 2.132 . 0 0 "[ . 1 . 2]" 1 2211 1 199 ILE H 1 199 ILE MG . . 3.390 3.720 3.663 3.774 0.384 6 0 "[ . 1 . 2]" 1 2212 1 32 TYR QD 1 199 ILE MG . . 2.630 2.208 1.890 2.862 0.232 20 0 "[ . 1 . 2]" 1 2213 1 137 THR HA 1 137 THR MG . . 2.670 2.421 2.367 2.505 . 0 0 "[ . 1 . 2]" 1 2214 1 16 VAL HA 1 16 VAL MG2 . . 2.490 2.300 2.280 2.315 . 0 0 "[ . 1 . 2]" 1 2215 1 16 VAL HB 1 16 VAL MG2 . . 2.180 2.129 2.126 2.131 . 0 0 "[ . 1 . 2]" 1 2216 1 16 VAL H 1 16 VAL MG2 . . 2.830 2.211 2.136 2.265 . 0 0 "[ . 1 . 2]" 1 2217 1 223 VAL HB 1 223 VAL QG . . 2.300 1.894 1.892 1.897 . 0 0 "[ . 1 . 2]" 1 2218 1 100 LYS HA 1 100 LYS QE . . 2.870 3.165 2.695 3.883 1.013 9 6 "[ **. *+1 -*. 2]" 1 2219 1 166 PHE HA 1 166 PHE QD . . 3.470 2.832 2.704 3.006 . 0 0 "[ . 1 . 2]" 1 2220 1 25 LEU QD 1 69 VAL MG2 . . 3.310 2.744 1.876 3.691 0.381 4 0 "[ . 1 . 2]" 1 2221 1 6 LEU QD 1 54 ASN HA . . 3.350 2.112 1.759 2.268 . 0 0 "[ . 1 . 2]" 1 2222 1 103 VAL HA 1 103 VAL MG2 . . 2.650 2.342 2.304 2.394 . 0 0 "[ . 1 . 2]" 1 2223 1 103 VAL HA 1 104 THR H . . 3.050 2.137 2.112 2.157 . 0 0 "[ . 1 . 2]" 1 2224 1 113 ARG QD 1 116 ILE MD . . 2.940 2.183 1.962 2.524 . 0 0 "[ . 1 . 2]" 1 2225 1 197 LYS HD2 1 197 LYS QG . . 2.490 2.257 2.172 2.420 . 0 0 "[ . 1 . 2]" 1 2226 1 197 LYS HA 1 197 LYS QG . . 3.270 2.394 2.289 2.542 . 0 0 "[ . 1 . 2]" 1 2227 1 101 ARG HA 1 101 ARG HB3 . . 2.890 2.372 2.277 3.011 0.121 7 0 "[ . 1 . 2]" 1 2228 1 101 ARG QB 1 101 ARG QD . . 2.990 2.246 2.048 2.595 . 0 0 "[ . 1 . 2]" 1 2229 1 101 ARG QB 1 102 LYS H . . 3.430 3.303 3.138 3.868 0.438 7 0 "[ . 1 . 2]" 1 2230 1 101 ARG H 1 101 ARG HB3 . . 3.240 3.517 2.732 3.845 0.605 14 1 "[ . 1 +. 2]" 1 2231 1 79 THR HA 1 101 ARG QB . . 3.450 3.560 1.890 3.806 0.356 10 0 "[ . 1 . 2]" 1 2232 1 42 PRO HA 1 42 PRO HB3 . . 2.820 2.286 2.269 2.295 . 0 0 "[ . 1 . 2]" 1 2233 1 31 LEU QD 1 203 SER HB3 . . 2.640 2.530 2.166 2.761 0.121 13 0 "[ . 1 . 2]" 1 2234 1 203 SER HA 1 203 SER HB3 . . 2.920 3.029 3.021 3.032 0.112 11 0 "[ . 1 . 2]" 1 2235 1 89 THR H 1 89 THR HB . . 3.420 3.525 3.489 3.555 0.135 17 0 "[ . 1 . 2]" 1 2236 1 123 GLU HA 1 186 ILE MD . . 2.820 2.435 1.936 2.812 . 0 0 "[ . 1 . 2]" 1 2237 1 123 GLU HG3 1 186 ILE MD . . 2.910 2.652 1.770 3.226 0.316 18 0 "[ . 1 . 2]" 1 2238 1 181 PRO QB 1 186 ILE MD . . 2.330 2.500 2.361 2.700 0.370 11 0 "[ . 1 . 2]" 1 2239 1 186 ILE H 1 186 ILE MD . . 2.980 3.154 3.044 3.233 0.253 14 0 "[ . 1 . 2]" 1 2240 1 218 ALA HA 1 218 ALA MB . . 2.230 2.118 2.111 2.123 . 0 0 "[ . 1 . 2]" 1 2241 1 184 ALA MB 1 218 ALA HA . . 3.120 2.135 1.955 2.522 . 0 0 "[ . 1 . 2]" 1 2242 1 229 ASP H 1 229 ASP HB2 . . 3.070 2.687 2.613 2.775 . 0 0 "[ . 1 . 2]" 1 2243 1 132 LEU HB3 1 132 LEU QD . . 2.980 2.117 2.070 2.451 . 0 0 "[ . 1 . 2]" 1 2244 1 14 TYR QD 1 132 LEU QD . . 3.090 2.966 2.801 3.414 0.324 18 0 "[ . 1 . 2]" 1 2245 1 222 ARG HA 1 222 ARG QG . . 3.180 2.639 2.475 3.318 0.138 10 0 "[ . 1 . 2]" 1 2246 1 10 THR HA 1 10 THR MG . . 2.210 2.364 2.324 2.418 0.208 19 0 "[ . 1 . 2]" 1 2247 1 9 ALA HA 1 10 THR MG . . 3.150 3.568 3.461 3.765 0.615 18 1 "[ . 1 . + 2]" 1 2248 1 138 THR MG 1 143 ASN QB . . 3.450 2.064 1.932 2.338 . 0 0 "[ . 1 . 2]" 1 2249 1 146 SER HA 1 146 SER HB2 . . 2.950 2.587 2.474 3.024 0.074 6 0 "[ . 1 . 2]" 1 2250 1 229 ASP H 1 229 ASP HB3 . . 3.160 2.480 2.383 2.547 . 0 0 "[ . 1 . 2]" 1 2251 1 50 ILE HA 1 51 HIS H . . 3.320 2.200 2.142 2.374 . 0 0 "[ . 1 . 2]" 1 2252 1 219 GLN H 1 219 GLN QG . . 3.180 2.976 2.235 3.262 0.082 4 0 "[ . 1 . 2]" 1 2253 1 120 LYS QD 1 120 LYS QE . . 2.230 2.085 2.000 2.091 . 0 0 "[ . 1 . 2]" 1 2254 1 120 LYS QE 1 149 SER QB . . 3.410 3.208 2.429 3.748 0.338 11 0 "[ . 1 . 2]" 1 2255 1 214 VAL HA 1 214 VAL QG . . 2.550 2.291 2.115 2.356 . 0 0 "[ . 1 . 2]" 1 2256 1 214 VAL HB 1 214 VAL QG . . 2.070 1.894 1.890 1.898 . 0 0 "[ . 1 . 2]" 1 2257 1 214 VAL QG 1 215 LEU H . . 2.820 2.896 2.851 2.931 0.111 13 0 "[ . 1 . 2]" 1 2258 1 105 LEU HA 1 105 LEU QD . . 3.330 1.988 1.932 2.070 . 0 0 "[ . 1 . 2]" 1 2259 1 233 VAL HB 1 234 THR MG . . 3.130 3.098 2.937 3.368 0.238 12 0 "[ . 1 . 2]" 1 2260 1 41 LEU HA 1 41 LEU HG . . 3.270 3.127 2.907 3.197 . 0 0 "[ . 1 . 2]" 1 2261 1 39 SER HA 1 39 SER HB3 . . 2.920 2.718 2.322 3.029 0.109 19 0 "[ . 1 . 2]" 1 2262 1 3 SER HA 1 4 PHE H . . 2.980 2.252 2.203 2.336 . 0 0 "[ . 1 . 2]" 1 2263 1 33 ASP HA 1 33 ASP HB3 . . 2.790 3.004 2.994 3.009 0.219 10 0 "[ . 1 . 2]" 1 2264 1 33 ASP HA 1 33 ASP HB2 . . 2.890 2.421 2.374 2.483 . 0 0 "[ . 1 . 2]" 1 2265 1 184 ALA MB 1 185 ILE H . . 2.600 2.312 2.226 2.390 . 0 0 "[ . 1 . 2]" 1 2266 1 40 THR HB 1 40 THR MG . . 2.320 2.135 2.131 2.137 . 0 0 "[ . 1 . 2]" 1 2267 1 228 VAL HA 1 228 VAL MG1 . . 3.210 2.362 2.267 3.172 . 0 0 "[ . 1 . 2]" 1 2268 1 207 GLY HA2 1 228 VAL MG1 . . 3.220 2.647 2.028 3.014 . 0 0 "[ . 1 . 2]" 1 2269 1 18 ILE MD 1 21 LEU QD . . 2.810 2.343 2.296 2.438 . 0 0 "[ . 1 . 2]" 1 2270 1 21 LEU QD 1 158 THR HA . . 3.180 2.788 2.636 3.025 . 0 0 "[ . 1 . 2]" 1 2271 1 18 ILE HA 1 21 LEU QD . . 3.260 2.834 2.786 2.896 . 0 0 "[ . 1 . 2]" 1 2272 1 21 LEU QD 1 162 ALA MB . . 2.030 2.034 1.975 2.098 0.068 11 0 "[ . 1 . 2]" 1 2273 1 131 ALA HA 1 131 ALA MB . . 2.370 2.128 2.124 2.131 . 0 0 "[ . 1 . 2]" 1 2274 1 247 ALA HA 1 247 ALA MB . . 2.240 2.128 2.116 2.135 . 0 0 "[ . 1 . 2]" 1 2275 1 247 ALA H 1 247 ALA MB . . 2.420 2.450 2.252 2.864 0.444 17 0 "[ . 1 . 2]" 1 2276 1 114 LEU HA 1 114 LEU MD2 . . 2.710 1.985 1.961 2.027 . 0 0 "[ . 1 . 2]" 1 2277 1 109 GLY QA 1 114 LEU MD2 . . 3.270 2.140 1.851 2.440 . 0 0 "[ . 1 . 2]" 1 2278 1 107 TYR QD 1 114 LEU MD2 . . 2.850 2.223 2.102 2.343 . 0 0 "[ . 1 . 2]" 1 2279 1 71 VAL HA 1 71 VAL QG . . 2.860 2.124 2.115 2.132 . 0 0 "[ . 1 . 2]" 1 2280 1 154 LEU HA 1 154 LEU HG . . 2.370 2.596 2.380 3.000 0.630 12 6 "[ - . * ** + *. 2]" 1 2281 1 180 LEU H 1 180 LEU MD2 . . 2.990 2.850 2.672 3.376 0.386 9 0 "[ . 1 . 2]" 1 2282 1 118 ALA HA 1 118 ALA MB . . 2.400 2.128 2.124 2.131 . 0 0 "[ . 1 . 2]" 1 2283 1 118 ALA MB 1 149 SER QB . . 2.640 2.086 1.918 2.701 0.061 4 0 "[ . 1 . 2]" 1 2284 1 118 ALA H 1 118 ALA MB . . 2.560 2.256 2.248 2.264 . 0 0 "[ . 1 . 2]" 1 2285 1 118 ALA MB 1 120 LYS H . . 2.810 2.505 2.403 2.602 . 0 0 "[ . 1 . 2]" 1 2286 1 121 ILE MD 1 123 GLU HG3 . . 3.200 3.560 3.244 4.063 0.863 10 5 "[ .* + **. - 2]" 1 2287 1 121 ILE HB 1 121 ILE MD . . 2.580 2.427 2.408 2.454 . 0 0 "[ . 1 . 2]" 1 2288 1 137 THR MG 1 141 TYR QD . . 2.710 2.646 2.364 2.877 0.167 11 0 "[ . 1 . 2]" 1 2289 1 137 THR MG 1 141 TYR QE . . 2.930 2.509 2.015 3.017 0.087 2 0 "[ . 1 . 2]" 1 2290 1 177 LYS QE 1 177 LYS QG . . 2.080 2.246 2.086 2.337 0.257 14 0 "[ . 1 . 2]" 1 2291 1 216 ILE HA 1 216 ILE MG . . 2.580 2.357 2.321 2.414 . 0 0 "[ . 1 . 2]" 1 2292 1 216 ILE MG 1 220 ASN HA . . 2.430 2.166 1.789 2.406 . 0 0 "[ . 1 . 2]" 1 2293 1 216 ILE MG 1 221 GLN H . . 3.050 2.469 2.355 2.725 . 0 0 "[ . 1 . 2]" 1 2294 1 194 ALA HA 1 197 LYS QE . . 3.400 2.795 2.143 4.509 1.109 13 1 "[ . 1 + . 2]" 1 2295 1 10 THR HA 1 175 VAL QG . . 2.420 1.904 1.787 2.052 . 0 0 "[ . 1 . 2]" 1 2296 1 175 VAL HA 1 175 VAL QG . . 2.370 2.273 2.125 2.514 0.144 20 0 "[ . 1 . 2]" 1 2297 1 175 VAL HB 1 175 VAL QG . . 2.110 1.887 1.879 1.892 . 0 0 "[ . 1 . 2]" 1 2298 1 29 ARG QB 1 29 ARG QD . . 3.080 2.233 2.022 2.456 . 0 0 "[ . 1 . 2]" 1 2299 1 29 ARG QD 1 31 LEU QD . . 3.090 1.849 1.789 1.943 . 0 0 "[ . 1 . 2]" 1 2300 1 106 PRO HA 1 106 PRO HB3 . . 2.550 2.261 2.254 2.292 . 0 0 "[ . 1 . 2]" 1 2301 1 129 LEU HA 1 129 LEU QD . . 2.450 1.843 1.781 1.914 . 0 0 "[ . 1 . 2]" 1 2302 1 129 LEU QB 1 129 LEU QD . . 2.900 1.984 1.943 2.059 . 0 0 "[ . 1 . 2]" 1 2303 1 167 ILE MD 1 188 LEU QD . . 2.380 2.516 2.283 2.657 0.277 13 0 "[ . 1 . 2]" 1 2304 1 188 LEU H 1 188 LEU QD . . 3.150 2.985 2.039 3.096 . 0 0 "[ . 1 . 2]" 1 2305 1 180 LEU MD1 1 180 LEU HG . . 2.160 2.112 2.106 2.125 . 0 0 "[ . 1 . 2]" 1 2306 1 180 LEU MD1 1 180 LEU MD2 . . 2.050 2.074 2.056 2.081 0.031 15 0 "[ . 1 . 2]" 1 2307 1 110 ASN HA 1 110 ASN HB2 . . 2.890 2.468 2.450 2.488 . 0 0 "[ . 1 . 2]" 1 2308 1 158 THR HB 1 158 THR MG . . 2.510 2.128 2.126 2.129 . 0 0 "[ . 1 . 2]" 1 2309 1 17 PHE QE 1 158 THR MG . . 2.720 2.049 1.952 2.157 . 0 0 "[ . 1 . 2]" 1 2310 1 57 ASP HA 1 57 ASP HB3 . . 2.990 3.009 3.004 3.012 0.022 11 0 "[ . 1 . 2]" 1 2311 1 53 THR MG 1 57 ASP HA . . 2.470 1.754 1.717 1.801 . 0 0 "[ . 1 . 2]" 1 2312 1 57 ASP H 1 57 ASP HA . . 2.790 2.266 2.257 2.279 . 0 0 "[ . 1 . 2]" 1 2313 1 101 ARG HA 1 101 ARG QB . . 2.710 2.176 2.145 2.422 . 0 0 "[ . 1 . 2]" 1 2314 1 101 ARG HA 1 102 LYS H . . 2.850 2.124 2.103 2.188 . 0 0 "[ . 1 . 2]" 1 2315 1 98 ASP HA 1 98 ASP HB2 . . 2.810 2.448 2.413 2.510 . 0 0 "[ . 1 . 2]" 1 2316 1 142 TYR HB2 1 142 TYR QD . . 3.440 2.731 2.686 2.772 . 0 0 "[ . 1 . 2]" 1 2317 1 47 TYR HA 1 66 VAL QG . . 3.420 2.332 2.258 2.431 . 0 0 "[ . 1 . 2]" 1 2318 1 53 THR MG 1 57 ASP HB2 . . 3.280 3.591 3.545 3.643 0.363 17 0 "[ . 1 . 2]" 1 2319 1 57 ASP HA 1 57 ASP HB2 . . 2.950 2.438 2.404 2.462 . 0 0 "[ . 1 . 2]" 1 2320 1 57 ASP H 1 57 ASP HB2 . . 3.330 3.286 3.261 3.350 0.020 20 0 "[ . 1 . 2]" 1 2321 1 72 MET HA 1 72 MET QG . . 3.510 2.835 2.512 3.138 . 0 0 "[ . 1 . 2]" 1 2322 1 7 SER H 1 7 SER HB2 . . 2.720 2.457 2.407 2.504 . 0 0 "[ . 1 . 2]" 1 2323 1 178 THR MG 1 179 PHE H . . 2.970 3.275 3.211 3.323 0.353 15 0 "[ . 1 . 2]" 1 2324 1 131 ALA H 1 178 THR MG . . 3.130 2.702 2.480 3.002 . 0 0 "[ . 1 . 2]" 1 2325 1 178 THR HA 1 178 THR MG . . 2.760 2.249 2.190 2.274 . 0 0 "[ . 1 . 2]" 1 2326 1 211 THR MG 1 212 PRO HD2 . . 3.290 2.840 2.580 3.040 . 0 0 "[ . 1 . 2]" 1 2327 1 211 THR HA 1 212 PRO HD2 . . 3.250 2.599 2.536 2.661 . 0 0 "[ . 1 . 2]" 1 2328 1 26 PRO HA 1 26 PRO QG . . 3.380 3.236 2.913 3.512 0.132 2 0 "[ . 1 . 2]" 1 2329 1 26 PRO HA 1 27 TYR H . . 2.850 2.411 2.348 2.460 . 0 0 "[ . 1 . 2]" 1 2330 1 185 ILE HA 1 188 LEU HG . . 3.470 3.302 2.671 3.816 0.346 16 0 "[ . 1 . 2]" 1 2331 1 144 ALA HA 1 147 ALA MB . . 2.940 2.172 2.022 2.510 . 0 0 "[ . 1 . 2]" 1 2332 1 142 TYR QD 1 147 ALA MB . . 2.970 2.497 2.189 2.770 . 0 0 "[ . 1 . 2]" 1 2333 1 142 TYR QE 1 147 ALA MB . . 2.850 2.767 2.439 2.910 0.060 9 0 "[ . 1 . 2]" 1 2334 1 185 ILE MD 1 185 ILE HG13 . . 2.560 2.114 2.113 2.116 . 0 0 "[ . 1 . 2]" 1 2335 1 21 LEU HB3 1 21 LEU HG . . 3.000 2.397 2.385 2.414 . 0 0 "[ . 1 . 2]" 1 2336 1 20 ASN HA 1 23 LYS QD . . 3.290 2.027 1.860 2.152 . 0 0 "[ . 1 . 2]" 1 2337 1 28 GLU HA 1 28 GLU HB2 . . 3.000 2.441 2.340 2.485 . 0 0 "[ . 1 . 2]" 1 2338 1 113 ARG HA 1 116 ILE MD . . 2.810 2.131 1.992 2.441 . 0 0 "[ . 1 . 2]" 1 2339 1 112 GLU HG3 1 116 ILE MD . . 2.700 2.826 2.728 2.882 0.182 6 0 "[ . 1 . 2]" 1 2340 1 116 ILE MD 1 116 ILE HG12 . . 2.120 2.116 2.113 2.118 . 0 0 "[ . 1 . 2]" 1 2341 1 116 ILE MD 1 116 ILE HG13 . . 2.140 2.113 2.109 2.114 . 0 0 "[ . 1 . 2]" 1 2342 1 116 ILE H 1 116 ILE MD . . 3.000 3.352 3.319 3.392 0.392 16 0 "[ . 1 . 2]" 1 2343 1 219 GLN HA 1 219 GLN HB3 . . 2.520 2.449 2.399 2.473 . 0 0 "[ . 1 . 2]" 1 2344 1 18 ILE HA 1 18 ILE MG . . 3.040 2.424 2.407 2.469 . 0 0 "[ . 1 . 2]" 1 2345 1 18 ILE HA 1 18 ILE MD . . 2.840 1.897 1.882 1.924 . 0 0 "[ . 1 . 2]" 1 2346 1 169 GLN HA 1 169 GLN HG2 . . 3.190 2.585 2.515 2.711 . 0 0 "[ . 1 . 2]" 1 2347 1 168 GLU QG 1 169 GLN HA . . 2.840 2.920 2.858 3.038 0.198 14 0 "[ . 1 . 2]" 1 2348 1 49 LEU QD 1 64 ILE H . . 2.980 3.017 2.911 3.099 0.119 7 0 "[ . 1 . 2]" 1 2349 1 216 ILE MD 1 216 ILE QG . . 2.220 1.883 1.880 1.886 . 0 0 "[ . 1 . 2]" 1 2350 1 216 ILE MD 1 223 VAL H . . 3.200 3.544 3.468 3.609 0.409 20 0 "[ . 1 . 2]" 1 2351 1 138 THR MG 1 147 ALA HA . . 3.330 2.157 1.991 2.379 . 0 0 "[ . 1 . 2]" 1 2352 1 36 LEU HB3 1 36 LEU HG . . 2.590 2.463 2.376 2.528 . 0 0 "[ . 1 . 2]" 1 2353 1 139 LEU MD2 1 139 LEU HG . . 2.550 2.121 2.115 2.124 . 0 0 "[ . 1 . 2]" 1 2354 1 139 LEU HA 1 139 LEU MD2 . . 2.520 1.797 1.774 1.833 . 0 0 "[ . 1 . 2]" 1 2355 1 139 LEU MD2 1 151 LEU H . . 3.410 2.717 2.641 2.847 . 0 0 "[ . 1 . 2]" 1 2356 1 139 LEU H 1 139 LEU MD2 . . 2.980 3.140 3.099 3.168 0.188 14 0 "[ . 1 . 2]" 1 2357 1 2 VAL MG1 1 21 LEU HA . . 2.350 2.490 2.431 2.529 0.179 20 0 "[ . 1 . 2]" 1 2358 1 2 VAL MG1 1 20 ASN QB . . 2.530 2.017 1.915 2.167 . 0 0 "[ . 1 . 2]" 1 2359 1 2 VAL MG1 1 17 PHE QE . . 2.370 2.185 2.068 2.277 . 0 0 "[ . 1 . 2]" 1 2360 1 177 LYS QB 1 178 THR H . . 2.860 1.841 1.696 2.139 . 0 0 "[ . 1 . 2]" 1 2361 1 243 ARG HA 1 243 ARG HG3 . . 3.440 3.213 2.966 3.704 0.264 6 0 "[ . 1 . 2]" 1 2362 1 30 LYS QD 1 30 LYS HE3 . . 2.790 2.304 2.169 2.390 . 0 0 "[ . 1 . 2]" 1 2363 1 30 LYS HE3 1 30 LYS HG2 . . 3.500 2.900 2.348 3.690 0.190 9 0 "[ . 1 . 2]" 1 2364 1 144 ALA H 1 144 ALA MB . . 2.990 2.191 2.180 2.197 . 0 0 "[ . 1 . 2]" 1 2365 1 142 TYR QD 1 144 ALA MB . . 3.500 3.792 3.677 3.878 0.378 6 0 "[ . 1 . 2]" 1 2366 1 142 TYR QE 1 144 ALA MB . . 3.090 3.079 2.908 3.208 0.118 12 0 "[ . 1 . 2]" 1 2367 1 232 VAL HB 1 232 VAL MG1 . . 2.410 2.128 2.125 2.132 . 0 0 "[ . 1 . 2]" 1 2368 1 247 ALA H 1 247 ALA HA . . 3.020 2.759 2.250 2.894 . 0 0 "[ . 1 . 2]" 1 2369 1 161 ALA H 1 161 ALA MB . . 2.950 2.246 2.218 2.260 . 0 0 "[ . 1 . 2]" 1 2370 1 100 LYS HA 1 100 LYS HG2 . . 2.870 2.982 2.890 3.043 0.173 18 0 "[ . 1 . 2]" 1 2371 1 100 LYS QE 1 100 LYS HG2 . . 3.030 2.988 2.316 3.463 0.433 19 0 "[ . 1 . 2]" 1 2372 1 211 THR HB 1 211 THR MG . . 2.160 2.133 2.131 2.135 . 0 0 "[ . 1 . 2]" 1 2373 1 211 THR H 1 211 THR HB . . 3.210 2.821 2.539 2.897 . 0 0 "[ . 1 . 2]" 1 2374 1 127 LEU HB3 1 171 ILE HA . . 3.490 3.617 3.342 3.818 0.328 14 0 "[ . 1 . 2]" 1 2375 1 171 ILE HA 1 179 PHE QE . . 3.490 2.317 1.928 2.960 . 0 0 "[ . 1 . 2]" 1 2376 1 219 GLN HA 1 219 GLN HB2 . . 2.930 3.001 2.994 3.007 0.077 14 0 "[ . 1 . 2]" 1 2377 1 146 SER HA 1 146 SER HB3 . . 3.080 2.970 2.488 3.033 . 0 0 "[ . 1 . 2]" 1 2378 1 186 ILE MD 1 186 ILE MG . . 2.100 2.064 1.940 2.221 0.121 11 0 "[ . 1 . 2]" 1 2379 1 186 ILE HA 1 186 ILE MG . . 2.780 2.443 2.359 2.519 . 0 0 "[ . 1 . 2]" 1 2380 1 186 ILE HB 1 186 ILE MG . . 2.420 2.122 2.117 2.126 . 0 0 "[ . 1 . 2]" 1 2381 1 186 ILE MG 1 187 SER H . . 3.210 3.345 3.259 3.450 0.240 6 0 "[ . 1 . 2]" 1 2382 1 16 VAL HA 1 19 SER QB . . 3.050 2.304 2.235 2.412 . 0 0 "[ . 1 . 2]" 1 2383 1 161 ALA HA 1 167 ILE MD . . 3.270 3.469 3.378 3.559 0.289 16 0 "[ . 1 . 2]" 1 2384 1 164 TYR HB2 1 167 ILE MD . . 3.080 2.118 1.965 2.972 . 0 0 "[ . 1 . 2]" 1 2385 1 167 ILE HB 1 167 ILE MD . . 2.770 2.379 2.315 2.447 . 0 0 "[ . 1 . 2]" 1 2386 1 81 TYR HA 1 103 VAL MG2 . . 3.030 3.484 3.441 3.521 0.491 12 0 "[ . 1 . 2]" 1 2387 1 25 LEU H 1 25 LEU QD . . 3.030 2.517 1.781 2.663 . 0 0 "[ . 1 . 2]" 1 2388 1 180 LEU QB 1 180 LEU MD2 . . 3.240 2.277 2.046 2.339 . 0 0 "[ . 1 . 2]" 1 2389 1 56 ALA HA 1 56 ALA MB . . 2.160 2.123 2.117 2.126 . 0 0 "[ . 1 . 2]" 1 2390 1 56 ALA H 1 56 ALA HA . . 2.850 2.889 2.884 2.895 0.045 2 0 "[ . 1 . 2]" 1 2391 1 228 VAL HA 1 228 VAL MG2 . . 3.210 3.155 2.215 3.212 0.002 20 0 "[ . 1 . 2]" 1 2392 1 125 ILE HA 1 125 ILE MD . . 3.100 2.200 2.103 2.329 . 0 0 "[ . 1 . 2]" 1 2393 1 125 ILE MD 1 149 SER QB . . 2.640 2.316 1.934 2.720 0.080 4 0 "[ . 1 . 2]" 1 2394 1 120 LYS QE 1 125 ILE MD . . 3.090 2.352 1.877 3.601 0.511 3 1 "[ + . 1 . 2]" 1 2395 1 125 ILE HB 1 125 ILE MD . . 2.310 2.387 2.355 2.407 0.097 20 0 "[ . 1 . 2]" 1 2396 1 186 ILE HA 1 186 ILE MD . . 3.430 2.905 1.972 3.790 0.360 3 0 "[ . 1 . 2]" 1 2397 1 201 ILE MD 1 210 GLU QG . . 2.500 2.371 1.923 2.801 0.301 18 0 "[ . 1 . 2]" 1 2398 1 201 ILE MD 1 201 ILE HG12 . . 2.340 2.117 2.114 2.120 . 0 0 "[ . 1 . 2]" 1 2399 1 201 ILE H 1 201 ILE MD . . 2.970 3.305 3.212 3.404 0.434 10 0 "[ . 1 . 2]" 1 2400 1 69 VAL HA 1 69 VAL MG2 . . 2.780 2.854 2.508 3.167 0.387 4 0 "[ . 1 . 2]" 1 2401 1 225 ILE HA 1 225 ILE MD . . 2.690 2.081 2.013 2.120 . 0 0 "[ . 1 . 2]" 1 2402 1 225 ILE HB 1 225 ILE MD . . 2.990 3.233 3.231 3.235 0.245 6 0 "[ . 1 . 2]" 1 2403 1 225 ILE MD 1 230 ALA MB . . 2.490 2.315 2.089 2.579 0.089 16 0 "[ . 1 . 2]" 1 2404 1 16 VAL HA 1 16 VAL MG1 . . 2.280 2.482 2.447 2.498 0.218 20 0 "[ . 1 . 2]" 1 2405 1 145 ASN HA 1 145 ASN QB . . 2.610 2.353 2.296 2.397 . 0 0 "[ . 1 . 2]" 1 2406 1 246 MET HA 1 246 MET HG2 . . 2.560 2.451 2.364 2.592 0.032 15 0 "[ . 1 . 2]" 1 2407 1 63 ALA H 1 63 ALA MB . . 2.460 2.301 2.271 2.312 . 0 0 "[ . 1 . 2]" 1 2408 1 63 ALA MB 1 73 GLY H . . 2.910 2.907 2.736 3.010 0.100 4 0 "[ . 1 . 2]" 1 2409 1 141 TYR HA 1 141 TYR QD . . 3.260 2.421 1.950 3.001 . 0 0 "[ . 1 . 2]" 1 2410 1 195 LEU MD2 1 195 LEU HG . . 2.260 2.129 2.120 2.136 . 0 0 "[ . 1 . 2]" 1 2411 1 88 ALA HA 1 88 ALA MB . . 2.540 2.122 2.117 2.128 . 0 0 "[ . 1 . 2]" 1 2412 1 83 PHE HB2 1 88 ALA MB . . 3.240 2.122 2.034 2.261 . 0 0 "[ . 1 . 2]" 1 2413 1 82 PHE QB 1 88 ALA MB . . 3.010 1.753 1.734 1.772 . 0 0 "[ . 1 . 2]" 1 2414 1 82 PHE QD 1 88 ALA MB . . 2.540 2.237 1.957 2.490 . 0 0 "[ . 1 . 2]" 1 2415 1 72 MET HA 1 88 ALA MB . . 3.050 3.123 2.940 3.292 0.242 12 0 "[ . 1 . 2]" 1 2416 1 221 GLN HA 1 221 GLN QG . . 2.960 3.304 3.295 3.310 0.350 7 0 "[ . 1 . 2]" 1 2417 1 221 GLN HA 1 222 ARG H . . 2.870 2.197 2.121 2.260 . 0 0 "[ . 1 . 2]" 1 2418 1 212 PRO HG3 1 226 THR MG . . 2.810 1.933 1.847 2.121 . 0 0 "[ . 1 . 2]" 1 2419 1 201 ILE HB 1 201 ILE MG . . 2.310 2.120 2.113 2.128 . 0 0 "[ . 1 . 2]" 1 2420 1 192 TRP HE1 1 237 ILE MD . . 3.350 2.652 2.378 3.363 0.013 7 0 "[ . 1 . 2]" 1 2421 1 125 ILE HA 1 125 ILE MG . . 2.880 2.913 2.846 2.967 0.087 6 0 "[ . 1 . 2]" 1 2422 1 125 ILE HB 1 125 ILE MG . . 2.550 2.116 2.113 2.119 . 0 0 "[ . 1 . 2]" 1 2423 1 153 VAL HA 1 153 VAL QG . . 2.670 2.438 2.140 2.489 . 0 0 "[ . 1 . 2]" 1 2424 1 31 LEU HA 1 31 LEU QD . . 2.960 2.859 2.034 2.948 . 0 0 "[ . 1 . 2]" 1 2425 1 244 ASN HA 1 244 ASN HB2 . . 2.760 2.805 2.418 3.030 0.270 9 0 "[ . 1 . 2]" 1 2426 1 116 ILE HA 1 116 ILE HG13 . . 2.980 2.766 2.704 2.819 . 0 0 "[ . 1 . 2]" 1 2427 1 116 ILE HA 1 116 ILE MG . . 2.450 2.457 2.429 2.488 0.038 18 0 "[ . 1 . 2]" 1 2428 1 105 LEU MD1 1 105 LEU MD2 . . 2.420 2.071 2.064 2.078 . 0 0 "[ . 1 . 2]" 1 2429 1 105 LEU QD 1 142 TYR QE . . 2.980 2.771 2.345 2.970 . 0 0 "[ . 1 . 2]" 1 2430 1 112 GLU HG2 1 116 ILE MD . . 2.930 2.293 2.075 2.510 . 0 0 "[ . 1 . 2]" 1 2431 1 112 GLU HA 1 112 GLU HG2 . . 3.060 3.192 3.091 3.295 0.235 9 0 "[ . 1 . 2]" 1 2432 1 116 ILE MG 1 117 ALA H . . 3.000 3.082 3.019 3.136 0.136 5 0 "[ . 1 . 2]" 1 2433 1 26 PRO HD3 1 66 VAL QG . . 3.450 2.668 2.494 2.985 . 0 0 "[ . 1 . 2]" 1 2434 1 238 ALA MB 1 239 LEU HG . . 2.670 2.692 2.566 2.877 0.207 3 0 "[ . 1 . 2]" 1 2435 1 219 GLN HB2 1 221 GLN HG2 . . 2.380 2.290 2.108 2.556 0.176 13 0 "[ . 1 . 2]" 1 2436 1 221 GLN HG3 1 223 VAL MG1 . . 2.810 2.686 2.232 3.070 0.260 10 0 "[ . 1 . 2]" 1 2437 1 221 GLN H 1 221 GLN HG2 . . 2.800 2.280 2.077 2.375 . 0 0 "[ . 1 . 2]" 1 2438 1 2 VAL H 1 2 VAL HB . . 3.040 2.736 2.638 2.976 . 0 0 "[ . 1 . 2]" 1 2439 1 206 ASN HA 1 206 ASN HB3 . . 2.920 2.580 2.467 3.013 0.093 16 0 "[ . 1 . 2]" 1 2440 1 55 TYR HB2 1 55 TYR QD . . 3.420 2.296 2.261 2.352 . 0 0 "[ . 1 . 2]" 1 2441 1 183 LEU QD 1 220 ASN QB . . 3.290 2.073 1.777 2.427 . 0 0 "[ . 1 . 2]" 1 2442 1 89 THR HB 1 89 THR MG . . 2.220 2.136 2.135 2.138 . 0 0 "[ . 1 . 2]" 1 2443 1 188 LEU HA 1 188 LEU HG . . 2.980 3.022 2.901 3.635 0.655 16 1 "[ . 1 .+ 2]" 1 2444 1 2 VAL HA 1 2 VAL MG1 . . 2.200 2.291 2.260 2.320 0.120 11 0 "[ . 1 . 2]" 1 2445 1 2 VAL HB 1 2 VAL MG1 . . 2.030 2.124 2.120 2.126 0.096 11 0 "[ . 1 . 2]" 1 2446 1 2 VAL HB 1 50 ILE HA . . 4.100 2.283 2.083 2.655 . 0 0 "[ . 1 . 2]" 1 2447 1 2 VAL HB 1 17 PHE QE . . 4.210 3.124 2.892 3.423 . 0 0 "[ . 1 . 2]" 1 2448 1 2 VAL HB 1 24 ALA MB . . 3.920 4.159 4.108 4.215 0.295 5 0 "[ . 1 . 2]" 1 2449 1 3 SER HA 1 51 HIS HD2 . . 4.130 3.808 3.547 3.976 . 0 0 "[ . 1 . 2]" 1 2450 1 3 SER HA 1 51 HIS HB3 . . 4.210 3.845 3.742 3.995 . 0 0 "[ . 1 . 2]" 1 2451 1 3 SER QB 1 51 HIS HD2 . . 3.880 2.576 2.285 2.832 . 0 0 "[ . 1 . 2]" 1 2452 1 3 SER QB 1 51 HIS HB2 . . 3.550 2.125 1.962 2.208 . 0 0 "[ . 1 . 2]" 1 2453 1 3 SER QB 1 51 HIS HB3 . . 3.890 3.408 3.276 3.512 . 0 0 "[ . 1 . 2]" 1 2454 1 2 VAL HA 1 3 SER QB . . 4.330 4.134 4.085 4.173 . 0 0 "[ . 1 . 2]" 1 2455 1 4 PHE H 1 4 PHE QB . . 3.530 2.794 2.780 2.811 . 0 0 "[ . 1 . 2]" 1 2456 1 5 ARG HA 1 5 ARG QG . . 2.970 3.064 2.950 3.309 0.339 8 0 "[ . 1 . 2]" 1 2457 1 5 ARG HA 1 5 ARG HD2 . . 4.400 3.362 3.211 3.828 . 0 0 "[ . 1 . 2]" 1 2458 1 5 ARG HA 1 53 THR HB . . 3.920 2.043 1.917 2.156 . 0 0 "[ . 1 . 2]" 1 2459 1 5 ARG HA 1 6 LEU H . . 3.410 2.190 2.164 2.213 . 0 0 "[ . 1 . 2]" 1 2460 1 5 ARG HA 1 7 SER H . . 3.730 3.655 3.537 3.736 0.006 9 0 "[ . 1 . 2]" 1 2461 1 5 ARG HB2 1 5 ARG HD2 . . 3.990 3.526 2.828 3.705 . 0 0 "[ . 1 . 2]" 1 2462 1 5 ARG H 1 5 ARG HB3 . . 4.150 3.569 3.227 3.635 . 0 0 "[ . 1 . 2]" 1 2463 1 5 ARG HB3 1 5 ARG HD2 . . 3.860 2.621 2.369 3.709 . 0 0 "[ . 1 . 2]" 1 2464 1 5 ARG HB3 1 6 LEU H . . 4.400 3.418 3.294 3.865 . 0 0 "[ . 1 . 2]" 1 2465 1 6 LEU HA 1 9 ALA HA . . 4.420 4.395 4.173 4.530 0.110 19 0 "[ . 1 . 2]" 1 2466 1 4 PHE QD 1 6 LEU HA . . 3.680 3.949 3.782 4.038 0.358 7 0 "[ . 1 . 2]" 1 2467 1 6 LEU QD 1 55 TYR H . . 3.570 3.538 2.934 3.768 0.198 8 0 "[ . 1 . 2]" 1 2468 1 6 LEU HA 1 6 LEU HG . . 3.640 3.608 2.259 3.695 0.055 1 0 "[ . 1 . 2]" 1 2469 1 6 LEU H 1 6 LEU HG . . 3.720 3.990 3.334 4.054 0.334 20 0 "[ . 1 . 2]" 1 2470 1 7 SER HA 1 7 SER HB2 . . 3.100 2.473 2.445 2.504 . 0 0 "[ . 1 . 2]" 1 2471 1 7 SER HA 1 7 SER HB3 . . 2.880 3.028 3.024 3.030 0.150 10 0 "[ . 1 . 2]" 1 2472 1 7 SER H 1 7 SER HB3 . . 2.870 2.570 2.521 2.625 . 0 0 "[ . 1 . 2]" 1 2473 1 8 GLY HA3 1 9 ALA H . . 3.300 3.401 3.347 3.449 0.149 7 0 "[ . 1 . 2]" 1 2474 1 8 GLY HA2 1 9 ALA H . . 3.350 3.156 3.087 3.231 . 0 0 "[ . 1 . 2]" 1 2475 1 9 ALA H 1 9 ALA HA . . 3.110 2.763 2.754 2.770 . 0 0 "[ . 1 . 2]" 1 2476 1 9 ALA HA 1 10 THR HA . . 4.020 4.376 4.349 4.398 0.378 20 0 "[ . 1 . 2]" 1 2477 1 16 VAL H 1 16 VAL HB . . 3.060 2.436 2.411 2.485 . 0 0 "[ . 1 . 2]" 1 2478 1 16 VAL HB 1 16 VAL MG1 . . 2.090 2.132 2.130 2.134 0.044 20 0 "[ . 1 . 2]" 1 2479 1 18 ILE HA 1 21 LEU HB2 . . 3.710 2.684 2.627 2.764 . 0 0 "[ . 1 . 2]" 1 2480 1 18 ILE HA 1 18 ILE HG13 . . 3.890 3.652 3.634 3.666 . 0 0 "[ . 1 . 2]" 1 2481 1 18 ILE HA 1 21 LEU H . . 4.000 3.062 3.005 3.101 . 0 0 "[ . 1 . 2]" 1 2482 1 18 ILE HA 1 21 LEU HG . . 3.920 4.324 4.262 4.367 0.447 11 0 "[ . 1 . 2]" 1 2483 1 18 ILE MD 1 158 THR HB . . 3.570 3.773 3.700 3.839 0.269 6 0 "[ . 1 . 2]" 1 2484 1 18 ILE MD 1 161 ALA H . . 4.360 4.042 3.936 4.129 . 0 0 "[ . 1 . 2]" 1 2485 1 15 GLY H 1 18 ILE HG12 . . 4.770 4.951 4.907 4.999 0.229 18 0 "[ . 1 . 2]" 1 2486 1 21 LEU H 1 21 LEU HB2 . . 3.580 2.451 2.417 2.484 . 0 0 "[ . 1 . 2]" 1 2487 1 21 LEU QD 1 159 SER H . . 4.030 3.475 3.410 3.643 . 0 0 "[ . 1 . 2]" 1 2488 1 22 ARG HA 1 22 ARG QD . . 4.350 4.084 4.038 4.557 0.207 1 0 "[ . 1 . 2]" 1 2489 1 22 ARG HA 1 25 LEU QD . . 3.980 2.709 2.076 2.960 . 0 0 "[ . 1 . 2]" 1 2490 1 23 LYS H 1 23 LYS QD . . 3.680 3.870 3.720 3.909 0.229 19 0 "[ . 1 . 2]" 1 2491 1 23 LYS QE 1 23 LYS HG2 . . 2.940 2.652 2.299 3.040 0.100 4 0 "[ . 1 . 2]" 1 2492 1 23 LYS HA 1 23 LYS HG2 . . 2.930 2.461 2.402 2.523 . 0 0 "[ . 1 . 2]" 1 2493 1 20 ASN HA 1 23 LYS HG2 . . 3.970 4.044 3.839 4.231 0.261 1 0 "[ . 1 . 2]" 1 2494 1 20 ASN HA 1 23 LYS HG3 . . 3.940 2.732 2.483 3.131 . 0 0 "[ . 1 . 2]" 1 2495 1 23 LYS QB 1 24 ALA HA . . 4.110 3.954 3.894 4.007 . 0 0 "[ . 1 . 2]" 1 2496 1 25 LEU HA 1 26 PRO HD2 . . 3.540 2.285 1.915 2.581 . 0 0 "[ . 1 . 2]" 1 2497 1 25 LEU QD 1 66 VAL H . . 3.700 3.873 3.819 4.026 0.326 6 0 "[ . 1 . 2]" 1 2498 1 25 LEU HA 1 26 PRO HD3 . . 4.040 2.157 1.853 2.638 . 0 0 "[ . 1 . 2]" 1 2499 1 26 PRO HD2 1 66 VAL QG . . 2.800 2.224 2.037 2.579 . 0 0 "[ . 1 . 2]" 1 2500 1 27 TYR HA 1 27 TYR QD . . 4.160 3.746 3.713 3.766 . 0 0 "[ . 1 . 2]" 1 2501 1 27 TYR HB2 1 28 GLU H . . 3.870 2.936 2.802 3.061 . 0 0 "[ . 1 . 2]" 1 2502 1 28 GLU HA 1 29 ARG HA . . 4.220 4.534 4.494 4.581 0.361 20 0 "[ . 1 . 2]" 1 2503 1 28 GLU H 1 28 GLU HB2 . . 3.680 3.603 3.584 3.628 . 0 0 "[ . 1 . 2]" 1 2504 1 28 GLU H 1 28 GLU HB3 . . 3.820 2.671 2.478 2.791 . 0 0 "[ . 1 . 2]" 1 2505 1 28 GLU HG3 1 29 ARG HA . . 4.490 4.593 4.172 4.796 0.306 16 0 "[ . 1 . 2]" 1 2506 1 30 LYS HB2 1 33 ASP HA . . 4.720 2.201 2.041 2.337 . 0 0 "[ . 1 . 2]" 1 2507 1 30 LYS QD 1 33 ASP HA . . 3.830 1.882 1.754 2.074 . 0 0 "[ . 1 . 2]" 1 2508 1 30 LYS HA 1 30 LYS QD . . 3.940 3.700 3.660 3.744 . 0 0 "[ . 1 . 2]" 1 2509 1 30 LYS HE2 1 33 ASP HA . . 4.480 4.060 3.624 4.887 0.407 9 0 "[ . 1 . 2]" 1 2510 1 30 LYS HA 1 30 LYS HG2 . . 4.470 4.147 4.122 4.169 . 0 0 "[ . 1 . 2]" 1 2511 1 27 TYR QD 1 30 LYS HG2 . . 4.550 4.520 4.154 4.717 0.167 5 0 "[ . 1 . 2]" 1 2512 1 27 TYR QD 1 30 LYS HG3 . . 4.370 3.584 3.256 3.829 . 0 0 "[ . 1 . 2]" 1 2513 1 30 LYS H 1 30 LYS HG3 . . 3.610 2.698 2.636 2.765 . 0 0 "[ . 1 . 2]" 1 2514 1 30 LYS HB2 1 36 LEU H . . 4.120 4.221 4.105 4.536 0.416 12 0 "[ . 1 . 2]" 1 2515 1 31 LEU HA 1 32 TYR HA . . 3.910 4.259 4.241 4.307 0.397 17 0 "[ . 1 . 2]" 1 2516 1 31 LEU QB 1 32 TYR QD . . 4.250 2.402 2.123 4.114 . 0 0 "[ . 1 . 2]" 1 2517 1 31 LEU HG 1 32 TYR H . . 3.950 4.285 4.021 5.577 1.627 17 1 "[ . 1 . + 2]" 1 2518 1 32 TYR HB2 1 199 ILE MG . . 4.300 3.157 2.788 4.435 0.135 20 0 "[ . 1 . 2]" 1 2519 1 32 TYR HB3 1 199 ILE MG . . 4.010 4.242 3.455 4.493 0.483 7 0 "[ . 1 . 2]" 1 2520 1 34 ILE HB 1 34 ILE MD . . 3.330 3.141 2.310 3.236 . 0 0 "[ . 1 . 2]" 1 2521 1 34 ILE H 1 34 ILE HB . . 3.430 2.665 2.434 2.780 . 0 0 "[ . 1 . 2]" 1 2522 1 27 TYR QD 1 35 PRO HB2 . . 4.540 4.347 4.075 4.614 0.074 13 0 "[ . 1 . 2]" 1 2523 1 27 TYR HB2 1 35 PRO HB3 . . 4.020 3.394 3.149 3.696 . 0 0 "[ . 1 . 2]" 1 2524 1 34 ILE HA 1 35 PRO HD3 . . 3.450 1.982 1.892 2.029 . 0 0 "[ . 1 . 2]" 1 2525 1 34 ILE MG 1 35 PRO HD3 . . 4.000 3.381 3.117 3.521 . 0 0 "[ . 1 . 2]" 1 2526 1 34 ILE MD 1 35 PRO HD3 . . 4.730 3.706 3.466 4.790 0.060 18 0 "[ . 1 . 2]" 1 2527 1 38 ARG HA 1 38 ARG HD2 . . 4.030 3.331 1.970 4.631 0.601 11 4 "[ * . 1+ -* 2]" 1 2528 1 28 GLU H 1 38 ARG QD . . 4.480 3.642 2.691 4.578 0.098 16 0 "[ . 1 . 2]" 1 2529 1 39 SER HB3 1 242 ASN HB3 . . 3.780 3.091 2.217 3.969 0.189 6 0 "[ . 1 . 2]" 1 2530 1 39 SER H 1 39 SER HB3 . . 3.470 2.690 2.466 2.914 . 0 0 "[ . 1 . 2]" 1 2531 1 39 SER HB2 1 242 ASN HB3 . . 3.790 2.938 1.799 3.909 0.119 20 0 "[ . 1 . 2]" 1 2532 1 40 THR HA 1 40 THR MG . . 2.600 2.310 2.229 2.369 . 0 0 "[ . 1 . 2]" 1 2533 1 40 THR HB 1 41 LEU H . . 3.320 3.541 3.363 3.951 0.631 6 1 "[ .+ 1 . 2]" 1 2534 1 40 THR H 1 40 THR MG . . 3.450 2.431 2.288 2.636 . 0 0 "[ . 1 . 2]" 1 2535 1 39 SER H 1 40 THR MG . . 4.110 4.330 4.211 4.419 0.309 17 0 "[ . 1 . 2]" 1 2536 1 41 LEU QB 1 42 PRO QD . . 4.250 2.522 2.278 2.711 . 0 0 "[ . 1 . 2]" 1 2537 1 42 PRO HB2 1 42 PRO QD . . 3.760 2.942 2.902 2.997 . 0 0 "[ . 1 . 2]" 1 2538 1 42 PRO HB3 1 42 PRO QD . . 3.800 3.522 3.516 3.526 . 0 0 "[ . 1 . 2]" 1 2539 1 43 GLY QA 1 46 ARG QB . . 4.350 2.315 2.139 2.515 . 0 0 "[ . 1 . 2]" 1 2540 1 44 SER HA 1 94 TYR QB . . 3.940 2.069 1.881 2.742 . 0 0 "[ . 1 . 2]" 1 2541 1 46 ARG HA 1 67 THR MG . . 3.100 2.699 2.485 2.905 . 0 0 "[ . 1 . 2]" 1 2542 1 47 TYR HA 1 48 ALA MB . . 3.500 3.796 3.751 3.862 0.362 5 0 "[ . 1 . 2]" 1 2543 1 47 TYR HA 1 48 ALA H . . 3.220 2.166 2.117 2.234 . 0 0 "[ . 1 . 2]" 1 2544 1 47 TYR H 1 47 TYR HB3 . . 4.010 3.886 3.206 3.933 . 0 0 "[ . 1 . 2]" 1 2545 1 49 LEU HA 1 49 LEU QD . . 3.390 2.005 1.959 2.033 . 0 0 "[ . 1 . 2]" 1 2546 1 49 LEU HA 1 50 ILE H . . 3.160 2.138 2.106 2.155 . 0 0 "[ . 1 . 2]" 1 2547 1 49 LEU HB3 1 50 ILE H . . 4.370 3.344 3.240 3.466 . 0 0 "[ . 1 . 2]" 1 2548 1 50 ILE HB 1 50 ILE HG13 . . 2.910 2.506 2.490 2.530 . 0 0 "[ . 1 . 2]" 1 2549 1 50 ILE HB 1 62 VAL HB . . 3.590 1.890 1.810 1.936 . 0 0 "[ . 1 . 2]" 1 2550 1 50 ILE HG12 1 62 VAL HB . . 3.840 4.311 4.092 4.479 0.639 2 8 "[*+ -. *1* * * *]" 1 2551 1 50 ILE H 1 50 ILE HG13 . . 3.760 2.286 2.158 2.322 . 0 0 "[ . 1 . 2]" 1 2552 1 50 ILE HA 1 50 ILE HG13 . . 4.310 2.949 2.912 2.993 . 0 0 "[ . 1 . 2]" 1 2553 1 49 LEU HA 1 50 ILE HG13 . . 4.190 3.881 3.683 3.939 . 0 0 "[ . 1 . 2]" 1 2554 1 50 ILE HG13 1 62 VAL HB . . 3.470 3.213 2.882 3.436 . 0 0 "[ . 1 . 2]" 1 2555 1 3 SER HA 1 50 ILE MG . . 3.630 3.302 3.095 3.493 . 0 0 "[ . 1 . 2]" 1 2556 1 50 ILE MG 1 62 VAL H . . 3.430 3.652 3.608 3.711 0.281 6 0 "[ . 1 . 2]" 1 2557 1 50 ILE HB 1 62 VAL H . . 4.230 2.574 2.460 2.683 . 0 0 "[ . 1 . 2]" 1 2558 1 51 HIS HA 1 52 LEU H . . 3.340 2.213 2.186 2.240 . 0 0 "[ . 1 . 2]" 1 2559 1 51 HIS HA 1 59 THR MG . . 4.030 3.177 2.988 3.309 . 0 0 "[ . 1 . 2]" 1 2560 1 3 SER HA 1 51 HIS HB2 . . 4.100 2.303 2.204 2.447 . 0 0 "[ . 1 . 2]" 1 2561 1 51 HIS HB3 1 59 THR MG . . 4.440 2.592 2.390 2.787 . 0 0 "[ . 1 . 2]" 1 2562 1 4 PHE QD 1 52 LEU HA . . 4.340 3.988 3.922 4.054 . 0 0 "[ . 1 . 2]" 1 2563 1 52 LEU HB3 1 52 LEU HG . . 2.960 2.493 2.453 3.006 0.046 11 0 "[ . 1 . 2]" 1 2564 1 53 THR HA 1 53 THR MG . . 2.980 2.371 2.326 2.408 . 0 0 "[ . 1 . 2]" 1 2565 1 53 THR HA 1 54 ASN H . . 3.240 2.238 2.217 2.264 . 0 0 "[ . 1 . 2]" 1 2566 1 6 LEU QD 1 54 ASN HB2 . . 4.150 3.835 3.080 3.982 . 0 0 "[ . 1 . 2]" 1 2567 1 56 ALA HA 1 57 ASP HB2 . . 4.080 4.314 4.259 4.384 0.304 20 0 "[ . 1 . 2]" 1 2568 1 59 THR HB 1 59 THR MG . . 2.550 2.131 2.129 2.133 . 0 0 "[ . 1 . 2]" 1 2569 1 59 THR HA 1 59 THR MG . . 2.760 2.286 2.257 2.338 . 0 0 "[ . 1 . 2]" 1 2570 1 59 THR MG 1 60 ILE H . . 2.920 2.145 2.006 2.275 . 0 0 "[ . 1 . 2]" 1 2571 1 60 ILE MD 1 140 PHE HA . . 3.740 3.793 3.499 3.896 0.156 19 0 "[ . 1 . 2]" 1 2572 1 60 ILE MD 1 136 ILE H . . 4.030 4.047 3.897 4.197 0.167 18 0 "[ . 1 . 2]" 1 2573 1 51 HIS HA 1 61 SER HA . . 3.780 2.438 2.273 2.572 . 0 0 "[ . 1 . 2]" 1 2574 1 61 SER HA 1 62 VAL H . . 3.590 2.196 2.174 2.226 . 0 0 "[ . 1 . 2]" 1 2575 1 64 ILE HA 1 72 MET QG . . 4.380 3.366 2.670 3.654 . 0 0 "[ . 1 . 2]" 1 2576 1 64 ILE HA 1 65 ASP H . . 3.480 2.151 2.125 2.171 . 0 0 "[ . 1 . 2]" 1 2577 1 64 ILE HB 1 65 ASP H . . 3.960 4.051 3.994 4.165 0.205 5 0 "[ . 1 . 2]" 1 2578 1 64 ILE H 1 64 ILE HB . . 3.810 2.687 2.644 2.749 . 0 0 "[ . 1 . 2]" 1 2579 1 64 ILE HA 1 64 ILE MD . . 3.190 2.227 2.117 3.541 0.351 5 0 "[ . 1 . 2]" 1 2580 1 50 ILE H 1 64 ILE MD . . 3.440 3.929 3.819 4.803 1.363 5 2 "[ + - 1 . 2]" 1 2581 1 64 ILE H 1 64 ILE MD . . 3.240 3.336 3.233 4.533 1.293 5 1 "[ + 1 . 2]" 1 2582 1 64 ILE H 1 64 ILE QG . . 3.570 2.299 2.208 3.148 . 0 0 "[ . 1 . 2]" 1 2583 1 64 ILE MG 1 69 VAL HA . . 2.780 2.412 2.257 2.512 . 0 0 "[ . 1 . 2]" 1 2584 1 64 ILE MG 1 71 VAL HA . . 2.890 3.156 3.098 3.202 0.312 10 0 "[ . 1 . 2]" 1 2585 1 64 ILE HA 1 64 ILE MG . . 2.730 2.259 2.233 2.422 . 0 0 "[ . 1 . 2]" 1 2586 1 47 TYR HA 1 64 ILE MG . . 4.460 4.579 4.307 4.690 0.230 4 0 "[ . 1 . 2]" 1 2587 1 65 ASP HA 1 66 VAL QG . . 3.670 3.267 3.237 3.295 . 0 0 "[ . 1 . 2]" 1 2588 1 68 ASN H 1 69 VAL HA . . 3.870 3.963 3.867 4.036 0.166 9 0 "[ . 1 . 2]" 1 2589 1 69 VAL HB 1 69 VAL MG2 . . 2.560 2.123 2.109 2.133 . 0 0 "[ . 1 . 2]" 1 2590 1 70 TYR HA 1 71 VAL QG . . 3.640 3.706 3.620 3.761 0.121 9 0 "[ . 1 . 2]" 1 2591 1 70 TYR HA 1 70 TYR QD . . 3.920 2.630 1.785 2.952 . 0 0 "[ . 1 . 2]" 1 2592 1 64 ILE HA 1 71 VAL HA . . 4.030 2.351 2.179 2.428 . 0 0 "[ . 1 . 2]" 1 2593 1 71 VAL QG 1 72 MET HA . . 3.130 3.482 3.445 3.577 0.447 5 0 "[ . 1 . 2]" 1 2594 1 71 VAL QG 1 73 GLY HA2 . . 4.180 3.176 3.002 3.380 . 0 0 "[ . 1 . 2]" 1 2595 1 73 GLY HA2 1 82 PHE HA . . 4.150 2.963 2.788 3.126 . 0 0 "[ . 1 . 2]" 1 2596 1 73 GLY HA2 1 74 TYR H . . 3.330 2.912 2.843 3.023 . 0 0 "[ . 1 . 2]" 1 2597 1 73 GLY HA3 1 82 PHE HA . . 4.160 2.119 1.979 2.232 . 0 0 "[ . 1 . 2]" 1 2598 1 73 GLY HA3 1 74 TYR H . . 3.350 2.216 2.182 2.255 . 0 0 "[ . 1 . 2]" 1 2599 1 62 VAL HA 1 74 TYR HA . . 4.540 2.145 2.101 2.234 . 0 0 "[ . 1 . 2]" 1 2600 1 75 ARG HA 1 76 ALA H . . 3.460 2.280 2.263 2.306 . 0 0 "[ . 1 . 2]" 1 2601 1 61 SER HB3 1 75 ARG QB . . 4.870 3.617 3.532 3.668 . 0 0 "[ . 1 . 2]" 1 2602 1 75 ARG QB 1 99 ALA MB . . 4.450 3.729 3.520 4.084 . 0 0 "[ . 1 . 2]" 1 2603 1 75 ARG HG3 1 78 ASP HA . . 3.950 4.422 4.265 4.640 0.690 3 4 "[ + .- 1 .* *2]" 1 2604 1 75 ARG HG3 1 76 ALA H . . 3.770 2.404 2.366 2.442 . 0 0 "[ . 1 . 2]" 1 2605 1 79 THR HA 1 101 ARG HB2 . . 3.560 3.874 1.901 4.166 0.606 10 3 "[ . + .* -2]" 1 2606 1 83 PHE HA 1 88 ALA MB . . 5.310 3.867 3.803 3.988 . 0 0 "[ . 1 . 2]" 1 2607 1 82 PHE HA 1 83 PHE HA . . 4.450 4.309 4.283 4.329 . 0 0 "[ . 1 . 2]" 1 2608 1 84 ASN HB3 1 104 THR MG . . 3.920 4.098 4.033 4.154 0.234 12 0 "[ . 1 . 2]" 1 2609 1 84 ASN HB2 1 104 THR MG . . 2.920 3.019 2.729 3.149 0.229 12 0 "[ . 1 . 2]" 1 2610 1 84 ASN H 1 84 ASN HB2 . . 3.690 2.517 2.408 2.601 . 0 0 "[ . 1 . 2]" 1 2611 1 84 ASN HA 1 85 GLU H . . 4.010 3.257 2.397 3.439 . 0 0 "[ . 1 . 2]" 1 2612 1 89 THR HB 1 90 GLU H . . 2.930 3.216 3.097 3.292 0.362 10 0 "[ . 1 . 2]" 1 2613 1 90 GLU HA 1 93 LYS HE3 . . 3.710 3.372 2.177 3.727 0.017 18 0 "[ . 1 . 2]" 1 2614 1 90 GLU HA 1 90 GLU HG3 . . 3.630 3.141 2.882 3.779 0.149 6 0 "[ . 1 . 2]" 1 2615 1 91 ALA HA 1 91 ALA MB . . 2.580 2.127 2.123 2.130 . 0 0 "[ . 1 . 2]" 1 2616 1 92 ALA HA 1 102 LYS HG2 . . 4.160 3.916 3.733 4.110 . 0 0 "[ . 1 . 2]" 1 2617 1 82 PHE QB 1 92 ALA MB . . 3.820 3.163 3.059 3.261 . 0 0 "[ . 1 . 2]" 1 2618 1 90 GLU HA 1 93 LYS HE2 . . 3.430 2.942 2.197 3.496 0.066 16 0 "[ . 1 . 2]" 1 2619 1 96 PHE HA 1 96 PHE QD . . 3.650 2.221 2.149 2.307 . 0 0 "[ . 1 . 2]" 1 2620 1 75 ARG HD2 1 96 PHE HB3 . . 3.680 2.218 2.102 2.267 . 0 0 "[ . 1 . 2]" 1 2621 1 97 LYS HB3 1 97 LYS QE . . 4.180 1.944 1.886 1.999 . 0 0 "[ . 1 . 2]" 1 2622 1 97 LYS HB2 1 97 LYS QE . . 3.980 3.450 3.333 3.533 . 0 0 "[ . 1 . 2]" 1 2623 1 97 LYS HA 1 97 LYS HD3 . . 3.660 3.739 3.643 3.798 0.138 3 0 "[ . 1 . 2]" 1 2624 1 97 LYS HA 1 97 LYS HD2 . . 3.700 2.159 2.039 2.227 . 0 0 "[ . 1 . 2]" 1 2625 1 99 ALA HA 1 100 LYS H . . 2.810 2.101 2.076 2.133 . 0 0 "[ . 1 . 2]" 1 2626 1 99 ALA H 1 99 ALA HA . . 2.930 2.819 2.805 2.824 . 0 0 "[ . 1 . 2]" 1 2627 1 100 LYS HA 1 100 LYS HB2 . . 3.010 3.011 3.006 3.016 0.006 3 0 "[ . 1 . 2]" 1 2628 1 78 ASP HA 1 100 LYS HG2 . . 3.700 3.752 3.509 3.875 0.175 14 0 "[ . 1 . 2]" 1 2629 1 102 LYS HE2 1 102 LYS HG2 . . 2.880 2.445 2.360 2.543 . 0 0 "[ . 1 . 2]" 1 2630 1 82 PHE QD 1 102 LYS HG2 . . 3.700 3.870 3.760 3.964 0.264 3 0 "[ . 1 . 2]" 1 2631 1 102 LYS HA 1 102 LYS HG2 . . 3.770 3.653 3.623 3.672 . 0 0 "[ . 1 . 2]" 1 2632 1 102 LYS HE2 1 102 LYS HG3 . . 3.550 3.079 2.955 3.131 . 0 0 "[ . 1 . 2]" 1 2633 1 102 LYS HA 1 102 LYS HG3 . . 3.830 2.422 2.381 2.453 . 0 0 "[ . 1 . 2]" 1 2634 1 82 PHE QD 1 102 LYS HG3 . . 3.640 3.069 2.910 3.402 . 0 0 "[ . 1 . 2]" 1 2635 1 103 VAL HB 1 103 VAL MG1 . . 2.480 2.120 2.116 2.123 . 0 0 "[ . 1 . 2]" 1 2636 1 103 VAL HB 1 103 VAL MG2 . . 2.460 2.121 2.119 2.123 . 0 0 "[ . 1 . 2]" 1 2637 1 103 VAL MG1 1 142 TYR QD . . 3.910 3.528 3.285 3.968 0.058 13 0 "[ . 1 . 2]" 1 2638 1 103 VAL MG1 1 142 TYR QE . . 3.820 2.464 2.306 2.885 . 0 0 "[ . 1 . 2]" 1 2639 1 104 THR HA 1 104 THR HB . . 2.730 3.009 2.999 3.012 0.282 13 0 "[ . 1 . 2]" 1 2640 1 104 THR H 1 104 THR HB . . 3.100 2.616 2.549 2.710 . 0 0 "[ . 1 . 2]" 1 2641 1 105 LEU QD 1 106 PRO HD3 . . 3.560 2.978 2.447 3.134 . 0 0 "[ . 1 . 2]" 1 2642 1 105 LEU HA 1 106 PRO HD2 . . 3.860 3.185 3.120 3.236 . 0 0 "[ . 1 . 2]" 1 2643 1 105 LEU HA 1 106 PRO HD3 . . 3.990 1.893 1.846 1.935 . 0 0 "[ . 1 . 2]" 1 2644 1 107 TYR HA 1 113 ARG QB . . 3.820 3.313 2.964 3.594 . 0 0 "[ . 1 . 2]" 1 2645 1 83 PHE HB3 1 108 SER HA . . 4.280 2.377 1.900 2.965 . 0 0 "[ . 1 . 2]" 1 2646 1 108 SER HA 1 109 GLY QA . . 4.100 3.811 3.719 3.838 . 0 0 "[ . 1 . 2]" 1 2647 1 110 ASN HA 1 114 LEU HG . . 4.090 4.241 4.177 4.299 0.209 10 0 "[ . 1 . 2]" 1 2648 1 110 ASN HA 1 110 ASN HB3 . . 2.920 2.425 2.398 2.449 . 0 0 "[ . 1 . 2]" 1 2649 1 110 ASN H 1 110 ASN HB3 . . 3.440 2.836 2.796 2.882 . 0 0 "[ . 1 . 2]" 1 2650 1 112 GLU HA 1 112 GLU HG3 . . 2.860 2.532 2.456 2.618 . 0 0 "[ . 1 . 2]" 1 2651 1 112 GLU H 1 112 GLU HB3 . . 3.120 2.367 2.325 2.423 . 0 0 "[ . 1 . 2]" 1 2652 1 112 GLU H 1 112 GLU HG3 . . 3.950 4.376 4.352 4.410 0.460 8 0 "[ . 1 . 2]" 1 2653 1 112 GLU H 1 112 GLU HG2 . . 4.030 4.300 4.268 4.333 0.303 4 0 "[ . 1 . 2]" 1 2654 1 113 ARG H 1 113 ARG QG . . 3.860 2.307 2.210 2.410 . 0 0 "[ . 1 . 2]" 1 2655 1 114 LEU HA 1 114 LEU HG . . 3.000 3.163 3.121 3.198 0.198 13 0 "[ . 1 . 2]" 1 2656 1 114 LEU HB3 1 151 LEU QB . . 4.360 4.206 4.082 4.403 0.043 13 0 "[ . 1 . 2]" 1 2657 1 113 ARG HA 1 116 ILE HB . . 3.810 2.585 2.484 2.770 . 0 0 "[ . 1 . 2]" 1 2658 1 116 ILE H 1 116 ILE HB . . 2.990 2.395 2.343 2.435 . 0 0 "[ . 1 . 2]" 1 2659 1 116 ILE HA 1 116 ILE HG12 . . 2.960 2.585 2.562 2.620 . 0 0 "[ . 1 . 2]" 1 2660 1 116 ILE H 1 116 ILE HG12 . . 3.760 3.597 3.539 3.657 . 0 0 "[ . 1 . 2]" 1 2661 1 119 GLY QA 1 120 LYS H . . 3.180 2.827 2.774 2.872 . 0 0 "[ . 1 . 2]" 1 2662 1 120 LYS HA 1 121 ILE H . . 2.930 2.114 2.089 2.149 . 0 0 "[ . 1 . 2]" 1 2663 1 115 GLN HG2 1 121 ILE HA . . 3.770 2.205 1.805 3.129 . 0 0 "[ . 1 . 2]" 1 2664 1 121 ILE MD 1 123 GLU H . . 3.630 3.169 3.033 3.303 . 0 0 "[ . 1 . 2]" 1 2665 1 123 GLU HA 1 123 GLU HG3 . . 3.630 2.867 2.429 3.422 . 0 0 "[ . 1 . 2]" 1 2666 1 123 GLU HA 1 123 GLU HG2 . . 3.810 2.672 2.145 3.590 . 0 0 "[ . 1 . 2]" 1 2667 1 123 GLU HG2 1 186 ILE MD . . 3.770 3.001 2.262 4.168 0.398 6 0 "[ . 1 . 2]" 1 2668 1 125 ILE MG 1 153 VAL H . . 3.550 3.593 3.421 3.733 0.183 11 0 "[ . 1 . 2]" 1 2669 1 126 PRO HA 1 127 LEU H . . 3.480 2.193 2.159 2.261 . 0 0 "[ . 1 . 2]" 1 2670 1 129 LEU HA 1 132 LEU H . . 4.050 3.367 3.269 3.485 . 0 0 "[ . 1 . 2]" 1 2671 1 14 TYR H 1 129 LEU QD . . 3.920 3.558 3.240 3.926 0.006 7 0 "[ . 1 . 2]" 1 2672 1 55 TYR QE 1 130 PRO HA . . 4.030 2.520 2.267 2.995 . 0 0 "[ . 1 . 2]" 1 2673 1 130 PRO HB2 1 178 THR MG . . 4.000 2.076 1.890 2.286 . 0 0 "[ . 1 . 2]" 1 2674 1 130 PRO HD3 1 178 THR MG . . 4.280 3.834 3.610 4.366 0.086 18 0 "[ . 1 . 2]" 1 2675 1 129 LEU QB 1 130 PRO HD3 . . 3.970 1.920 1.844 2.085 . 0 0 "[ . 1 . 2]" 1 2676 1 130 PRO HD2 1 178 THR MG . . 4.760 2.420 2.174 3.038 . 0 0 "[ . 1 . 2]" 1 2677 1 131 ALA HA 1 134 SER H . . 4.130 3.339 3.080 3.435 . 0 0 "[ . 1 . 2]" 1 2678 1 131 ALA HA 1 178 THR MG . . 3.840 3.275 3.048 3.493 . 0 0 "[ . 1 . 2]" 1 2679 1 132 LEU QD 1 157 SER HA . . 3.560 3.430 3.318 3.497 . 0 0 "[ . 1 . 2]" 1 2680 1 54 ASN HB2 1 133 ASP HA . . 3.660 2.679 2.267 2.989 . 0 0 "[ . 1 . 2]" 1 2681 1 6 LEU QD 1 133 ASP HB3 . . 3.920 3.200 3.084 3.311 . 0 0 "[ . 1 . 2]" 1 2682 1 133 ASP H 1 133 ASP HB2 . . 3.350 2.651 2.605 2.690 . 0 0 "[ . 1 . 2]" 1 2683 1 133 ASP H 1 133 ASP HB3 . . 3.450 2.388 2.336 2.420 . 0 0 "[ . 1 . 2]" 1 2684 1 136 ILE H 1 136 ILE HB . . 3.630 2.353 2.202 2.438 . 0 0 "[ . 1 . 2]" 1 2685 1 136 ILE MG 1 140 PHE QD . . 4.380 4.144 3.957 4.354 . 0 0 "[ . 1 . 2]" 1 2686 1 54 ASN HD22 1 136 ILE MG . . 3.660 3.120 2.801 3.982 0.322 11 0 "[ . 1 . 2]" 1 2687 1 136 ILE HA 1 136 ILE MG . . 2.900 2.522 2.465 2.689 . 0 0 "[ . 1 . 2]" 1 2688 1 54 ASN HB3 1 136 ILE MG . . 3.250 1.994 1.868 2.061 . 0 0 "[ . 1 . 2]" 1 2689 1 136 ILE MG 1 140 PHE QB . . 3.630 2.921 2.709 3.077 . 0 0 "[ . 1 . 2]" 1 2690 1 137 THR HA 1 140 PHE HB3 . . 4.060 3.145 2.949 3.451 . 0 0 "[ . 1 . 2]" 1 2691 1 138 THR H 1 138 THR HB . . 3.230 2.509 2.383 2.604 . 0 0 "[ . 1 . 2]" 1 2692 1 139 LEU HA 1 139 LEU HG . . 3.080 3.094 3.077 3.115 0.035 8 0 "[ . 1 . 2]" 1 2693 1 139 LEU MD2 1 142 TYR QE . . 3.820 4.100 3.887 4.181 0.361 3 0 "[ . 1 . 2]" 1 2694 1 140 PHE HA 1 140 PHE QD . . 3.710 3.043 2.891 3.098 . 0 0 "[ . 1 . 2]" 1 2695 1 142 TYR HA 1 143 ASN H . . 2.870 2.389 2.326 2.426 . 0 0 "[ . 1 . 2]" 1 2696 1 143 ASN HA 1 144 ALA MB . . 3.730 4.030 4.005 4.054 0.324 3 0 "[ . 1 . 2]" 1 2697 1 143 ASN QB 1 147 ALA MB . . 4.080 3.506 3.342 3.663 . 0 0 "[ . 1 . 2]" 1 2698 1 142 TYR QE 1 144 ALA HA . . 4.010 3.161 2.672 3.812 . 0 0 "[ . 1 . 2]" 1 2699 1 143 ASN QB 1 146 SER HB2 . . 3.640 3.586 2.587 3.903 0.263 3 0 "[ . 1 . 2]" 1 2700 1 143 ASN QB 1 146 SER HB3 . . 4.080 3.035 2.351 4.128 0.048 6 0 "[ . 1 . 2]" 1 2701 1 147 ALA HA 1 147 ALA MB . . 2.450 2.124 2.120 2.128 . 0 0 "[ . 1 . 2]" 1 2702 1 107 TYR QD 1 151 LEU MD1 . . 3.530 3.647 3.547 3.708 0.178 12 0 "[ . 1 . 2]" 1 2703 1 151 LEU H 1 151 LEU MD1 . . 3.260 3.383 3.309 3.444 0.184 9 0 "[ . 1 . 2]" 1 2704 1 139 LEU HG 1 151 LEU HG . . 3.970 3.940 3.786 4.231 0.261 19 0 "[ . 1 . 2]" 1 2705 1 151 LEU HA 1 151 LEU HG . . 2.960 2.711 2.621 2.969 0.009 19 0 "[ . 1 . 2]" 1 2706 1 155 ILE HB 1 155 ILE MG . . 2.560 2.128 2.124 2.131 . 0 0 "[ . 1 . 2]" 1 2707 1 18 ILE MD 1 158 THR HA . . 3.740 2.153 2.066 2.274 . 0 0 "[ . 1 . 2]" 1 2708 1 158 THR MG 1 159 SER H . . 3.390 3.643 3.603 3.694 0.304 7 0 "[ . 1 . 2]" 1 2709 1 18 ILE MD 1 162 ALA MB . . 3.580 3.398 3.212 3.582 0.002 11 0 "[ . 1 . 2]" 1 2710 1 163 ARG HA 1 239 LEU HB2 . . 3.600 1.980 1.871 2.160 . 0 0 "[ . 1 . 2]" 1 2711 1 163 ARG HA 1 239 LEU HB3 . . 3.580 3.706 3.608 3.879 0.299 11 0 "[ . 1 . 2]" 1 2712 1 167 ILE MD 1 188 LEU QB . . 3.980 2.053 1.840 3.917 . 0 0 "[ . 1 . 2]" 1 2713 1 169 GLN HA 1 169 GLN HG3 . . 3.520 2.873 2.816 2.981 . 0 0 "[ . 1 . 2]" 1 2714 1 170 GLN HA 1 173 LYS QG . . 3.820 3.490 3.006 4.020 0.200 7 0 "[ . 1 . 2]" 1 2715 1 14 TYR QE 1 171 ILE HB . . 4.450 2.809 2.471 3.070 . 0 0 "[ . 1 . 2]" 1 2716 1 171 ILE HB 1 171 ILE MD . . 2.760 2.284 2.244 2.330 . 0 0 "[ . 1 . 2]" 1 2717 1 128 GLY HA2 1 171 ILE MG . . 3.900 2.327 2.092 2.647 . 0 0 "[ . 1 . 2]" 1 2718 1 171 ILE MG 1 172 GLY HA2 . . 3.710 3.135 3.015 3.202 . 0 0 "[ . 1 . 2]" 1 2719 1 18 ILE MD 1 171 ILE MG . . 4.150 4.500 4.389 4.550 0.400 20 0 "[ . 1 . 2]" 1 2720 1 14 TYR QE 1 172 GLY HA2 . . 4.010 3.829 3.604 4.109 0.099 11 0 "[ . 1 . 2]" 1 2721 1 173 LYS HB2 1 173 LYS QE . . 3.710 3.529 2.007 4.220 0.510 6 4 "[- **.+ 1 . 2]" 1 2722 1 173 LYS HB3 1 173 LYS QE . . 3.930 2.738 1.960 3.977 0.047 4 0 "[ . 1 . 2]" 1 2723 1 174 ARG QB 1 175 VAL H . . 4.250 3.884 3.866 3.900 . 0 0 "[ . 1 . 2]" 1 2724 1 185 ILE HA 1 185 ILE HG12 . . 3.200 2.391 2.355 2.426 . 0 0 "[ . 1 . 2]" 1 2725 1 185 ILE HA 1 185 ILE MG . . 3.280 2.465 2.425 2.503 . 0 0 "[ . 1 . 2]" 1 2726 1 185 ILE HA 1 185 ILE HG13 . . 3.800 3.016 2.969 3.089 . 0 0 "[ . 1 . 2]" 1 2727 1 185 ILE MD 1 185 ILE MG . . 2.190 1.903 1.846 1.962 . 0 0 "[ . 1 . 2]" 1 2728 1 123 GLU H 1 186 ILE MD . . 3.580 3.261 3.000 3.672 0.092 19 0 "[ . 1 . 2]" 1 2729 1 194 ALA HA 1 197 LYS HB3 . . 3.540 2.901 2.698 3.129 . 0 0 "[ . 1 . 2]" 1 2730 1 195 LEU H 1 195 LEU MD1 . . 3.690 3.867 3.410 4.249 0.559 10 1 "[ . + . 2]" 1 2731 1 201 ILE HB 1 201 ILE MD . . 2.450 2.330 2.309 2.362 . 0 0 "[ . 1 . 2]" 1 2732 1 201 ILE HA 1 201 ILE HG13 . . 4.010 2.804 2.746 2.913 . 0 0 "[ . 1 . 2]" 1 2733 1 205 ASN H 1 205 ASN HB2 . . 3.530 2.975 2.901 3.046 . 0 0 "[ . 1 . 2]" 1 2734 1 202 ALA HA 1 205 ASN HB2 . . 3.930 3.001 2.836 3.139 . 0 0 "[ . 1 . 2]" 1 2735 1 201 ILE MG 1 205 ASN HB2 . . 3.900 2.795 2.465 2.991 . 0 0 "[ . 1 . 2]" 1 2736 1 202 ALA HA 1 205 ASN HB3 . . 3.800 1.847 1.810 1.902 . 0 0 "[ . 1 . 2]" 1 2737 1 206 ASN HA 1 206 ASN HB2 . . 2.980 2.964 2.524 3.019 0.039 15 0 "[ . 1 . 2]" 1 2738 1 208 GLN HA 1 208 GLN HG2 . . 3.720 3.534 3.340 3.693 . 0 0 "[ . 1 . 2]" 1 2739 1 208 GLN HA 1 208 GLN HG3 . . 3.810 3.218 2.572 3.872 0.062 14 0 "[ . 1 . 2]" 1 2740 1 210 GLU H 1 210 GLU HB3 . . 3.720 3.245 2.655 3.598 . 0 0 "[ . 1 . 2]" 1 2741 1 210 GLU H 1 210 GLU QG . . 3.300 2.129 1.785 2.271 . 0 0 "[ . 1 . 2]" 1 2742 1 210 GLU QG 1 211 THR H . . 3.700 3.243 1.992 4.003 0.303 16 0 "[ . 1 . 2]" 1 2743 1 216 ILE MD 1 222 ARG H . . 3.330 3.064 2.663 3.373 0.043 2 0 "[ . 1 . 2]" 1 2744 1 216 ILE HA 1 216 ILE QG . . 3.190 2.981 2.840 3.050 . 0 0 "[ . 1 . 2]" 1 2745 1 217 ASN HB2 1 223 VAL MG1 . . 2.930 2.076 1.916 2.928 . 0 0 "[ . 1 . 2]" 1 2746 1 219 GLN HB2 1 219 GLN HE21 . . 3.700 3.827 3.676 4.299 0.599 1 1 "[+ . 1 . 2]" 1 2747 1 218 ALA MB 1 219 GLN QG . . 3.540 3.505 3.070 3.699 0.159 4 0 "[ . 1 . 2]" 1 2748 1 183 LEU QD 1 220 ASN HA . . 2.750 3.092 2.753 3.651 0.901 2 3 "[ + . - 1 * 2]" 1 2749 1 220 ASN H 1 220 ASN QB . . 3.550 3.237 2.879 3.408 . 0 0 "[ . 1 . 2]" 1 2750 1 221 GLN H 1 221 GLN HA . . 3.130 2.921 2.908 2.928 . 0 0 "[ . 1 . 2]" 1 2751 1 221 GLN H 1 221 GLN HB2 . . 3.880 3.819 3.692 3.845 . 0 0 "[ . 1 . 2]" 1 2752 1 225 ILE H 1 225 ILE MD . . 3.570 3.537 3.367 3.637 0.067 13 0 "[ . 1 . 2]" 1 2753 1 209 PHE HZ 1 225 ILE MG . . 2.730 2.620 2.467 2.790 0.060 2 0 "[ . 1 . 2]" 1 2754 1 229 ASP HA 1 229 ASP HB3 . . 2.870 3.023 3.020 3.025 0.155 2 0 "[ . 1 . 2]" 1 2755 1 230 ALA MB 1 233 VAL H . . 3.910 2.868 2.622 3.206 . 0 0 "[ . 1 . 2]" 1 2756 1 66 VAL H 1 67 THR MG . . 3.200 3.538 3.412 3.621 0.421 6 0 "[ . 1 . 2]" 1 2757 1 235 SER HA 1 235 SER HB3 . . 2.990 2.822 2.423 3.031 0.041 20 0 "[ . 1 . 2]" 1 2758 1 235 SER HA 1 235 SER HB2 . . 3.130 2.664 2.450 3.028 . 0 0 "[ . 1 . 2]" 1 2759 1 243 ARG HB2 1 243 ARG QD . . 3.540 2.715 2.324 3.518 . 0 0 "[ . 1 . 2]" 1 2760 1 243 ARG H 1 243 ARG HB3 . . 3.630 3.416 2.553 3.600 . 0 0 "[ . 1 . 2]" 1 2761 1 243 ARG HA 1 243 ARG HB3 . . 2.540 2.476 2.385 2.595 0.055 2 0 "[ . 1 . 2]" 1 2762 1 243 ARG H 1 243 ARG HB2 . . 3.110 2.620 2.268 3.595 0.485 9 0 "[ . 1 . 2]" 1 2763 1 243 ARG HA 1 243 ARG HG2 . . 3.370 2.680 2.352 3.741 0.371 10 0 "[ . 1 . 2]" 1 2764 1 164 TYR HA 1 238 ALA MB . . 3.580 2.858 2.610 3.504 . 0 0 "[ . 1 . 2]" 1 2765 1 6 LEU HA 1 9 ALA MB . . 2.690 2.252 2.094 2.443 . 0 0 "[ . 1 . 2]" 1 2766 1 55 TYR HA 1 57 ASP H . . 3.820 3.682 3.636 3.730 . 0 0 "[ . 1 . 2]" 1 2767 1 139 LEU HG 1 151 LEU H . . 4.040 4.194 4.153 4.262 0.222 9 0 "[ . 1 . 2]" 1 2768 1 181 PRO HG2 1 186 ILE MD . . 2.400 1.991 1.876 2.368 . 0 0 "[ . 1 . 2]" 1 2769 1 102 LYS HA 1 102 LYS HD2 . . 2.890 2.808 2.726 2.882 . 0 0 "[ . 1 . 2]" 1 2770 1 177 LYS HA 1 177 LYS QG . . 3.580 3.419 2.905 3.478 . 0 0 "[ . 1 . 2]" 1 2771 1 186 ILE MG 1 187 SER HA . . 3.150 3.357 3.287 3.443 0.293 9 0 "[ . 1 . 2]" 1 2772 1 246 MET HB2 1 246 MET HG2 . . 2.830 2.991 2.987 3.004 0.174 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 133 _Distance_constraint_stats_list.Viol_count 1334 _Distance_constraint_stats_list.Viol_total 14484.913 _Distance_constraint_stats_list.Viol_max 1.861 _Distance_constraint_stats_list.Viol_rms 0.4016 _Distance_constraint_stats_list.Viol_average_all_restraints 0.2723 _Distance_constraint_stats_list.Viol_average_violations_only 0.5429 _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 VAL 3.950 0.367 6 0 "[ . 1 . 2]" 1 3 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 4 PHE 1.091 1.091 11 1 "[ . 1+ . 2]" 1 6 LEU 21.769 0.998 3 19 "[**+**** -***********]" 1 9 ALA 7.018 0.410 6 0 "[ . 1 . 2]" 1 10 THR 49.193 1.760 20 20 [*****-*************+] 1 11 SER 18.818 1.053 20 20 [*****-*************+] 1 12 SER 41.315 1.760 20 20 [****-**************+] 1 13 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 14 TYR 2.048 0.267 6 0 "[ . 1 . 2]" 1 15 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 16 VAL 10.941 0.708 18 14 "[*** -* *** *****+ 2]" 1 17 PHE 9.183 0.862 5 4 "[ * +- * 1 . 2]" 1 18 ILE 24.071 1.244 1 20 [+******-************] 1 20 ASN 27.880 1.244 1 20 [+******-************] 1 21 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 23 LYS 3.808 0.252 1 0 "[ . 1 . 2]" 1 28 GLU 0.836 0.281 8 0 "[ . 1 . 2]" 1 29 ARG 0.282 0.282 9 0 "[ . 1 . 2]" 1 31 LEU 15.370 0.905 3 20 [**+****************-] 1 34 ILE 15.370 0.905 3 20 [**+****************-] 1 36 LEU 1.118 0.282 9 0 "[ . 1 . 2]" 1 38 ARG 6.449 1.193 13 3 "[ . *1 +-. 2]" 1 40 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 41 LEU 6.449 1.193 13 3 "[ . *1 +-. 2]" 1 42 PRO 1.060 0.242 5 0 "[ . 1 . 2]" 1 45 GLN 1.060 0.242 5 0 "[ . 1 . 2]" 1 46 ARG 17.010 1.162 16 20 [*****-*********+****] 1 48 ALA 5.504 0.465 9 0 "[ . 1 . 2]" 1 49 LEU 9.454 0.465 9 0 "[ . 1 . 2]" 1 50 ILE 9.183 0.862 5 4 "[ * +- * 1 . 2]" 1 52 LEU 24.979 1.261 5 20 [****+*****-*********] 1 59 THR 18.079 0.972 8 20 [*******+******-*****] 1 60 ILE 22.961 0.972 8 20 [*******+******-*****] 1 61 SER 9.264 0.579 14 7 "[* *.* - 1 +. **2]" 1 62 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 63 ALA 29.432 1.749 8 20 [*******+*****-******] 1 64 ILE 6.671 0.441 4 0 "[ . 1 . 2]" 1 67 THR 17.010 1.162 16 20 [*****-*********+****] 1 71 VAL 29.473 1.724 5 20 [****+****-**********] 1 72 MET 7.557 0.451 20 0 "[ . 1 . 2]" 1 73 GLY 6.671 0.441 4 0 "[ . 1 . 2]" 1 74 TYR 14.846 0.417 13 0 "[ . 1 . 2]" 1 75 ARG 7.058 0.383 13 0 "[ . 1 . 2]" 1 77 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 79 THR 11.144 0.694 11 18 "[*- *******+* *******]" 1 80 SER 1.214 0.527 8 1 "[ . + 1 . 2]" 1 81 TYR 22.791 1.749 8 20 [*******+*****-******] 1 82 PHE 31.254 1.681 5 20 [****+*****-*********] 1 83 PHE 19.381 1.152 16 20 [***************+*-**] 1 85 GLU 17.720 1.505 17 16 "[ * **-** *******+**2]" 1 88 ALA 11.799 0.839 5 15 "[****+**-** **.** *]" 1 90 GLU 13.545 0.839 5 15 "[****+**-** **.** *]" 1 91 ALA 25.289 1.681 5 20 [****+*****-*********] 1 92 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 93 LYS 4.772 0.352 6 0 "[ . 1 . 2]" 1 94 TYR 4.772 0.352 6 0 "[ . 1 . 2]" 1 95 VAL 9.123 0.533 6 3 "[ *.+ -1 . 2]" 1 96 PHE 9.123 0.533 6 3 "[ *.+ -1 . 2]" 1 99 ALA 11.144 0.694 11 18 "[*- *******+* *******]" 1 100 LYS 0.554 0.332 11 0 "[ . 1 . 2]" 1 101 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 103 VAL 1.214 0.527 8 1 "[ . + 1 . 2]" 1 105 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 106 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 108 SER 17.720 1.505 17 16 "[ * **-** *******+**2]" 1 109 GLY 2.687 0.279 18 0 "[ . 1 . 2]" 1 110 ASN 0.293 0.074 14 0 "[ . 1 . 2]" 1 112 GLU 0.293 0.074 14 0 "[ . 1 . 2]" 1 113 ARG 11.203 0.509 12 2 "[ .- 1 + . 2]" 1 114 LEU 0.210 0.072 13 0 "[ . 1 . 2]" 1 115 GLN 0.210 0.072 13 0 "[ . 1 . 2]" 1 116 ILE 22.146 0.799 13 20 [*****-******+*******] 1 117 ALA 20.473 1.452 5 20 [**-*+***************] 1 118 ALA 33.822 1.086 1 20 [+*************-*****] 1 120 LYS 9.743 0.666 3 5 "[ + . *- * .* 2]" 1 121 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 124 ASN 3.063 0.666 3 5 "[ + . *- * .* 2]" 1 127 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 129 LEU 8.451 0.804 14 8 "[* *. * *1 +* * -2]" 1 130 PRO 3.674 0.358 16 0 "[ . 1 . 2]" 1 132 LEU 17.128 0.680 18 20 [*****************+*-] 1 134 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 135 ALA 17.128 0.680 18 20 [*****************+*-] 1 136 ILE 14.862 0.998 3 19 "[**+**** -***********]" 1 138 THR 5.947 0.444 15 0 "[ . 1 . 2]" 1 139 LEU 13.033 0.686 9 20 [********+******-****] 1 140 PHE 14.873 0.579 14 7 "[* *.* - 1 +. **2]" 1 141 TYR 13.033 0.686 9 20 [********+******-****] 1 143 ASN 0.329 0.160 1 0 "[ . 1 . 2]" 1 144 ALA 2.561 0.207 18 0 "[ . 1 . 2]" 1 145 ASN 10.533 0.605 13 2 "[ .- 1 + . 2]" 1 147 ALA 15.611 0.605 13 2 "[ .- 1 + . 2]" 1 148 ALA 40.665 1.452 5 20 [**-*+***************] 1 150 ALA 13.257 0.490 3 0 "[ . 1 . 2]" 1 151 LEU 6.414 0.509 19 1 "[ . 1 . +2]" 1 152 MET 19.381 1.152 16 20 [***************+*-**] 1 154 LEU 6.414 0.509 19 1 "[ . 1 . +2]" 1 155 ILE 11.036 0.597 5 19 "[****+-* ************]" 1 156 GLN 11.036 0.597 5 19 "[****+-* ************]" 1 157 SER 21.492 1.579 8 20 [****-**+************] 1 158 THR 28.478 1.724 5 20 [****+****-**********] 1 159 SER 21.492 1.579 8 20 [****-**+************] 1 166 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 169 GLN 1.937 0.267 6 0 "[ . 1 . 2]" 1 170 GLN 4.008 0.385 6 0 "[ . 1 . 2]" 1 171 ILE 1.769 0.644 4 2 "[ +. 1 -. 2]" 1 172 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 173 LYS 4.008 0.385 6 0 "[ . 1 . 2]" 1 174 ARG 6.734 0.853 16 5 "[ . * 1 * .+ * -]" 1 177 LYS 14.054 0.853 16 7 "[ * * 1 * .+** -]" 1 178 THR 8.256 0.403 15 0 "[ . 1 . 2]" 1 179 PHE 10.249 0.804 14 8 "[* *. * *1 +* * -2]" 1 180 LEU 3.848 1.303 9 3 "[ . +* . -2]" 1 182 SER 1.522 0.312 3 0 "[ . 1 . 2]" 1 183 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 184 ALA 3.033 0.449 14 0 "[ . 1 . 2]" 1 185 ILE 1.551 0.312 3 0 "[ . 1 . 2]" 1 186 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 187 SER 3.033 0.449 14 0 "[ . 1 . 2]" 1 188 LEU 0.452 0.110 8 0 "[ . 1 . 2]" 1 192 TRP 35.277 1.861 15 20 [*************-+*****] 1 195 LEU 3.250 0.784 2 1 "[ + . 1 . 2]" 1 197 LYS 5.291 1.415 6 4 "[ .+ **1 . - 2]" 1 198 GLN 23.874 1.699 5 11 "[*- *+* **1* ** *]" 1 199 ILE 20.624 1.699 5 11 "[*- *+* **1* ** *]" 1 201 ILE 5.291 1.415 6 4 "[ .+ **1 . - 2]" 1 202 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 206 ASN 0.285 0.157 2 0 "[ . 1 . 2]" 1 208 GLN 0.285 0.157 2 0 "[ . 1 . 2]" 1 212 PRO 5.010 0.436 5 0 "[ . 1 . 2]" 1 215 LEU 9.481 0.637 11 10 "[ * . ****+- *.* *]" 1 216 ILE 4.298 0.375 1 0 "[ . 1 . 2]" 1 217 ASN 26.018 0.981 12 20 [***********+********] 1 221 GLN 16.936 0.981 12 20 [***********+-*******] 1 222 ARG 4.298 0.375 1 0 "[ . 1 . 2]" 1 223 VAL 0.398 0.082 20 0 "[ . 1 . 2]" 1 224 THR 0.033 0.033 7 0 "[ . 1 . 2]" 1 226 THR 4.977 0.436 5 0 "[ . 1 . 2]" 1 228 VAL 4.058 0.336 10 0 "[ . 1 . 2]" 1 230 ALA 4.058 0.336 10 0 "[ . 1 . 2]" 1 237 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 238 ALA 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 100 LYS QE 1 100 LYS HG3 . . 2.960 2.565 2.366 3.292 0.332 11 0 "[ . 1 . 2]" 2 2 1 4 PHE QD 1 52 LEU HG . . 3.330 2.877 2.621 4.421 1.091 11 1 "[ . 1+ . 2]" 2 3 1 116 ILE HB 1 116 ILE MD . . 2.670 2.326 2.308 2.341 . 0 0 "[ . 1 . 2]" 2 4 1 216 ILE MD 1 222 ARG HA . . 2.290 1.961 1.867 2.058 . 0 0 "[ . 1 . 2]" 2 5 1 206 ASN HA 1 208 GLN QE . . 4.260 4.133 3.890 4.417 0.157 2 0 "[ . 1 . 2]" 2 6 1 60 ILE QG 1 140 PHE H . . 4.640 4.902 4.718 5.008 0.368 7 0 "[ . 1 . 2]" 2 7 1 113 ARG H 1 116 ILE H . . 4.320 4.746 4.648 4.829 0.509 12 2 "[ .- 1 + . 2]" 2 8 1 120 LYS HD2 1 124 ASN QD . . 4.790 4.382 3.317 5.456 0.666 3 5 "[ + . *- * .* 2]" 2 9 1 156 GLN HA 1 158 THR H . . 3.990 3.594 3.490 3.659 . 0 0 "[ . 1 . 2]" 2 10 1 144 ALA MB 1 145 ASN QB . . 3.970 4.021 3.783 4.137 0.167 12 0 "[ . 1 . 2]" 2 11 1 147 ALA HA 1 150 ALA H . . 2.920 3.302 3.185 3.410 0.490 3 0 "[ . 1 . 2]" 2 12 1 42 PRO HA 1 42 PRO QG . . 3.160 3.054 2.995 3.131 . 0 0 "[ . 1 . 2]" 2 13 1 170 GLN H 1 173 LYS H . . 4.660 4.860 4.733 5.045 0.385 6 0 "[ . 1 . 2]" 2 14 1 130 PRO HA 1 178 THR MG . . 4.140 4.321 4.093 4.498 0.358 16 0 "[ . 1 . 2]" 2 15 1 228 VAL MG2 1 230 ALA H . . 4.440 4.638 4.347 4.776 0.336 10 0 "[ . 1 . 2]" 2 16 1 77 GLY H 1 140 PHE QD . . 5.170 4.569 4.331 4.937 . 0 0 "[ . 1 . 2]" 2 17 1 38 ARG QB 1 41 LEU H . . 5.090 5.411 5.070 6.283 1.193 13 3 "[ . *1 +-. 2]" 2 18 1 90 GLU QB 1 91 ALA H . . 2.920 2.584 2.274 3.399 0.479 3 0 "[ . 1 . 2]" 2 19 1 63 ALA MB 1 81 TYR H . . 4.380 5.520 5.380 6.129 1.749 8 20 [*******+*****-******] 2 20 1 145 ASN QB 1 147 ALA H . . 4.100 4.499 4.350 4.705 0.605 13 2 "[ .- 1 + . 2]" 2 21 1 199 ILE H 1 202 ALA H . . 4.960 4.565 4.493 4.645 . 0 0 "[ . 1 . 2]" 2 22 1 151 LEU QB 1 154 LEU H . . 4.480 4.801 4.712 4.989 0.509 19 1 "[ . 1 . +2]" 2 23 1 187 SER H 1 187 SER QB . . 3.000 2.265 2.231 2.401 . 0 0 "[ . 1 . 2]" 2 24 1 75 ARG QB 1 96 PHE HB3 . . 4.900 3.196 2.996 3.392 . 0 0 "[ . 1 . 2]" 2 25 1 12 SER HA 1 16 VAL H . . 3.380 3.927 3.753 4.088 0.708 18 14 "[*** -* *** *****+ 2]" 2 26 1 197 LYS QE 1 201 ILE MD . . 2.990 2.987 1.925 4.405 1.415 6 4 "[ .+ **1 . - 2]" 2 27 1 114 LEU HB3 1 115 GLN H . . 3.540 3.536 3.481 3.612 0.072 13 0 "[ . 1 . 2]" 2 28 1 60 ILE H 1 60 ILE QG . . 4.150 2.526 2.508 2.538 . 0 0 "[ . 1 . 2]" 2 29 1 138 THR H 1 150 ALA MB . . 3.680 3.961 3.811 4.124 0.444 15 0 "[ . 1 . 2]" 2 30 1 48 ALA H 1 49 LEU QD . . 3.540 3.813 3.495 4.005 0.465 9 0 "[ . 1 . 2]" 2 31 1 83 PHE QE 1 152 MET H . . 4.910 5.879 5.698 6.062 1.152 16 20 [***************+*-**] 2 32 1 88 ALA H 1 90 GLU H . . 3.580 4.170 3.860 4.419 0.839 5 15 "[****+**-** **.** *]" 2 33 1 10 THR H 1 11 SER HA . . 3.940 4.881 4.772 4.993 1.053 20 20 [*****-*************+] 2 34 1 109 GLY H 1 113 ARG QB . . 4.650 4.770 4.543 4.929 0.279 18 0 "[ . 1 . 2]" 2 35 1 74 TYR H 1 82 PHE QB . . 4.810 5.129 4.998 5.227 0.417 13 0 "[ . 1 . 2]" 2 36 1 6 LEU QB 1 9 ALA H . . 4.120 4.465 4.401 4.530 0.410 6 0 "[ . 1 . 2]" 2 37 1 177 LYS H 1 177 LYS QE . . 4.420 4.261 3.806 5.217 0.797 5 1 "[ + 1 . 2]" 2 38 1 95 VAL QG 1 96 PHE QD . . 2.460 2.916 2.868 2.993 0.533 6 3 "[ *.+ -1 . 2]" 2 39 1 20 ASN H 1 23 LYS H . . 4.340 4.530 4.491 4.592 0.252 1 0 "[ . 1 . 2]" 2 40 1 157 SER QB 1 159 SER H . . 4.590 5.665 5.510 6.169 1.579 8 20 [****-**+************] 2 41 1 120 LYS HB3 1 120 LYS QE . . 2.170 2.189 1.989 2.624 0.454 3 0 "[ . 1 . 2]" 2 42 1 31 LEU QB 1 34 ILE H . . 3.760 4.528 4.277 4.665 0.905 3 20 [**+****************-] 2 43 1 127 LEU H 1 179 PHE QR . . 4.490 3.783 3.525 4.016 . 0 0 "[ . 1 . 2]" 2 44 1 74 TYR H 1 75 ARG HA . . 4.270 4.623 4.545 4.653 0.383 13 0 "[ . 1 . 2]" 2 45 1 166 PHE QR 1 185 ILE H . . 4.550 3.290 2.846 3.666 . 0 0 "[ . 1 . 2]" 2 46 1 179 PHE QB 1 180 LEU H . . 3.190 2.971 2.815 3.104 . 0 0 "[ . 1 . 2]" 2 47 1 144 ALA H 1 145 ASN QB . . 4.600 4.534 4.378 4.807 0.207 18 0 "[ . 1 . 2]" 2 48 1 13 SER H 1 14 TYR QB . . 5.150 4.186 4.149 4.252 . 0 0 "[ . 1 . 2]" 2 49 1 64 ILE HA 1 64 ILE QG . . 3.670 3.014 2.249 3.070 . 0 0 "[ . 1 . 2]" 2 50 1 17 PHE QR 1 21 LEU H . . 5.120 4.062 4.002 4.179 . 0 0 "[ . 1 . 2]" 2 51 1 28 GLU HG2 1 36 LEU H . . 5.200 5.145 4.931 5.481 0.281 8 0 "[ . 1 . 2]" 2 52 1 138 THR H 1 139 LEU QB . . 4.590 4.534 4.503 4.571 . 0 0 "[ . 1 . 2]" 2 53 1 42 PRO QG 1 45 GLN HE22 . . 4.210 3.540 3.155 3.788 . 0 0 "[ . 1 . 2]" 2 54 1 184 ALA H 1 187 SER QB . . 4.460 4.611 4.451 4.909 0.449 14 0 "[ . 1 . 2]" 2 55 1 138 THR HA 1 143 ASN QB . . 3.680 3.594 3.302 3.840 0.160 1 0 "[ . 1 . 2]" 2 56 1 139 LEU QB 1 141 TYR H . . 3.870 4.522 4.493 4.556 0.686 9 20 [********+******-****] 2 57 1 120 LYS QD 1 124 ASN QD . . 4.590 3.924 3.191 4.347 . 0 0 "[ . 1 . 2]" 2 58 1 217 ASN HA 1 221 GLN H . . 4.210 5.057 4.897 5.191 0.981 12 20 [***********+-*******] 2 59 1 120 LYS QG 1 124 ASN H . . 4.400 3.717 3.610 3.913 . 0 0 "[ . 1 . 2]" 2 60 1 2 VAL H 1 49 LEU HB2 . . 4.290 4.487 4.290 4.657 0.367 6 0 "[ . 1 . 2]" 2 61 1 129 LEU H 1 179 PHE QD . . 5.490 5.898 5.244 6.294 0.804 14 8 "[* *. * *1 +* * -2]" 2 62 1 179 PHE HZ 1 185 ILE MD . . 2.830 2.597 2.307 2.859 0.029 18 0 "[ . 1 . 2]" 2 63 1 222 ARG HB3 1 222 ARG QD . . 3.040 2.319 2.217 2.432 . 0 0 "[ . 1 . 2]" 2 64 1 237 ILE MG 1 238 ALA H . . 4.300 4.137 2.851 4.229 . 0 0 "[ . 1 . 2]" 2 65 1 215 LEU QB 1 217 ASN H . . 4.560 5.011 4.504 5.197 0.637 11 10 "[ * . ****+- *.* *]" 2 66 1 14 TYR QB 1 15 GLY H . . 3.650 2.464 2.357 2.517 . 0 0 "[ . 1 . 2]" 2 67 1 120 LYS QG 1 121 ILE H . . 3.470 2.595 2.488 2.701 . 0 0 "[ . 1 . 2]" 2 68 1 82 PHE QB 1 92 ALA H . . 5.140 4.349 4.209 4.457 . 0 0 "[ . 1 . 2]" 2 69 1 17 PHE H 1 20 ASN H . . 4.730 4.450 4.415 4.504 . 0 0 "[ . 1 . 2]" 2 70 1 14 TYR H 1 14 TYR QB . . 3.190 2.202 2.169 2.233 . 0 0 "[ . 1 . 2]" 2 71 1 134 SER HA 1 134 SER QB . . 2.530 2.375 2.343 2.511 . 0 0 "[ . 1 . 2]" 2 72 1 71 VAL QG 1 158 THR H . . 3.710 5.134 4.946 5.434 1.724 5 20 [****+****-**********] 2 73 1 59 THR H 1 60 ILE MG . . 3.490 4.376 4.313 4.462 0.972 8 20 [*******+******-*****] 2 74 1 10 THR H 1 12 SER HA . . 5.030 6.549 6.372 6.790 1.760 20 20 [-******************+] 2 75 1 212 PRO QB 1 224 THR MG . . 2.800 2.258 2.058 2.833 0.033 7 0 "[ . 1 . 2]" 2 76 1 93 LYS H 1 94 TYR QE . . 4.190 4.429 4.269 4.542 0.352 6 0 "[ . 1 . 2]" 2 77 1 81 TYR H 1 96 PHE QR . . 4.870 3.415 3.242 4.138 . 0 0 "[ . 1 . 2]" 2 78 1 85 GLU QG 1 108 SER H . . 4.500 5.381 4.455 6.005 1.505 17 16 "[ * **-** *******+**2]" 2 79 1 212 PRO HA 1 226 THR MG . . 3.020 3.267 2.980 3.456 0.436 5 0 "[ . 1 . 2]" 2 80 1 9 ALA MB 1 14 TYR QB . . 3.790 3.632 3.395 3.881 0.091 16 0 "[ . 1 . 2]" 2 81 1 17 PHE QE 1 50 ILE MD . . 2.760 3.219 3.000 3.622 0.862 5 4 "[ * +- * 1 . 2]" 2 82 1 18 ILE MG 1 20 ASN H . . 3.850 5.054 5.014 5.094 1.244 1 20 [+******-************] 2 83 1 215 LEU QB 1 223 VAL H . . 3.900 3.899 3.785 3.982 0.082 20 0 "[ . 1 . 2]" 2 84 1 101 ARG QD 1 101 ARG HG2 . . 2.720 2.346 2.175 2.448 . 0 0 "[ . 1 . 2]" 2 85 1 80 SER HA 1 103 VAL H . . 4.680 4.726 4.628 5.207 0.527 8 1 "[ . + 1 . 2]" 2 86 1 177 LYS QE 1 178 THR H . . 4.350 4.579 4.366 4.753 0.403 15 0 "[ . 1 . 2]" 2 87 1 14 TYR QE 1 169 GLN H . . 4.610 4.691 4.500 4.877 0.267 6 0 "[ . 1 . 2]" 2 88 1 132 LEU H 1 135 ALA H . . 3.910 4.514 4.477 4.590 0.680 18 20 [*****************+*-] 2 89 1 79 THR HA 1 99 ALA MB . . 3.040 3.597 3.502 3.734 0.694 11 18 "[*- *******+* *******]" 2 90 1 113 ARG HA 1 116 ILE H . . 3.600 3.354 3.226 3.480 . 0 0 "[ . 1 . 2]" 2 91 1 64 ILE H 1 73 GLY H . . 5.400 5.734 5.604 5.841 0.441 4 0 "[ . 1 . 2]" 2 92 1 188 LEU QB 1 192 TRP H . . 4.830 4.785 4.552 4.940 0.110 8 0 "[ . 1 . 2]" 2 93 1 171 ILE H 1 179 PHE HZ . . 4.210 4.017 3.337 4.854 0.644 4 2 "[ +. 1 -. 2]" 2 94 1 63 ALA MB 1 74 TYR H . . 4.160 4.058 3.875 4.238 0.078 8 0 "[ . 1 . 2]" 2 95 1 61 SER H 1 140 PHE QD . . 5.400 5.863 5.735 5.979 0.579 14 7 "[* *.* - 1 +. **2]" 2 96 1 192 TRP H 1 192 TRP HE1 . . 5.080 6.821 6.735 6.941 1.861 15 20 [*************-+*****] 2 97 1 132 LEU H 1 135 ALA MB . . 4.130 4.383 4.328 4.461 0.331 5 0 "[ . 1 . 2]" 2 98 1 50 ILE HG13 1 62 VAL H . . 4.880 4.325 4.214 4.474 . 0 0 "[ . 1 . 2]" 2 99 1 117 ALA MB 1 148 ALA H . . 3.380 4.404 4.224 4.832 1.452 5 20 [**-*+***************] 2 100 1 29 ARG QD 1 36 LEU QD . . 3.570 2.598 2.010 3.852 0.282 9 0 "[ . 1 . 2]" 2 101 1 74 TYR H 1 82 PHE QD . . 4.400 4.458 4.333 4.557 0.157 3 0 "[ . 1 . 2]" 2 102 1 195 LEU HA 1 198 GLN QG . . 3.280 3.383 2.913 4.064 0.784 2 1 "[ + . 1 . 2]" 2 103 1 46 ARG H 1 67 THR MG . . 4.020 4.871 4.685 5.182 1.162 16 20 [*****-*********+****] 2 104 1 182 SER HB2 1 185 ILE H . . 4.040 3.335 2.309 4.352 0.312 3 0 "[ . 1 . 2]" 2 105 1 198 GLN H 1 199 ILE MD . . 3.500 4.531 3.657 5.199 1.699 5 11 "[*- *+* **1* ** *]" 2 106 1 42 PRO QG 1 45 GLN HE21 . . 3.950 3.746 3.097 4.192 0.242 5 0 "[ . 1 . 2]" 2 107 1 172 GLY H 1 173 LYS QG . . 5.050 4.456 4.270 4.656 . 0 0 "[ . 1 . 2]" 2 108 1 170 GLN QB 1 185 ILE MD . . 2.620 2.300 2.089 2.538 . 0 0 "[ . 1 . 2]" 2 109 1 129 LEU QB 1 132 LEU QD . . 4.010 3.390 3.258 3.615 . 0 0 "[ . 1 . 2]" 2 110 1 120 LYS HA 1 120 LYS HB3 . . 2.780 3.010 3.002 3.014 0.234 5 0 "[ . 1 . 2]" 2 111 1 63 ALA MB 1 72 MET H . . 2.880 3.208 3.003 3.331 0.451 20 0 "[ . 1 . 2]" 2 112 1 4 PHE QB 1 17 PHE QD . . 4.230 2.473 2.370 2.577 . 0 0 "[ . 1 . 2]" 2 113 1 101 ARG QD 1 101 ARG HG3 . . 2.650 2.242 2.161 2.374 . 0 0 "[ . 1 . 2]" 2 114 1 179 PHE QR 1 182 SER H . . 3.940 3.283 2.953 3.762 . 0 0 "[ . 1 . 2]" 2 115 1 52 LEU H 1 52 LEU HG . . 3.520 4.714 3.763 4.781 1.261 5 19 "[****+***** ******-**]" 2 116 1 155 ILE H 1 156 GLN HA . . 4.810 5.362 5.307 5.407 0.597 5 19 "[****+-* ************]" 2 117 1 116 ILE HA 1 118 ALA H . . 3.790 4.471 4.346 4.589 0.799 13 20 [************+*-*****] 2 118 1 110 ASN QD 1 112 GLU HB3 . . 4.280 4.237 4.076 4.354 0.074 14 0 "[ . 1 . 2]" 2 119 1 118 ALA H 1 148 ALA HA . . 4.280 5.290 5.191 5.366 1.086 1 20 [+*********-*********] 2 120 1 183 LEU HA 1 186 ILE HB . . 3.070 2.518 2.222 2.821 . 0 0 "[ . 1 . 2]" 2 121 1 41 LEU HA 1 41 LEU QD . . 2.470 1.967 1.911 2.026 . 0 0 "[ . 1 . 2]" 2 122 1 216 ILE MD 1 222 ARG QD . . 2.860 2.922 1.787 3.235 0.375 1 0 "[ . 1 . 2]" 2 123 1 177 LYS H 1 177 LYS QG . . 3.030 2.750 2.453 3.604 0.574 17 1 "[ . 1 . + 2]" 2 124 1 71 VAL QG 1 72 MET QG . . 4.020 4.060 3.931 4.168 0.148 3 0 "[ . 1 . 2]" 2 125 1 82 PHE QE 1 91 ALA H . . 4.230 5.407 5.180 5.911 1.681 5 20 [****+*****-*********] 2 126 1 105 LEU QD 1 106 PRO HD2 . . 3.620 3.451 3.083 3.567 . 0 0 "[ . 1 . 2]" 2 127 1 38 ARG QB 1 40 THR H . . 4.900 3.978 3.373 4.732 . 0 0 "[ . 1 . 2]" 2 128 1 180 LEU H 1 180 LEU HG . . 2.900 2.156 1.760 4.203 1.303 9 3 "[ . +* . -2]" 2 129 1 59 THR H 1 140 PHE QE . . 4.810 4.610 4.215 5.045 0.235 18 0 "[ . 1 . 2]" 2 130 1 174 ARG HA 1 177 LYS QG . . 3.730 4.040 3.326 4.583 0.853 16 5 "[ . * 1 * .+ * -]" 2 131 1 46 ARG HA 1 46 ARG QD . . 4.800 4.014 3.868 4.118 . 0 0 "[ . 1 . 2]" 2 132 1 3 SER H 1 17 PHE QR . . 4.730 3.488 3.225 3.749 . 0 0 "[ . 1 . 2]" 2 133 1 6 LEU H 1 136 ILE MG . . 5.070 5.813 5.563 6.068 0.998 3 19 "[**+**** -***********]" 2 stop_ save_ save_distance_constraint_statistics_3 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 3 _Distance_constraint_stats_list.Constraint_count 117 _Distance_constraint_stats_list.Viol_count 68 _Distance_constraint_stats_list.Viol_total 73.866 _Distance_constraint_stats_list.Viol_max 0.182 _Distance_constraint_stats_list.Viol_rms 0.0114 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0016 _Distance_constraint_stats_list.Viol_average_violations_only 0.0543 _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 4 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 6 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 9 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 11 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 12 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 13 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 14 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 15 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 16 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 17 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 18 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 19 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 20 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 21 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 22 ARG 0.760 0.098 19 0 "[ . 1 . 2]" 1 23 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 24 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 25 LEU 0.760 0.098 19 0 "[ . 1 . 2]" 1 28 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 29 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 31 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 34 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 35 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 36 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 37 LEU 0.028 0.028 12 0 "[ . 1 . 2]" 1 46 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 48 ALA 0.038 0.038 5 0 "[ . 1 . 2]" 1 50 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 51 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 52 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 53 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 54 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 58 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 60 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 61 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 62 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 63 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 64 ILE 0.038 0.038 5 0 "[ . 1 . 2]" 1 65 ASP 0.038 0.035 15 0 "[ . 1 . 2]" 1 66 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 68 ASN 0.038 0.035 15 0 "[ . 1 . 2]" 1 70 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 72 MET 0.000 0.000 . 0 "[ . 1 . 2]" 1 73 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 74 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 75 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 76 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 79 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 80 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 81 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 82 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 83 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 84 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 85 GLU 0.010 0.010 10 0 "[ . 1 . 2]" 1 86 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 87 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 88 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 89 THR 0.010 0.010 10 0 "[ . 1 . 2]" 1 90 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 91 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 92 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 93 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 96 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 99 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 101 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 103 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 105 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 107 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 110 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 111 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 113 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 114 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 115 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 117 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 118 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 119 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 121 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 124 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 127 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 128 GLY 0.058 0.058 18 0 "[ . 1 . 2]" 1 129 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 130 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 131 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 132 LEU 0.058 0.058 18 0 "[ . 1 . 2]" 1 133 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 134 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 135 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 136 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 137 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 138 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 139 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 140 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 146 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 147 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 148 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 149 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 150 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 151 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 152 MET 0.000 0.000 . 0 "[ . 1 . 2]" 1 153 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 154 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 155 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 156 GLN 0.187 0.083 4 0 "[ . 1 . 2]" 1 157 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 158 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 159 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 160 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 161 ALA 0.187 0.083 4 0 "[ . 1 . 2]" 1 162 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 163 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 164 TYR 0.053 0.027 6 0 "[ . 1 . 2]" 1 165 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 166 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 167 ILE 0.053 0.027 6 0 "[ . 1 . 2]" 1 168 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 169 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 170 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 171 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 172 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 174 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 179 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 182 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 183 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 184 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 185 ILE 0.148 0.128 16 0 "[ . 1 . 2]" 1 186 ILE 0.066 0.041 9 0 "[ . 1 . 2]" 1 187 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 188 LEU 1.932 0.182 2 0 "[ . 1 . 2]" 1 189 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 190 ASN 0.066 0.041 9 0 "[ . 1 . 2]" 1 191 SER 1.784 0.182 2 0 "[ . 1 . 2]" 1 192 TRP 0.048 0.019 14 0 "[ . 1 . 2]" 1 193 SER 0.298 0.087 16 0 "[ . 1 . 2]" 1 194 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 195 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 196 SER 0.172 0.052 7 0 "[ . 1 . 2]" 1 197 LYS 0.298 0.087 16 0 "[ . 1 . 2]" 1 198 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 199 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 200 GLN 0.123 0.052 7 0 "[ . 1 . 2]" 1 201 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 202 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 203 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 205 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 207 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 208 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 209 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 213 VAL 0.055 0.038 7 0 "[ . 1 . 2]" 1 215 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 217 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 221 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 223 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 225 ILE 0.055 0.038 7 0 "[ . 1 . 2]" 1 226 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 228 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 230 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 231 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 234 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 235 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 236 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 238 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 240 LEU 0.028 0.028 12 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 4 PHE H 1 51 HIS O . . 2.700 1.948 1.829 2.112 . 0 0 "[ . 1 . 2]" 3 2 1 6 LEU H 1 53 THR O . . 2.700 1.674 1.600 1.776 . 0 0 "[ . 1 . 2]" 3 3 1 6 LEU O 1 9 ALA H . . 2.700 1.849 1.777 1.921 . 0 0 "[ . 1 . 2]" 3 4 1 11 SER O 1 15 GLY H . . 2.700 1.937 1.807 2.084 . 0 0 "[ . 1 . 2]" 3 5 1 12 SER O 1 16 VAL H . . 2.700 1.893 1.820 1.973 . 0 0 "[ . 1 . 2]" 3 6 1 13 SER O 1 17 PHE H . . 2.700 2.016 1.914 2.123 . 0 0 "[ . 1 . 2]" 3 7 1 14 TYR O 1 18 ILE H . . 2.700 1.817 1.790 1.843 . 0 0 "[ . 1 . 2]" 3 8 1 15 GLY O 1 19 SER H . . 2.700 1.828 1.746 1.895 . 0 0 "[ . 1 . 2]" 3 9 1 16 VAL O 1 20 ASN H . . 2.700 1.717 1.682 1.764 . 0 0 "[ . 1 . 2]" 3 10 1 17 PHE O 1 21 LEU H . . 2.700 1.839 1.811 1.877 . 0 0 "[ . 1 . 2]" 3 11 1 18 ILE O 1 22 ARG H . . 2.700 1.886 1.817 1.963 . 0 0 "[ . 1 . 2]" 3 12 1 19 SER O 1 23 LYS H . . 2.700 2.008 1.938 2.113 . 0 0 "[ . 1 . 2]" 3 13 1 20 ASN O 1 24 ALA H . . 2.700 2.097 1.987 2.418 . 0 0 "[ . 1 . 2]" 3 14 1 21 LEU O 1 24 ALA H . . 2.700 2.578 2.206 2.684 . 0 0 "[ . 1 . 2]" 3 15 1 22 ARG O 1 25 LEU H . . 2.700 2.737 2.686 2.798 0.098 19 0 "[ . 1 . 2]" 3 16 1 28 GLU H 1 36 LEU O . . 2.700 2.071 1.898 2.271 . 0 0 "[ . 1 . 2]" 3 17 1 31 LEU H 1 34 ILE O . . 2.700 2.474 2.317 2.602 . 0 0 "[ . 1 . 2]" 3 18 1 31 LEU O 1 34 ILE H . . 2.700 2.383 2.280 2.545 . 0 0 "[ . 1 . 2]" 3 19 1 29 ARG O 1 36 LEU H . . 2.700 1.744 1.703 1.795 . 0 0 "[ . 1 . 2]" 3 20 1 37 LEU H 1 240 LEU O . . 2.700 2.221 1.925 2.728 0.028 12 0 "[ . 1 . 2]" 3 21 1 48 ALA H 1 64 ILE O . . 2.700 1.903 1.781 2.044 . 0 0 "[ . 1 . 2]" 3 22 1 50 ILE H 1 62 VAL O . . 2.700 1.803 1.738 1.871 . 0 0 "[ . 1 . 2]" 3 23 1 52 LEU H 1 60 ILE O . . 2.700 2.194 2.070 2.261 . 0 0 "[ . 1 . 2]" 3 24 1 4 PHE O 1 53 THR H . . 2.700 2.101 2.010 2.177 . 0 0 "[ . 1 . 2]" 3 25 1 54 ASN H 1 58 GLU O . . 2.700 1.908 1.809 2.059 . 0 0 "[ . 1 . 2]" 3 26 1 52 LEU O 1 60 ILE H . . 2.700 2.254 2.162 2.446 . 0 0 "[ . 1 . 2]" 3 27 1 50 ILE O 1 62 VAL H . . 2.700 1.766 1.674 1.987 . 0 0 "[ . 1 . 2]" 3 28 1 63 ALA H 1 73 GLY O . . 2.700 2.207 2.087 2.366 . 0 0 "[ . 1 . 2]" 3 29 1 48 ALA O 1 64 ILE H . . 2.700 2.166 1.882 2.738 0.038 5 0 "[ . 1 . 2]" 3 30 1 65 ASP H 1 70 TYR O . . 2.700 1.763 1.711 1.852 . 0 0 "[ . 1 . 2]" 3 31 1 46 ARG O 1 66 VAL H . . 2.700 1.893 1.798 2.184 . 0 0 "[ . 1 . 2]" 3 32 1 65 ASP O 1 68 ASN H . . 2.700 2.468 2.225 2.735 0.035 15 0 "[ . 1 . 2]" 3 33 1 63 ALA O 1 72 MET H . . 2.700 1.744 1.707 1.859 . 0 0 "[ . 1 . 2]" 3 34 1 74 TYR H 1 81 TYR O . . 2.700 1.902 1.843 1.963 . 0 0 "[ . 1 . 2]" 3 35 1 61 SER O 1 75 ARG H . . 2.700 1.800 1.679 2.009 . 0 0 "[ . 1 . 2]" 3 36 1 76 ALA H 1 79 THR O . . 2.700 1.864 1.813 1.916 . 0 0 "[ . 1 . 2]" 3 37 1 80 SER H 1 101 ARG O . . 2.700 1.742 1.661 1.795 . 0 0 "[ . 1 . 2]" 3 38 1 74 TYR O 1 81 TYR H . . 2.700 1.824 1.728 1.891 . 0 0 "[ . 1 . 2]" 3 39 1 82 PHE H 1 103 VAL O . . 2.700 1.855 1.793 1.892 . 0 0 "[ . 1 . 2]" 3 40 1 72 MET O 1 83 PHE H . . 2.700 2.056 1.858 2.223 . 0 0 "[ . 1 . 2]" 3 41 1 84 ASN H 1 107 TYR O . . 2.700 2.017 1.811 2.267 . 0 0 "[ . 1 . 2]" 3 42 1 85 GLU O 1 89 THR H . . 2.700 2.565 2.293 2.710 0.010 10 0 "[ . 1 . 2]" 3 43 1 86 ALA O 1 90 GLU H . . 2.700 2.258 1.874 2.562 . 0 0 "[ . 1 . 2]" 3 44 1 87 SER O 1 91 ALA H . . 2.700 2.106 1.888 2.470 . 0 0 "[ . 1 . 2]" 3 45 1 88 ALA O 1 92 ALA H . . 2.700 1.880 1.780 2.018 . 0 0 "[ . 1 . 2]" 3 46 1 90 GLU O 1 93 LYS H . . 2.700 2.101 1.975 2.236 . 0 0 "[ . 1 . 2]" 3 47 1 96 PHE O 1 99 ALA H . . 2.700 2.185 2.114 2.259 . 0 0 "[ . 1 . 2]" 3 48 1 80 SER O 1 103 VAL H . . 2.700 1.863 1.769 2.554 . 0 0 "[ . 1 . 2]" 3 49 1 82 PHE O 1 105 LEU H . . 2.700 1.745 1.678 1.794 . 0 0 "[ . 1 . 2]" 3 50 1 110 ASN O 1 114 LEU H . . 2.700 1.979 1.921 2.049 . 0 0 "[ . 1 . 2]" 3 51 1 111 TYR O 1 115 GLN H . . 2.700 2.005 1.795 2.369 . 0 0 "[ . 1 . 2]" 3 52 1 113 ARG O 1 117 ALA H . . 2.700 1.902 1.843 2.021 . 0 0 "[ . 1 . 2]" 3 53 1 114 LEU O 1 118 ALA H . . 2.700 1.840 1.784 1.952 . 0 0 "[ . 1 . 2]" 3 54 1 115 GLN O 1 119 GLY H . . 2.700 2.151 2.024 2.365 . 0 0 "[ . 1 . 2]" 3 55 1 121 ILE O 1 124 ASN H . . 2.700 2.048 1.930 2.176 . 0 0 "[ . 1 . 2]" 3 56 1 127 LEU H 1 179 PHE O . . 2.700 1.863 1.727 2.148 . 0 0 "[ . 1 . 2]" 3 57 1 129 LEU H 1 174 ARG O . . 2.700 2.135 1.941 2.336 . 0 0 "[ . 1 . 2]" 3 58 1 128 GLY O 1 131 ALA H . . 2.720 2.193 2.042 2.370 . 0 0 "[ . 1 . 2]" 3 59 1 128 GLY O 1 132 LEU H . . 2.700 2.587 2.437 2.758 0.058 18 0 "[ . 1 . 2]" 3 60 1 129 LEU O 1 133 ASP H . . 2.700 2.293 2.128 2.560 . 0 0 "[ . 1 . 2]" 3 61 1 130 PRO O 1 134 SER H . . 2.700 1.843 1.691 1.972 . 0 0 "[ . 1 . 2]" 3 62 1 131 ALA O 1 135 ALA H . . 2.700 1.773 1.746 1.814 . 0 0 "[ . 1 . 2]" 3 63 1 132 LEU O 1 136 ILE H . . 2.700 1.863 1.807 1.953 . 0 0 "[ . 1 . 2]" 3 64 1 133 ASP O 1 137 THR H . . 2.700 1.881 1.787 2.077 . 0 0 "[ . 1 . 2]" 3 65 1 134 SER O 1 138 THR H . . 2.700 1.921 1.829 2.155 . 0 0 "[ . 1 . 2]" 3 66 1 135 ALA O 1 139 LEU H . . 2.700 1.734 1.704 1.817 . 0 0 "[ . 1 . 2]" 3 67 1 136 ILE O 1 140 PHE H . . 2.700 1.778 1.731 1.838 . 0 0 "[ . 1 . 2]" 3 68 1 146 SER O 1 150 ALA H . . 2.700 2.361 1.995 2.675 . 0 0 "[ . 1 . 2]" 3 69 1 147 ALA O 1 151 LEU H . . 2.700 1.802 1.731 1.898 . 0 0 "[ . 1 . 2]" 3 70 1 148 ALA O 1 152 MET H . . 2.700 2.070 1.935 2.202 . 0 0 "[ . 1 . 2]" 3 71 1 149 SER O 1 153 VAL H . . 2.700 1.752 1.698 1.836 . 0 0 "[ . 1 . 2]" 3 72 1 150 ALA O 1 154 LEU H . . 2.700 1.981 1.796 2.147 . 0 0 "[ . 1 . 2]" 3 73 1 151 LEU O 1 155 ILE H . . 2.700 1.767 1.691 1.904 . 0 0 "[ . 1 . 2]" 3 74 1 152 MET O 1 156 GLN H . . 2.700 2.135 1.898 2.314 . 0 0 "[ . 1 . 2]" 3 75 1 153 VAL O 1 157 SER H . . 2.700 2.068 1.923 2.265 . 0 0 "[ . 1 . 2]" 3 76 1 155 ILE O 1 158 THR H . . 2.700 2.246 1.970 2.596 . 0 0 "[ . 1 . 2]" 3 77 1 155 ILE O 1 160 GLU H . . 2.700 2.134 1.951 2.478 . 0 0 "[ . 1 . 2]" 3 78 1 156 GLN O 1 161 ALA H . . 2.700 2.555 2.325 2.783 0.083 4 0 "[ . 1 . 2]" 3 79 1 158 THR O 1 162 ALA H . . 2.700 1.831 1.716 1.957 . 0 0 "[ . 1 . 2]" 3 80 1 159 SER O 1 163 ARG H . . 2.700 1.997 1.833 2.192 . 0 0 "[ . 1 . 2]" 3 81 1 160 GLU O 1 164 TYR H . . 2.700 2.236 1.744 2.442 . 0 0 "[ . 1 . 2]" 3 82 1 165 LYS H 1 236 ASN O . . 2.700 1.820 1.702 2.175 . 0 0 "[ . 1 . 2]" 3 83 1 164 TYR O 1 167 ILE H . . 2.700 2.568 2.269 2.727 0.027 6 0 "[ . 1 . 2]" 3 84 1 164 TYR O 1 168 GLU H . . 2.700 2.234 2.076 2.391 . 0 0 "[ . 1 . 2]" 3 85 1 165 LYS O 1 169 GLN H . . 2.700 1.965 1.807 2.327 . 0 0 "[ . 1 . 2]" 3 86 1 166 PHE O 1 170 GLN H . . 2.700 2.129 1.993 2.262 . 0 0 "[ . 1 . 2]" 3 87 1 167 ILE O 1 171 ILE H . . 2.700 2.062 1.974 2.156 . 0 0 "[ . 1 . 2]" 3 88 1 168 GLU O 1 172 GLY H . . 2.700 1.811 1.764 1.882 . 0 0 "[ . 1 . 2]" 3 89 1 171 ILE O 1 174 ARG H . . 2.700 2.140 1.996 2.253 . 0 0 "[ . 1 . 2]" 3 90 1 127 LEU O 1 179 PHE H . . 2.700 1.946 1.874 2.026 . 0 0 "[ . 1 . 2]" 3 91 1 182 SER O 1 186 ILE H . . 2.700 2.094 1.916 2.272 . 0 0 "[ . 1 . 2]" 3 92 1 183 LEU O 1 187 SER H . . 2.700 1.907 1.815 2.056 . 0 0 "[ . 1 . 2]" 3 93 1 184 ALA O 1 188 LEU H . . 2.700 2.016 1.910 2.155 . 0 0 "[ . 1 . 2]" 3 94 1 185 ILE O 1 188 LEU H . . 2.770 2.603 2.417 2.898 0.128 16 0 "[ . 1 . 2]" 3 95 1 185 ILE O 1 189 GLU H . . 2.700 2.417 2.080 2.684 . 0 0 "[ . 1 . 2]" 3 96 1 186 ILE O 1 190 ASN H . . 2.700 2.466 2.033 2.741 0.041 9 0 "[ . 1 . 2]" 3 97 1 188 LEU O 1 191 SER H . . 2.700 2.787 2.665 2.882 0.182 2 0 "[ . 1 . 2]" 3 98 1 191 SER O 1 195 LEU H . . 2.700 1.694 1.657 1.770 . 0 0 "[ . 1 . 2]" 3 99 1 192 TRP O 1 196 SER H . . 2.700 2.546 1.965 2.719 0.019 14 0 "[ . 1 . 2]" 3 100 1 193 SER O 1 197 LYS H . . 2.700 2.551 2.168 2.787 0.087 16 0 "[ . 1 . 2]" 3 101 1 194 ALA O 1 198 GLN H . . 2.700 2.008 1.767 2.300 . 0 0 "[ . 1 . 2]" 3 102 1 195 LEU O 1 199 ILE H . . 2.700 2.122 1.743 2.692 . 0 0 "[ . 1 . 2]" 3 103 1 196 SER O 1 200 GLN H . . 2.700 2.340 2.045 2.752 0.052 7 0 "[ . 1 . 2]" 3 104 1 197 LYS O 1 201 ILE H . . 2.700 2.199 1.897 2.622 . 0 0 "[ . 1 . 2]" 3 105 1 199 ILE O 1 203 SER H . . 2.700 1.987 1.913 2.092 . 0 0 "[ . 1 . 2]" 3 106 1 198 GLN O 1 202 ALA H . . 2.700 1.681 1.633 1.710 . 0 0 "[ . 1 . 2]" 3 107 1 205 ASN O 1 208 GLN H . . 2.700 2.045 1.885 2.134 . 0 0 "[ . 1 . 2]" 3 108 1 209 PHE H 1 226 THR O . . 2.700 2.047 1.766 2.454 . 0 0 "[ . 1 . 2]" 3 109 1 213 VAL H 1 225 ILE O . . 2.700 2.545 2.376 2.717 0.017 7 0 "[ . 1 . 2]" 3 110 1 215 LEU H 1 223 VAL O . . 2.700 2.148 1.942 2.584 . 0 0 "[ . 1 . 2]" 3 111 1 217 ASN H 1 221 GLN O . . 2.700 1.861 1.661 2.076 . 0 0 "[ . 1 . 2]" 3 112 1 213 VAL O 1 225 ILE H . . 2.700 2.285 1.996 2.738 0.038 7 0 "[ . 1 . 2]" 3 113 1 207 GLY O 1 228 VAL H . . 2.700 2.355 1.945 2.646 . 0 0 "[ . 1 . 2]" 3 114 1 230 ALA O 1 234 THR H . . 2.700 2.189 1.954 2.379 . 0 0 "[ . 1 . 2]" 3 115 1 231 GLY O 1 235 SER H . . 2.700 2.062 1.854 2.440 . 0 0 "[ . 1 . 2]" 3 116 1 163 ARG O 1 238 ALA H . . 2.700 2.348 2.029 2.513 . 0 0 "[ . 1 . 2]" 3 117 1 35 PRO O 1 240 LEU H . . 2.700 2.027 1.865 2.594 . 0 0 "[ . 1 . 2]" 3 stop_ save_
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