TITL P1 lysozyme after mol rep CELL 0.92700 26.650 30.800 33.630 89.30 72.60 67.80 ZERR 1 0.027 0.031 0.034 0.05 0.05 0.05 REM Space group P1 LATT -1 SFAC C H N O S UNIT 613 1189 193 185 10 DEFS 0.02 0.1 0.01 0.04 L.S. 20 -1 BLOC 1 SHEL 10 2.5 FMAP 2 PLAN 200 2.3 LIST 6 WPDB 2 DELU $C_* $N_* $O_* $S_* SIMU 0.1 $C_* $N_* $O_* $S_* REM ISOR and CONN 0 recommended on adding water BUMP REM HOPE REM Remove MERG 4 instruction if Friedel opposites should not be merged MERG 4 REM MORE 0 would reduce output if not required for diagnostic purposes REM MORE 0 REM Remove 'REM ' before RTAB to activate remaining tables RTAB_* Cvol CA RTAB_* Omeg CA_+ N_+ C CA RTAB_* Phi C_- N CA C RTAB_* Psi N CA C N_+ RTAB_ARG Chi1 N CA CB CG RTAB_ARG Chi2 CA CB CG CD RTAB_ARG Chi3 CB CG CD NE RTAB_ARG Chi4 CG CD NE CZ RTAB_ASN Chi1 N CA CB CG RTAB_ASN Chi2 CA CB CG OD1 RTAB_ASP Chi1 N CA CB CG RTAB_ASP Chi2 CA CB CG OD1 RTAB_CYS Chi1 N CA CB SG RTAB_GLN Chi1 N CA CB CG RTAB_GLN Chi2 CA CB CG CD RTAB_GLN Chi3 CB CG CD OE1 RTAB_GLU Chi1 N CA CB CG RTAB_GLU Chi2 CA CB CG CD RTAB_GLU Chi3 CB CG CD OE1 RTAB_HIS Chi1 N CA CB CG RTAB_HIS Chi2 CA CB CG ND1 RTAB_ILE Chi1 N CA CB CG1 RTAB_ILE Chi2 CA CB CG1 CD1 RTAB_ILE Cvol CB RTAB_LEU Chi1 N CA CB CG RTAB_LEU Chi2 CA CB CG CD1 RTAB_LYS Chi1 N CA CB CG RTAB_LYS Chi2 CA CB CG CD RTAB_LYS Chi3 CB CG CD CE RTAB_LYS Chi4 CG CD CE NZ RTAB_MET Chi1 N CA CB CG RTAB_MET Chi2 CA CB CG SD RTAB_MET Chi3 CB CG SD CE RTAB_PHE Chi1 N CA CB CG RTAB_PHE Chi2 CA CB CG CD1 RTAB_PRO Chi1 N CA CB CG RTAB_PRO Chi2 CA CB CG CD RTAB_PRO Chi3 CB CG CD N RTAB_SER Chi1 N CA CB OG RTAB_THR Chi1 N CA CB OG1 RTAB_THR Cvol CB RTAB_TRP Chi1 N CA CB CG RTAB_TRP Chi2 CA CB CG CD1 RTAB_TYR Chi1 N CA CB CG RTAB_TYR Chi2 CA CB CG CD1 RTAB_VAL Chi1 N CA CB CG1 REM Remove 'REM ' in following to activate H-atom generation REM HFIX 33 N_1 REM HFIX_ALA 43 N REM HFIX_ALA 13 CA REM HFIX_ALA 33 CB REM HFIX_ARG 13 CA REM HFIX_ARG 23 CB CG CD REM HFIX_ARG 43 N NE REM HFIX_ARG 93 NH1 NH2 REM HFIX_ASN 43 N REM HFIX_ASN 13 CA REM HFIX_ASN 23 CB REM HFIX_ASN 93 ND2 REM HFIX_ASP 43 N REM HFIX_ASP 13 CA REM HFIX_ASP 23 CB REM HFIX_CYS 43 N REM HFIX_CYS 13 CA REM HFIX_CYS 23 CB REM HFIX_GLN 43 N REM HFIX_GLN 13 CA REM HFIX_GLN 23 CB CG REM HFIX_GLN 93 NE2 REM HFIX_GLU 43 N REM HFIX_GLU 13 CA REM HFIX_GLU 23 CB CG REM HFIX_GLY 43 N REM HFIX_GLY 23 CA REM HFIX_HIS 13 CA REM HFIX_HIS 23 CB REM HFIX_HIS 43 N ND1 CE1 CD2 REM HFIX_ILE 43 N REM HFIX_ILE 13 CA CB REM HFIX_ILE 23 CG1 REM HFIX_ILE 33 CD1 CG2 REM HFIX_LEU 43 N REM HFIX_LEU 13 CA CG REM HFIX_LEU 23 CB REM HFIX_LEU 33 CD1 CD2 REM HFIX_LYS 43 N REM HFIX_LYS 13 CA REM HFIX_LYS 23 CB CG CD CE REM HFIX_LYS 33 NZ REM HFIX_MET 43 N REM HFIX_MET 13 CA REM HFIX_MET 23 CB CG REM HFIX_MET 33 CE REM HFIX_PHE 13 CA REM HFIX_PHE 23 CB REM HFIX_PHE 43 N CD1 CD2 CE1 CE2 CZ REM HFIX_PRO 13 CA REM HFIX_PRO 23 CB CG CD REM HFIX_SER 43 N REM HFIX_SER 13 CA REM HFIX_SER 23 CB REM HFIX_SER 83 OG REM HFIX_THR 43 N REM HFIX_THR 13 CA CB REM HFIX_THR 33 CG2 REM HFIX_THR 83 OG1 REM HFIX_TRP 13 CA REM HFIX_TRP 23 CB REM HFIX_TRP 43 N CD1 NE1 CZ2 CH2 CZ3 CE3 REM HFIX_TYR 13 CA REM HFIX_TYR 23 CB REM HFIX_TYR 43 N CD1 CD2 CE1 CE2 REM HFIX_TYR 83 OH REM HFIX_VAL 43 N REM HFIX_VAL 13 CA CB REM HFIX_VAL 33 CG1 CG2 DFIX_* 1.329 C_- N DANG_* 2.425 CA_- N DANG_* 2.250 O_- N DANG_* 2.435 C_- CA FLAT_* 0.5 O_- CA_- N C_- CA CHIV_ALA C CHIV_ALA 2.477 CA DFIX_ALA 1.231 C O DFIX_ALA 1.525 C CA DFIX_ALA 1.521 CA CB DFIX_ALA 1.458 N CA DANG_ALA 2.462 C N DANG_ALA 2.401 O CA DANG_ALA 2.503 C CB DANG_ALA 2.446 CB N CHIV_ARG C CZ CHIV_ARG 2.503 CA FLAT_ARG CD NH1 NH2 NE CZ DFIX_ARG 1.231 C O DFIX_ARG 1.458 CA N DFIX_ARG 1.525 C CA DFIX_ARG 1.530 CA CB DFIX_ARG 1.520 CB CG CG CD DFIX_ARG 1.460 CD NE DFIX_ARG 1.326 CZ NE CZ NH1 CZ NH2 DANG_ARG 2.455 N CB DANG_ARG 2.401 O CA DANG_ARG 2.504 C CB DANG_ARG 2.462 C N DANG_ARG 2.559 CA CG DANG_ARG 2.510 CB CD DANG_ARG 2.471 CG NE DANG_ARG 2.466 CD CZ DANG_ARG 2.299 NE NH1 NE NH2 DANG_ARG 2.293 NH1 NH2 CHIV_ASN C CG CHIV_ASN 2.503 CA DFIX_ASN 1.231 C O CG OD1 DFIX_ASN 1.525 C CA DFIX_ASN 1.458 N CA DFIX_ASN 1.530 CA CB DFIX_ASN 1.516 CB CG DFIX_ASN 1.328 CG ND2 DANG_ASN 2.401 O CA DANG_ASN 2.462 C N DANG_ASN 2.455 CB N DANG_ASN 2.504 C CB DANG_ASN 2.534 CA CG DANG_ASN 2.393 CB OD1 DANG_ASN 2.419 CB ND2 DANG_ASN 2.245 OD1 ND2 CHIV_ASP C CG CHIV_ASP 2.503 CA DFIX_ASP 1.231 C O DFIX_ASP 1.525 C CA DFIX_ASP 1.530 CA CB DFIX_ASP 1.516 CB CG DFIX_ASP 1.458 CA N DFIX_ASP 1.249 CG OD1 CG OD2 DANG_ASP 2.401 O CA DANG_ASP 2.462 C N DANG_ASP 2.455 CB N DANG_ASP 2.504 C CB DANG_ASP 2.534 CA CG DANG_ASP 2.379 CB OD1 CB OD2 DANG_ASP 2.194 OD1 OD2 CHIV_CYS C CHIV_CYS 2.503 CA DFIX_CYS 1.231 C O DFIX_CYS 1.525 C CA DFIX_CYS 1.458 N CA DFIX_CYS 1.530 CA CB DFIX_CYS 1.808 CB SG DANG_CYS 2.401 O CA DANG_CYS 2.504 C CB DANG_CYS 2.455 CB N DANG_CYS 2.462 C N DANG_CYS 2.810 CA SG CHIV_GLN C CD CHIV_GLN 2.503 CA DFIX_GLN 1.231 C O DFIX_GLN 1.458 N CA DFIX_GLN 1.525 C CA DFIX_GLN 1.530 CA CB DFIX_GLN 1.520 CB CG DFIX_GLN 1.516 CG CD DFIX_GLN 1.231 CD OE1 DFIX_GLN 1.328 CD NE2 DANG_GLN 2.401 O CA DANG_GLN 2.462 C N DANG_GLN 2.455 CB N DANG_GLN 2.504 C CB DANG_GLN 2.559 CA CG DANG_GLN 2.526 CB CD DANG_GLN 2.393 CG OE1 DANG_GLN 2.419 CG NE2 DANG_GLN 2.245 OE1 NE2 CHIV_GLU C CD CHIV_GLU 2.503 CA DFIX_GLU 1.231 C O DFIX_GLU 1.458 N CA DFIX_GLU 1.525 C CA DFIX_GLU 1.530 CA CB DFIX_GLU 1.520 CB CG DFIX_GLU 1.516 CG CD DFIX_GLU 1.249 CD OE1 CD OE2 DANG_GLU 2.401 O CA DANG_GLU 2.462 C N DANG_GLU 2.455 CB N DANG_GLU 2.504 C CB DANG_GLU 2.559 CA CG DANG_GLU 2.526 CB CD DANG_GLU 2.379 CG OE1 CG OE2 DANG_GLU 2.194 OE1 OE2 CHIV_GLY C DFIX_GLY 1.231 O C DFIX_GLY 1.516 C CA DFIX_GLY 1.451 CA N DANG_GLY 2.467 C N DANG_GLY 2.393 O CA FLAT_HIS CB ND1 NE2 CD2 CE1 CG CHIV_HIS C CHIV_HIS 2.503 CA DFIX_HIS 1.231 C O DFIX_HIS 1.525 C CA DFIX_HIS 1.458 CA N DFIX_HIS 1.530 CA CB DFIX_HIS 1.497 CB CG DFIX_HIS 1.378 CG ND1 DFIX_HIS 1.321 ND1 CE1 CE1 NE2 DFIX_HIS 1.374 NE2 CD2 DFIX_HIS 1.354 CD2 CG DANG_HIS 2.401 O CA DANG_HIS 2.462 C N DANG_HIS 2.504 C CB DANG_HIS 2.455 N CB DANG_HIS 2.536 CA CG DANG_HIS 2.524 CB ND1 DANG_HIS 2.597 CB CD2 DANG_HIS 2.202 CG CE1 DANG_HIS 2.196 CG NE2 DANG_HIS 2.194 CE1 CD2 DANG_HIS 2.143 ND1 NE2 DANG_HIS 2.170 ND1 CD2 CHIV_ILE C CHIV_ILE 2.516 CA CHIV_ILE 2.495 CB DFIX_ILE 1.231 C O DFIX_ILE 1.525 C CA DFIX_ILE 1.458 CA N DFIX_ILE 1.540 CA CB DFIX_ILE 1.530 CB CG1 DFIX_ILE 1.521 CB CG2 DFIX_ILE 1.513 CG1 CD1 DANG_ILE 2.401 O CA DANG_ILE 2.462 C N DANG_ILE 2.479 N CB DANG_ILE 2.576 CA CG1 DANG_ILE 2.515 CA CG2 DANG_ILE 2.549 CB CD1 DANG_ILE 2.510 CG1 CG2 DANG_ILE 2.497 C CB CHIV_LEU C CHIV_LEU 2.503 CA CHIV_LEU -2.589 CG DFIX_LEU 1.231 C O DFIX_LEU 1.525 C CA DFIX_LEU 1.458 N CA DFIX_LEU 1.530 CA CB CB CG DFIX_LEU 1.521 CG CD1 CG CD2 DANG_LEU 2.401 O CA DANG_LEU 2.462 C N DANG_LEU 2.455 N CB DANG_LEU 2.504 C CB DANG_LEU 2.599 CA CG DANG_LEU 2.510 CB CD1 CB CD2 DANG_LEU 2.504 CD1 CD2 CHIV_LYS C CHIV_LYS 2.503 CA DFIX_LYS 1.231 C O DFIX_LYS 1.525 C CA DFIX_LYS 1.458 CA N DFIX_LYS 1.530 CA CB DFIX_LYS 1.520 CB CG CG CD CD CE DFIX_LYS 1.489 CE NZ DANG_LYS 2.401 O CA DANG_LYS 2.462 C N DANG_LYS 2.455 N CB DANG_LYS 2.504 C CB DANG_LYS 2.559 CA CG DANG_LYS 2.510 CB CD CG CE DANG_LYS 2.493 CD NZ CHIV_MET C CHIV_MET 2.503 CA DFIX_MET 1.231 C O DFIX_MET 1.458 N CA DFIX_MET 1.525 C CA DFIX_MET 1.530 CA CB DFIX_MET 1.520 CB CG DFIX_MET 1.803 CG SD DFIX_MET 1.791 SD CE DANG_MET 2.401 O CA DANG_MET 2.462 C N DANG_MET 2.455 N CB DANG_MET 2.559 CA CG DANG_MET 2.771 CB SD DANG_MET 2.504 C CB DANG_MET 2.771 CG CE FLAT_PHE CG CD1 CE2 CB CD2 CE1 CZ CHIV_PHE C CHIV_PHE 2.503 CA DFIX_PHE 1.231 C O DFIX_PHE 1.458 N CA DFIX_PHE 1.525 C CA DFIX_PHE 1.530 CA CB DFIX_PHE 1.520 CB CG DFIX_PHE 1.384 CG CD1 CG CD2 DFIX_PHE 1.382 CD1 CE1 CD2 CE2 CE1 CZ CE2 CZ DANG_PHE 2.401 O CA DANG_PHE 2.462 C N DANG_PHE 2.504 C CB DANG_PHE 2.455 N CB DANG_PHE 2.555 CA CG DANG_PHE 2.525 CB CD1 CB CD2 DANG_PHE 2.404 CG CE1 CG CE2 DANG_PHE 2.394 CD1 CZ CD2 CZ CE1 CE2 DANG_PHE 2.380 CD1 CD2 CHIV_PRO C N CHIV_PRO 2.728 CA DFIX_PRO 1.231 C O DFIX_PRO 1.525 C CA DFIX_PRO 1.466 CA N DFIX_PRO 1.473 N CD DFIX_PRO 1.503 CD CG DFIX_PRO 1.492 CG CB DFIX_PRO 1.530 CB CA DANG_PRO 2.401 O CA DANG_PRO 2.477 C N DANG_PRO 2.504 C CB DANG_PRO 2.437 CA CD DANG_PRO 2.332 N CG DANG_PRO 2.393 CD CB DANG_PRO 2.390 CA CG DANG_PRO 2.345 N CB DANG_PRO 2.497 CD C_- CHIV_SER C CHIV_SER 2.503 CA DFIX_SER 1.231 C O DFIX_SER 1.525 C CA DFIX_SER 1.458 N CA DFIX_SER 1.530 CA CB DFIX_SER 1.417 CB OG DANG_SER 2.401 O CA DANG_SER 2.462 C N DANG_SER 2.504 C CB DANG_SER 2.455 N CB DANG_SER 2.431 CA OG CHIV_THR C CHIV_THR 2.516 CA CHIV_THR -2.628 CB DFIX_THR 1.231 C O DFIX_THR 1.525 C CA DFIX_THR 1.458 N CA DFIX_THR 1.540 CA CB DFIX_THR 1.433 CB OG1 DFIX_THR 1.521 CB CG2 DANG_THR 2.401 O CA DANG_THR 2.462 C N DANG_THR 2.497 C CB DANG_THR 2.479 N CB DANG_THR 2.430 CA OG1 DANG_THR 2.515 CA CG2 DANG_THR 2.373 OG1 CG2 FLAT_TRP CB CE2 CZ3 CG CD1 NE1 CD2 CZ2 CH2 CE3 CHIV_TRP C CHIV_TRP 2.503 CA DFIX_TRP 1.231 C O DFIX_TRP 1.525 C CA DFIX_TRP 1.458 N CA DFIX_TRP 1.530 CA CB DFIX_TRP 1.498 CB CG DFIX_TRP 1.365 CG CD1 DFIX_TRP 1.374 CD1 NE1 DFIX_TRP 1.370 NE1 CE2 DFIX_TRP 1.394 CE2 CZ2 DFIX_TRP 1.368 CZ2 CH2 DFIX_TRP 1.400 CH2 CZ3 DFIX_TRP 1.382 CZ3 CE3 DFIX_TRP 1.398 CE3 CD2 DFIX_TRP 1.433 CD2 CG DFIX_TRP 1.409 CD2 CE2 DANG_TRP 2.401 O CA DANG_TRP 2.462 C N DANG_TRP 2.504 C CB DANG_TRP 2.455 N CB DANG_TRP 2.534 CA CG DANG_TRP 2.562 CB CD1 DANG_TRP 2.621 CB CD2 DANG_TRP 2.246 CG NE1 DANG_TRP 2.605 CG CE3 DANG_TRP 2.288 CG CE2 DANG_TRP 2.233 CD1 CE2 DANG_TRP 2.239 CD1 CD2 DANG_TRP 2.240 NE1 CD2 DANG_TRP 2.361 CE2 CH2 DANG_TRP 2.416 CE2 CE3 DANG_TRP 2.390 CD2 CZ3 DANG_TRP 2.456 CD2 CZ2 DANG_TRP 2.423 CE3 CH2 DANG_TRP 2.415 CZ3 CZ2 DANG_TRP 2.506 NE1 CZ2 FLAT_TYR CB CD1 CE2 CG CD2 CE1 CZ OH CHIV_TYR C CHIV_TYR 2.503 CA DFIX_TYR 1.231 C O DFIX_TYR 1.458 N CA DFIX_TYR 1.525 C CA DFIX_TYR 1.530 CA CB DFIX_TYR 1.512 CB CG DFIX_TYR 1.389 CG CD2 CG CD1 DFIX_TYR 1.382 CD2 CE2 CD1 CE1 DFIX_TYR 1.378 CE2 CZ CE1 CZ DFIX_TYR 1.376 CZ OH DANG_TYR 2.401 O CA DANG_TYR 2.462 C N DANG_TYR 2.455 N CB DANG_TYR 2.504 C CB DANG_TYR 2.550 CA CG DANG_TYR 2.523 CB CD1 CB CD2 DANG_TYR 2.414 CG CE1 CG CE2 DANG_TYR 2.385 CZ CD1 CZ CD2 DANG_TYR 2.384 OH CE1 OH CE2 DANG_TYR 2.382 CD1 CD2 DANG_TYR 2.390 CE1 CE2 CHIV_VAL C CHIV_VAL 2.516 CA CHIV_VAL -2.622 CB DFIX_VAL 1.231 C O DFIX_VAL 1.458 N CA DFIX_VAL 1.525 C CA DFIX_VAL 1.540 CA CB DFIX_VAL 1.521 CB CG2 CB CG1 DANG_VAL 2.401 O CA DANG_VAL 2.462 C N DANG_VAL 2.497 C CB DANG_VAL 2.515 CA CG1 CA CG2 DANG_VAL 2.479 N CB DANG_VAL 2.504 CG1 CG2 DFIX 2.031 SG_6 SG_127 SG_30 SG_115 SG_64 SG_80 SG_76 SG_94 DANG 3.035 CB_6 SG_127 SG_6 CB_127 CB_30 SG_115 SG_30 CB_115 CB_64 SG_80 DANG 3.035 SG_64 CB_80 CB_76 SG_94 SG_76 CB_94 DFIX_129 1.249 C OT1 C OT2 DANG_129 2.379 CA OT1 CA OT2 DANG_129 2.194 OT1 OT2 WGHT 0.100000 SWAT 0.218182 675.6104 FVAR 0.16092 AFIX 6 RESI 1 LYS N 3 -0.767637 1.175401 0.918481 11.00000 0.20264 CA 1 -0.775596 1.151231 0.956818 11.00000 0.20264 C 1 -0.727146 1.102730 0.946777 11.00000 0.25330 O 4 -0.707142 1.079788 0.910830 11.00000 0.25330 CB 1 -0.834099 1.146773 0.968204 11.00000 0.25330 CG 1 -0.840828 1.114712 1.002870 11.00000 0.34196 CD 1 -0.894079 1.104752 1.010137 11.00000 0.44328 CE 1 -0.897781 1.072640 1.045623 11.00000 0.56993 NZ 3 -0.942355 1.054349 1.046625 11.00000 0.56993 RESI 2 VAL N 3 -0.706526 1.087789 0.977336 11.00000 0.20264 CA 1 -0.659326 1.042894 0.975297 11.00000 0.20264 C 1 -0.687172 1.011163 1.000476 11.00000 0.25330 O 4 -0.712953 1.021132 1.038803 11.00000 0.25330 CB 1 -0.612930 1.048918 0.989552 11.00000 0.25330 CG1 1 -0.562289 1.001563 0.985494 11.00000 0.31663 CG2 1 -0.585968 1.080779 0.964068 11.00000 0.31663 RESI 3 PHE N 3 -0.684905 0.975235 0.979141 11.00000 0.20264 CA 1 -0.713940 0.944166 1.000294 11.00000 0.20264 C 1 -0.674169 0.907890 1.020923 11.00000 0.25330 O 4 -0.621780 0.895957 1.006491 11.00000 0.25330 CB 1 -0.730219 0.920594 0.969937 11.00000 0.25330 CG 1 -0.785003 0.946572 0.960696 11.00000 0.31663 CD1 1 -0.833202 0.937586 0.981644 11.00000 0.31663 CD2 1 -0.788096 0.978361 0.930554 11.00000 0.31663 CE1 1 -0.885093 0.960230 0.974488 11.00000 0.31663 CE2 1 -0.839164 1.000707 0.921609 11.00000 0.31663 CZ 1 -0.887792 0.992289 0.943966 11.00000 0.31663 RESI 4 GLY N 3 -0.701146 0.890770 1.052420 11.00000 0.20264 CA 1 -0.669894 0.848683 1.070640 11.00000 0.20264 C 1 -0.669192 0.806423 1.046371 11.00000 0.25330 O 4 -0.705538 0.812383 1.028172 11.00000 0.25330 RESI 5 ARG N 3 -0.629487 0.765102 1.046445 11.00000 0.20264 CA 1 -0.621807 0.722537 1.020900 11.00000 0.20264 C 1 -0.676975 0.715387 1.031456 11.00000 0.25330 O 4 -0.698189 0.714139 1.003464 11.00000 0.25330 CB 1 -0.570673 0.681610 1.025381 11.00000 0.25330 RESI 6 CYS N 3 -0.702228 0.710680 1.071240 11.00000 0.20264 CA 1 -0.752077 0.697206 1.082400 11.00000 0.20264 C 1 -0.803958 0.735990 1.076090 11.00000 0.25330 O 4 -0.840169 0.727913 1.063976 11.00000 0.25330 CB 1 -0.763693 0.684592 1.128354 11.00000 0.25330 SG 5 -0.709606 0.630412 1.134048 11.00000 0.25330 RESI 7 GLU N 3 -0.808300 0.779530 1.084500 11.00000 0.20264 CA 1 -0.854326 0.821719 1.079504 11.00000 0.20264 C 1 -0.852988 0.821741 1.033400 11.00000 0.25330 O 4 -0.896654 0.829761 1.024542 11.00000 0.25330 CB 1 -0.851466 0.867410 1.091691 11.00000 0.25330 CG 1 -0.895401 0.914297 1.085439 11.00000 0.34196 CD 1 -0.883020 0.956473 1.095341 11.00000 0.44328 OE1 4 -0.836804 0.954083 1.094995 11.00000 0.44328 OE2 4 -0.925214 0.994602 1.104837 11.00000 0.44328 RESI 8 LEU N 3 -0.800352 0.809770 1.004958 11.00000 0.20264 CA 1 -0.795210 0.806296 0.960182 11.00000 0.20264 C 1 -0.806318 0.764827 0.947579 11.00000 0.25330 O 4 -0.833246 0.768793 0.922335 11.00000 0.25330 CB 1 -0.736807 0.807800 0.933204 11.00000 0.25330 CG 1 -0.730854 0.804696 0.885855 11.00000 0.31663 CD1 1 -0.767289 0.851719 0.874414 11.00000 0.31663 CD2 1 -0.668586 0.787746 0.859791 11.00000 0.31663 RESI 9 ALA N 3 -0.783233 0.724178 0.961547 11.00000 0.20264 CA 1 -0.794272 0.683013 0.950443 11.00000 0.20264 C 1 -0.858306 0.695150 0.962907 11.00000 0.25330 O 4 -0.881731 0.682455 0.940480 11.00000 0.25330 CB 1 -0.766256 0.641421 0.973129 11.00000 0.25330 RESI 10 ALA N 3 -0.888492 0.721009 0.998740 11.00000 0.20264 CA 1 -0.951041 0.734260 1.016691 11.00000 0.20264 C 1 -0.981342 0.768658 0.990174 11.00000 0.25330 O 4 -1.022894 0.766520 0.982305 11.00000 0.25330 CB 1 -0.969875 0.755211 1.061829 11.00000 0.25330 RESI 11 ALA N 3 -0.962422 0.801753 0.976603 11.00000 0.20264 CA 1 -0.990441 0.835014 0.949633 11.00000 0.20264 C 1 -0.978716 0.809861 0.907072 11.00000 0.25330 O 4 -1.015388 0.822846 0.888848 11.00000 0.25330 CB 1 -0.969494 0.874921 0.945587 11.00000 0.25330 RESI 12 MET N 3 -0.925775 0.776243 0.889683 11.00000 0.20264 CA 1 -0.908742 0.752159 0.847011 11.00000 0.20264 C 1 -0.941350 0.720090 0.849123 11.00000 0.25330 O 4 -0.960172 0.715466 0.820217 11.00000 0.25330 CB 1 -0.844019 0.724326 0.830629 11.00000 0.25330 CG 1 -0.812491 0.756265 0.812797 11.00000 0.34196 SD 5 -0.736157 0.717342 0.800894 11.00000 0.34196 CE 1 -0.703030 0.746635 0.762234 11.00000 0.50660 RESI 13 LYS N 3 -0.948165 0.698819 0.883781 11.00000 0.20264 CA 1 -0.981362 0.667790 0.890366 11.00000 0.20264 C 1 -1.041728 0.696692 0.890823 11.00000 0.25330 O 4 -1.064869 0.683743 0.868332 11.00000 0.25330 CB 1 -0.980006 0.643592 0.930251 11.00000 0.25330 CG 1 -0.990656 0.597108 0.929794 11.00000 0.34196 CD 1 -1.017967 0.589262 0.973891 11.00000 0.44328 CE 1 -1.039992 0.550108 0.977817 11.00000 0.56993 NZ 3 -1.000321 0.509152 0.992775 11.00000 0.56993 RESI 14 ARG N 3 -1.068177 0.738942 0.913680 11.00000 0.20264 CA 1 -1.128217 0.769700 0.918913 11.00000 0.20264 C 1 -1.136052 0.785041 0.877708 11.00000 0.25330 O 4 -1.179753 0.793131 0.868036 11.00000 0.25330 CB 1 -1.146156 0.812523 0.950359 11.00000 0.25330 CG 1 -1.206656 0.848135 0.957233 11.00000 0.34196 CD 1 -1.213384 0.894270 0.977786 11.00000 0.44328 NE 3 -1.258878 0.932723 0.967327 11.00000 0.56993 CZ 1 -1.256372 0.975077 0.962613 11.00000 0.56993 NH1 3 -1.212882 0.983314 0.967848 11.00000 0.56993 NH2 3 -1.297424 1.008268 0.951512 11.00000 0.56993 RESI 15 HIS N 3 -1.089265 0.787852 0.851260 11.00000 0.20264 CA 1 -1.089223 0.806503 0.810570 11.00000 0.20264 C 1 -1.072011 0.767931 0.775644 11.00000 0.25330 O 4 -1.062309 0.777243 0.738130 11.00000 0.25330 CB 1 -1.054348 0.837429 0.800439 11.00000 0.25330 CG 1 -1.089669 0.888209 0.817398 11.00000 0.31663 ND1 3 -1.088615 0.909995 0.851953 11.00000 0.31663 CD2 1 -1.128219 0.921716 0.802960 11.00000 0.31663 CE1 1 -1.124706 0.954726 0.858716 11.00000 0.31663 NE2 3 -1.149402 0.962451 0.829062 11.00000 0.31663 RESI 16 GLY N 3 -1.069485 0.726250 0.786630 11.00000 0.20264 CA 1 -1.055516 0.684482 0.760466 11.00000 0.20264 C 1 -0.993864 0.655861 0.735763 11.00000 0.25330 O 4 -0.982871 0.627290 0.704197 11.00000 0.25330 RESI 17 LEU N 3 -0.951051 0.659947 0.745835 11.00000 0.20264 CA 1 -0.891874 0.631628 0.721683 11.00000 0.20264 C 1 -0.866026 0.581604 0.731848 11.00000 0.25330 O 4 -0.821605 0.555640 0.701869 11.00000 0.25330 CB 1 -0.851930 0.657035 0.722880 11.00000 0.25330 CG 1 -0.854350 0.697722 0.697576 11.00000 0.31663 CD1 1 -0.813635 0.718917 0.703630 11.00000 0.31663 CD2 1 -0.842015 0.684628 0.651243 11.00000 0.31663 RESI 18 ASP N 3 -0.884843 0.567064 0.767676 11.00000 0.20264 CA 1 -0.857238 0.516779 0.774982 11.00000 0.20264 C 1 -0.863046 0.484824 0.742974 11.00000 0.25330 O 4 -0.911434 0.490452 0.742357 11.00000 0.25330 CB 1 -0.879408 0.507214 0.819417 11.00000 0.25330 CG 1 -0.851927 0.458514 0.831316 11.00000 0.34196 OD1 4 -0.802449 0.427935 0.813663 11.00000 0.44328 OD2 4 -0.883160 0.448663 0.864008 11.00000 0.44328 RESI 19 ASN N 3 -0.813214 0.451681 0.719950 11.00000 0.20264 CA 1 -0.807650 0.419736 0.685659 11.00000 0.20264 C 1 -0.825390 0.442836 0.649636 11.00000 0.25330 O 4 -0.835838 0.418672 0.625517 11.00000 0.25330 CB 1 -0.840645 0.388980 0.704529 11.00000 0.25330 CG 1 -0.811385 0.355070 0.731867 11.00000 0.34196 OD1 4 -0.840232 0.350240 0.766835 11.00000 0.44328 ND2 3 -0.755235 0.331430 0.716197 11.00000 0.44328 RESI 20 TYR N 3 -0.831800 0.487790 0.645018 11.00000 0.20264 CA 1 -0.845747 0.508208 0.607409 11.00000 0.20264 C 1 -0.796294 0.480106 0.568390 11.00000 0.25330 O 4 -0.746936 0.475223 0.566058 11.00000 0.25330 CB 1 -0.855792 0.561029 0.609890 11.00000 0.25330 CG 1 -0.879903 0.584784 0.576450 11.00000 0.31663 CD1 1 -0.938371 0.601863 0.581845 11.00000 0.31663 CD2 1 -0.842715 0.588518 0.538665 11.00000 0.31663 CE1 1 -0.959041 0.622153 0.549453 11.00000 0.31663 CE2 1 -0.862815 0.608572 0.506332 11.00000 0.31663 CZ 1 -0.920954 0.626130 0.512410 11.00000 0.37995 OH 4 -0.936740 0.644234 0.478954 11.00000 0.37995 RESI 21 ARG N 3 -0.807822 0.461188 0.539008 11.00000 0.20264 CA 1 -0.765374 0.430091 0.501841 11.00000 0.20264 C 1 -0.718715 0.388849 0.511363 11.00000 0.25330 O 4 -0.670254 0.372180 0.484536 11.00000 0.25330 CB 1 -0.735962 0.455321 0.469357 11.00000 0.25330 CG 1 -0.774442 0.494417 0.450613 11.00000 0.34196 CD 1 -0.784669 0.474362 0.415440 11.00000 0.44328 NE 3 -0.815692 0.506562 0.392031 11.00000 0.56993 CZ 1 -0.869958 0.535440 0.401726 11.00000 0.56993 NH1 3 -0.908910 0.540943 0.438990 11.00000 0.56993 NH2 3 -0.887924 0.560372 0.371920 11.00000 0.56993 RESI 22 GLY N 3 -0.733082 0.372351 0.547348 11.00000 0.20264 CA 1 -0.691962 0.330146 0.557795 11.00000 0.20264 C 1 -0.656418 0.340365 0.580662 11.00000 0.25330 O 4 -0.618822 0.307383 0.588947 11.00000 0.25330 RESI 23 TYR N 3 -0.665764 0.385599 0.590139 11.00000 0.20264 CA 1 -0.628515 0.396241 0.610801 11.00000 0.20264 C 1 -0.659108 0.408235 0.657290 11.00000 0.25330 O 4 -0.704278 0.445107 0.671537 11.00000 0.25330 CB 1 -0.612745 0.437378 0.590847 11.00000 0.25330 CG 1 -0.570530 0.422137 0.546994 11.00000 0.31663 CD1 1 -0.511963 0.400683 0.539331 11.00000 0.31663 CD2 1 -0.590713 0.428283 0.512337 11.00000 0.31663 CE1 1 -0.474596 0.385102 0.498179 11.00000 0.31663 CE2 1 -0.554234 0.413359 0.471688 11.00000 0.31663 CZ 1 -0.495360 0.392299 0.464866 11.00000 0.37995 OH 4 -0.460151 0.378163 0.423037 11.00000 0.37995 RESI 24 SER N 3 -0.633480 0.378901 0.680794 11.00000 0.20264 CA 1 -0.660450 0.386750 0.727425 11.00000 0.20264 C 1 -0.660023 0.432069 0.743855 11.00000 0.25330 O 4 -0.626670 0.449667 0.722185 11.00000 0.25330 CB 1 -0.631285 0.342732 0.745483 11.00000 0.25330 OG 4 -0.575477 0.339379 0.742747 11.00000 0.37995 RESI 25 LEU N 3 -0.697525 0.451351 0.782119 11.00000 0.20264 CA 1 -0.703711 0.494868 0.803334 11.00000 0.20264 C 1 -0.646220 0.494705 0.802605 11.00000 0.25330 O 4 -0.636673 0.530997 0.796135 11.00000 0.25330 CB 1 -0.743211 0.505337 0.848214 11.00000 0.25330 CG 1 -0.791608 0.550826 0.867739 11.00000 0.31663 CD1 1 -0.795903 0.562025 0.912949 11.00000 0.31663 CD2 1 -0.793399 0.592200 0.842553 11.00000 0.31663 RESI 26 GLY N 3 -0.611374 0.455565 0.812842 11.00000 0.20264 CA 1 -0.555369 0.451788 0.813577 11.00000 0.20264 C 1 -0.520123 0.463452 0.773340 11.00000 0.25330 O 4 -0.487983 0.483154 0.776938 11.00000 0.25330 RESI 27 ASN N 3 -0.524899 0.452925 0.737679 11.00000 0.20264 CA 1 -0.491437 0.462779 0.697119 11.00000 0.20264 C 1 -0.509478 0.516476 0.696692 11.00000 0.25330 O 4 -0.471201 0.531566 0.684122 11.00000 0.25330 CB 1 -0.501875 0.442227 0.660042 11.00000 0.25330 CG 1 -0.468136 0.388544 0.651050 11.00000 0.34196 OD1 4 -0.416993 0.372823 0.632702 11.00000 0.44328 ND2 3 -0.496313 0.361129 0.664896 11.00000 0.44328 RESI 28 TRP N 3 -0.565034 0.541570 0.710820 11.00000 0.20264 CA 1 -0.590827 0.594288 0.711026 11.00000 0.20264 C 1 -0.575032 0.619204 0.740662 11.00000 0.25330 O 4 -0.561951 0.653680 0.730105 11.00000 0.25330 CB 1 -0.654985 0.609912 0.718975 11.00000 0.25330 CG 1 -0.672017 0.592337 0.686382 11.00000 0.31663 CD1 1 -0.692290 0.557010 0.688059 11.00000 0.31663 CD2 1 -0.666898 0.606936 0.645134 11.00000 0.31663 NE1 3 -0.699330 0.549691 0.649871 11.00000 0.31663 CE2 1 -0.686382 0.580547 0.624007 11.00000 0.31663 CE3 1 -0.651338 0.642180 0.625297 11.00000 0.31663 CZ2 1 -0.689781 0.587851 0.583796 11.00000 0.31663 CZ3 1 -0.654706 0.649485 0.585618 11.00000 0.31663 CH2 1 -0.671852 0.622359 0.564943 11.00000 0.31663 RESI 29 VAL N 3 -0.580163 0.605331 0.778593 11.00000 0.20264 CA 1 -0.564316 0.624055 0.810879 11.00000 0.20264 C 1 -0.501443 0.615144 0.795724 11.00000 0.25330 O 4 -0.485540 0.647810 0.801034 11.00000 0.25330 CB 1 -0.582381 0.606508 0.854060 11.00000 0.25330 CG1 1 -0.561269 0.621698 0.887316 11.00000 0.31663 CG2 1 -0.646139 0.619118 0.871992 11.00000 0.31663 RESI 30 CYS N 3 -0.464691 0.572144 0.776910 11.00000 0.20264 CA 1 -0.403163 0.559007 0.759874 11.00000 0.20264 C 1 -0.389839 0.589528 0.725253 11.00000 0.25330 O 4 -0.354270 0.608018 0.722666 11.00000 0.25330 CB 1 -0.375303 0.504701 0.743679 11.00000 0.25330 SG 5 -0.297938 0.485599 0.723906 11.00000 0.25330 RESI 31 ALA N 3 -0.418337 0.596450 0.697946 11.00000 0.20264 CA 1 -0.408544 0.625068 0.663174 11.00000 0.20264 C 1 -0.423007 0.675721 0.679896 11.00000 0.25330 O 4 -0.391477 0.696749 0.662763 11.00000 0.25330 CB 1 -0.445629 0.628651 0.635172 11.00000 0.25330 RESI 32 ALA N 3 -0.472046 0.694356 0.710754 11.00000 0.20264 CA 1 -0.491832 0.743082 0.729905 11.00000 0.20264 C 1 -0.448101 0.746896 0.748600 11.00000 0.25330 O 4 -0.434173 0.781395 0.743820 11.00000 0.25330 CB 1 -0.549671 0.757226 0.764418 11.00000 0.25330 RESI 33 LYS N 3 -0.430066 0.713213 0.771965 11.00000 0.20264 CA 1 -0.389969 0.714270 0.794203 11.00000 0.20264 C 1 -0.338463 0.718499 0.762551 11.00000 0.25330 O 4 -0.320434 0.750040 0.766691 11.00000 0.25330 CB 1 -0.368792 0.667124 0.812339 11.00000 0.25330 CG 1 -0.316236 0.659502 0.826282 11.00000 0.34196 CD 1 -0.334239 0.697429 0.863031 11.00000 0.44328 CE 1 -0.285139 0.690422 0.879941 11.00000 0.56993 NZ 3 -0.306705 0.730007 0.914461 11.00000 0.56993 RESI 34 PHE N 3 -0.314550 0.687368 0.727791 11.00000 0.20264 CA 1 -0.259905 0.687206 0.697912 11.00000 0.20264 C 1 -0.270280 0.724248 0.668184 11.00000 0.25330 O 4 -0.232292 0.738788 0.650896 11.00000 0.25330 CB 1 -0.219993 0.637120 0.677191 11.00000 0.25330 CG 1 -0.202269 0.604406 0.708779 11.00000 0.31663 CD1 1 -0.214143 0.564399 0.713281 11.00000 0.31663 CD2 1 -0.170087 0.613965 0.731583 11.00000 0.31663 CE1 1 -0.196759 0.533794 0.742205 11.00000 0.31663 CE2 1 -0.152053 0.583447 0.760064 11.00000 0.31663 CZ 1 -0.165012 0.543084 0.764577 11.00000 0.31663 RESI 35 GLU N 3 -0.321287 0.742756 0.661880 11.00000 0.20264 CA 1 -0.328972 0.777763 0.631263 11.00000 0.20264 C 1 -0.341466 0.825875 0.652668 11.00000 0.25330 O 4 -0.318871 0.851858 0.633746 11.00000 0.25330 CB 1 -0.376586 0.780264 0.614515 11.00000 0.25330 CG 1 -0.362706 0.735649 0.583516 11.00000 0.34196 CD 1 -0.319177 0.736441 0.542313 11.00000 0.44328 OE1 4 -0.303556 0.768864 0.535307 11.00000 0.44328 OE2 4 -0.299008 0.700658 0.517294 11.00000 0.44328 RESI 36 SER N 3 -0.375035 0.836807 0.692245 11.00000 0.20264 CA 1 -0.399411 0.884162 0.714534 11.00000 0.20264 C 1 -0.398460 0.888174 0.759132 11.00000 0.25330 O 4 -0.418525 0.928425 0.778535 11.00000 0.25330 CB 1 -0.462076 0.907116 0.716378 11.00000 0.25330 OG 4 -0.495793 0.884603 0.743478 11.00000 0.37995 RESI 37 ASN N 3 -0.378126 0.849090 0.775244 11.00000 0.20264 CA 1 -0.380331 0.846804 0.818860 11.00000 0.20264 C 1 -0.442560 0.870285 0.847277 11.00000 0.25330 O 4 -0.450740 0.893044 0.880249 11.00000 0.25330 CB 1 -0.343083 0.869291 0.828222 11.00000 0.25330 CG 1 -0.321734 0.850649 0.864573 11.00000 0.34196 OD1 4 -0.311529 0.809210 0.872524 11.00000 0.44328 ND2 3 -0.314084 0.882362 0.886060 11.00000 0.44328 RESI 38 PHE N 3 -0.482438 0.867621 0.833705 11.00000 0.20264 CA 1 -0.543653 0.886110 0.859131 11.00000 0.20264 C 1 -0.571978 0.939792 0.864388 11.00000 0.25330 O 4 -0.619217 0.961514 0.893249 11.00000 0.25330 CB 1 -0.549594 0.868447 0.902241 11.00000 0.25330 CG 1 -0.530280 0.815653 0.902810 11.00000 0.31663 CD1 1 -0.536252 0.788527 0.874130 11.00000 0.31663 CD2 1 -0.506724 0.796167 0.934237 11.00000 0.31663 CE1 1 -0.521253 0.740061 0.875719 11.00000 0.31663 CE2 1 -0.492361 0.747140 0.937740 11.00000 0.31663 CZ 1 -0.499790 0.720241 0.907634 11.00000 0.31663 RESI 39 ASN N 3 -0.545619 0.961462 0.837601 11.00000 0.20264 CA 1 -0.570267 1.015278 0.842389 11.00000 0.20264 C 1 -0.601001 1.032077 0.810343 11.00000 0.25330 O 4 -0.570556 1.022960 0.771882 11.00000 0.25330 CB 1 -0.519714 1.031063 0.833278 11.00000 0.25330 CG 1 -0.538924 1.084789 0.839835 11.00000 0.34196 OD1 4 -0.589888 1.110921 0.848542 11.00000 0.44328 ND2 3 -0.497018 1.099274 0.837805 11.00000 0.44328 RESI 40 THR N 3 -0.656193 1.057238 0.823905 11.00000 0.20264 CA 1 -0.686109 1.074757 0.792757 11.00000 0.20264 C 1 -0.665210 1.109206 0.766343 11.00000 0.25330 O 4 -0.676000 1.115407 0.732515 11.00000 0.25330 CB 1 -0.752254 1.100298 0.816133 11.00000 0.25330 OG1 4 -0.759225 1.142406 0.841112 11.00000 0.31663 CG2 1 -0.776420 1.067671 0.842911 11.00000 0.31663 RESI 41 GLN N 3 -0.638361 1.130179 0.780957 11.00000 0.20264 CA 1 -0.624712 1.168081 0.757061 11.00000 0.20264 C 1 -0.565686 1.149615 0.725462 11.00000 0.25330 O 4 -0.545923 1.178280 0.706210 11.00000 0.25330 CB 1 -0.631029 1.207096 0.788737 11.00000 0.25330 CG 1 -0.693432 1.231892 0.815931 11.00000 0.34196 CD 1 -0.702043 1.276643 0.840757 11.00000 0.44328 OE1 4 -0.704459 1.311981 0.822665 11.00000 0.44328 NE2 3 -0.703360 1.273620 0.880054 11.00000 0.44328 RESI 42 ALA N 3 -0.536593 1.103939 0.720107 11.00000 0.20264 CA 1 -0.476965 1.081836 0.690768 11.00000 0.20264 C 1 -0.476390 1.090708 0.645984 11.00000 0.25330 O 4 -0.511480 1.086390 0.631378 11.00000 0.25330 CB 1 -0.450898 1.029261 0.694063 11.00000 0.25330 RESI 43 THR N 3 -0.438113 1.107580 0.625276 11.00000 0.20264 CA 1 -0.424972 1.113349 0.580680 11.00000 0.20264 C 1 -0.360254 1.091224 0.561180 11.00000 0.25330 O 4 -0.329430 1.090279 0.583285 11.00000 0.25330 CB 1 -0.449117 1.166139 0.570615 11.00000 0.25330 OG1 4 -0.425494 1.191434 0.591806 11.00000 0.31663 CG2 1 -0.513438 1.189166 0.584636 11.00000 0.31663 RESI 44 ASN N 3 -0.340610 1.071113 0.522163 11.00000 0.20264 CA 1 -0.278278 1.053419 0.498476 11.00000 0.20264 C 1 -0.270090 1.059890 0.452198 11.00000 0.25330 O 4 -0.296479 1.044776 0.435589 11.00000 0.25330 CB 1 -0.250216 1.000905 0.503223 11.00000 0.25330 CG 1 -0.246079 0.993679 0.547493 11.00000 0.34196 OD1 4 -0.215527 1.008155 0.560660 11.00000 0.44328 ND2 3 -0.275132 0.969896 0.570337 11.00000 0.44328 RESI 45 ARG N 3 -0.233897 1.078077 0.433035 11.00000 0.20264 CA 1 -0.224863 1.086448 0.387276 11.00000 0.20264 C 1 -0.175399 1.042423 0.360887 11.00000 0.25330 O 4 -0.135215 1.023083 0.374727 11.00000 0.25330 CB 1 -0.209192 1.129126 0.381263 11.00000 0.25330 CG 1 -0.204200 1.150376 0.340616 11.00000 0.34196 CD 1 -0.261867 1.181301 0.338417 11.00000 0.44328 NE 3 -0.260097 1.220790 0.313989 11.00000 0.56993 CZ 1 -0.259045 1.258859 0.332475 11.00000 0.56993 NH1 3 -0.258587 1.259759 0.372117 11.00000 0.56993 NH2 3 -0.260535 1.295367 0.310930 11.00000 0.56993 RESI 46 ASN N 3 -0.179275 1.028402 0.325356 11.00000 0.20264 CA 1 -0.135065 0.990761 0.293984 11.00000 0.20264 C 1 -0.102874 1.010549 0.257400 11.00000 0.25330 O 4 -0.123185 1.051357 0.249631 11.00000 0.25330 CB 1 -0.161054 0.960986 0.276801 11.00000 0.25330 CG 1 -0.202670 0.949288 0.313559 11.00000 0.34196 OD1 4 -0.251999 0.957528 0.314409 11.00000 0.44328 ND2 3 -0.180540 0.929519 0.342341 11.00000 0.44328 RESI 47 THR N 3 -0.052923 0.978200 0.234529 11.00000 0.20264 CA 1 -0.014524 0.989615 0.198706 11.00000 0.20264 C 1 -0.043088 1.006830 0.165454 11.00000 0.25330 O 4 -0.031778 1.037287 0.144670 11.00000 0.25330 CB 1 0.045226 0.947046 0.181138 11.00000 0.25330 OG1 4 0.034676 0.910389 0.162289 11.00000 0.31663 CG2 1 0.073762 0.927656 0.214431 11.00000 0.31663 RESI 48 ASP N 3 -0.079733 0.989065 0.161260 11.00000 0.20264 CA 1 -0.106881 1.003348 0.128100 11.00000 0.20264 C 1 -0.154274 1.052560 0.140036 11.00000 0.25330 O 4 -0.179825 1.071259 0.115039 11.00000 0.25330 CB 1 -0.126169 0.965695 0.116520 11.00000 0.25330 CG 1 -0.173877 0.963008 0.153888 11.00000 0.34196 OD1 4 -0.185281 0.985030 0.188359 11.00000 0.44328 OD2 4 -0.200603 0.939721 0.148444 11.00000 0.44328 RESI 49 GLY N 3 -0.166263 1.074320 0.177359 11.00000 0.20264 CA 1 -0.208693 1.121028 0.193861 11.00000 0.20264 C 1 -0.267164 1.121568 0.220081 11.00000 0.25330 O 4 -0.306388 1.161141 0.232955 11.00000 0.25330 RESI 50 SER N 3 -0.274015 1.081858 0.225571 11.00000 0.20264 CA 1 -0.328232 1.078935 0.250924 11.00000 0.20264 C 1 -0.329992 1.082544 0.296860 11.00000 0.25330 O 4 -0.284461 1.077196 0.303224 11.00000 0.25330 CB 1 -0.330542 1.031553 0.239489 11.00000 0.25330 OG 4 -0.280667 0.993472 0.245095 11.00000 0.37995 RESI 51 THR N 3 -0.379735 1.088706 0.326177 11.00000 0.20264 CA 1 -0.380851 1.090626 0.371268 11.00000 0.20264 C 1 -0.413144 1.060877 0.392444 11.00000 0.25330 O 4 -0.452292 1.062401 0.378881 11.00000 0.25330 CB 1 -0.411580 1.142913 0.392842 11.00000 0.25330 OG1 4 -0.378031 1.168015 0.367796 11.00000 0.31663 CG2 1 -0.413399 1.149746 0.438423 11.00000 0.31663 RESI 52 ASP N 3 -0.396066 1.038013 0.421968 11.00000 0.20264 CA 1 -0.421836 1.007168 0.447376 11.00000 0.20264 C 1 -0.459719 1.035410 0.490206 11.00000 0.25330 O 4 -0.442014 1.059428 0.507261 11.00000 0.25330 CB 1 -0.374583 0.963593 0.454088 11.00000 0.25330 CG 1 -0.335561 0.932106 0.413824 11.00000 0.34196 OD1 4 -0.350728 0.931015 0.382748 11.00000 0.44328 OD2 4 -0.287045 0.907262 0.414795 11.00000 0.44328 RESI 53 TYR N 3 -0.509988 1.032380 0.505990 11.00000 0.20264 CA 1 -0.553228 1.065039 0.542501 11.00000 0.20264 C 1 -0.580827 1.039505 0.575534 11.00000 0.25330 O 4 -0.596655 1.010120 0.565208 11.00000 0.25330 CB 1 -0.602650 1.099968 0.528367 11.00000 0.25330 CG 1 -0.589141 1.134668 0.501232 11.00000 0.31663 CD1 1 -0.598785 1.179709 0.518655 11.00000 0.31663 CD2 1 -0.565748 1.124922 0.457454 11.00000 0.31663 CE1 1 -0.584628 1.211353 0.492840 11.00000 0.31663 CE2 1 -0.550730 1.156814 0.432161 11.00000 0.31663 CZ 1 -0.561099 1.201354 0.451156 11.00000 0.37995 OH 4 -0.545293 1.230801 0.424616 11.00000 0.37995 RESI 54 GLY N 3 -0.584564 1.052331 0.614354 11.00000 0.20264 CA 1 -0.622975 1.039587 0.649149 11.00000 0.20264 C 1 -0.591491 0.992292 0.661947 11.00000 0.25330 O 4 -0.539367 0.969420 0.646401 11.00000 0.25330 RESI 55 ILE N 3 -0.627477 0.979610 0.690937 11.00000 0.20264 CA 1 -0.609557 0.935238 0.709184 11.00000 0.20264 C 1 -0.577239 0.892930 0.677303 11.00000 0.25330 O 4 -0.539479 0.858858 0.687185 11.00000 0.25330 CB 1 -0.664853 0.934013 0.744077 11.00000 0.25330 CG1 1 -0.647330 0.899761 0.775204 11.00000 0.31663 CG2 1 -0.705982 0.925572 0.724283 11.00000 0.31663 CD1 1 -0.655059 0.922048 0.818524 11.00000 0.31663 RESI 56 LEU N 3 -0.587833 0.891932 0.641905 11.00000 0.20264 CA 1 -0.559682 0.850417 0.610088 11.00000 0.20264 C 1 -0.521654 0.858791 0.569308 11.00000 0.25330 O 4 -0.498858 0.829551 0.536958 11.00000 0.25330 CB 1 -0.604747 0.834732 0.603612 11.00000 0.25330 CG 1 -0.626608 0.807649 0.639355 11.00000 0.31663 CD1 1 -0.676116 0.798164 0.634238 11.00000 0.31663 CD2 1 -0.576596 0.762572 0.639295 11.00000 0.31663 RESI 57 GLN N 3 -0.513203 0.898182 0.572060 11.00000 0.20264 CA 1 -0.475176 0.911049 0.537143 11.00000 0.20264 C 1 -0.484595 0.902967 0.495914 11.00000 0.25330 O 4 -0.444686 0.877342 0.465752 11.00000 0.25330 CB 1 -0.412926 0.882388 0.534417 11.00000 0.25330 CG 1 -0.399687 0.898358 0.572364 11.00000 0.34196 CD 1 -0.399841 0.947426 0.571524 11.00000 0.44328 OE1 4 -0.355499 0.953580 0.553277 11.00000 0.44328 NE2 3 -0.447871 0.984393 0.592268 11.00000 0.44328 RESI 58 ILE N 3 -0.535724 0.928015 0.493932 11.00000 0.20264 CA 1 -0.551006 0.924889 0.456173 11.00000 0.20264 C 1 -0.532381 0.958003 0.426093 11.00000 0.25330 O 4 -0.540146 0.997290 0.439488 11.00000 0.25330 CB 1 -0.616529 0.938294 0.470052 11.00000 0.25330 CG1 1 -0.628260 0.899503 0.497281 11.00000 0.31663 CG2 1 -0.637073 0.943080 0.430931 11.00000 0.31663 CD1 1 -0.694548 0.915666 0.518036 11.00000 0.31663 RESI 59 ASN N 3 -0.509629 0.939972 0.386728 11.00000 0.20264 CA 1 -0.476223 0.959832 0.354137 11.00000 0.20264 C 1 -0.513197 0.994311 0.331208 11.00000 0.25330 O 4 -0.548069 0.984860 0.319558 11.00000 0.25330 CB 1 -0.425423 0.918355 0.324069 11.00000 0.25330 CG 1 -0.384941 0.935029 0.291274 11.00000 0.34196 OD1 4 -0.390857 0.941180 0.256592 11.00000 0.44328 ND2 3 -0.347883 0.947610 0.301768 11.00000 0.44328 RESI 60 SER N 3 -0.502694 1.033346 0.325784 11.00000 0.20264 CA 1 -0.532228 1.072387 0.304902 11.00000 0.20264 C 1 -0.518238 1.061565 0.257859 11.00000 0.25330 O 4 -0.551126 1.088434 0.239459 11.00000 0.25330 CB 1 -0.522949 1.116641 0.315228 11.00000 0.25330 OG 4 -0.466999 1.112789 0.293356 11.00000 0.37995 RESI 61 ARG N 3 -0.473396 1.024395 0.237050 11.00000 0.20264 CA 1 -0.459465 1.010312 0.191145 11.00000 0.20264 C 1 -0.504233 0.995395 0.183538 11.00000 0.25330 O 4 -0.523846 1.007320 0.153263 11.00000 0.25330 CB 1 -0.399791 0.972045 0.174218 11.00000 0.25330 CG 1 -0.373193 0.961339 0.126726 11.00000 0.34196 CD 1 -0.374466 1.004295 0.105813 11.00000 0.44328 NE 3 -0.321182 1.010596 0.089929 11.00000 0.56993 CZ 1 -0.288986 1.016113 0.111122 11.00000 0.56993 NH1 3 -0.301253 1.016216 0.152468 11.00000 0.56993 NH2 3 -0.241067 1.021925 0.090375 11.00000 0.56993 RESI 62 TRP N 3 -0.526066 0.970509 0.211080 11.00000 0.20264 CA 1 -0.567379 0.954016 0.202293 11.00000 0.20264 C 1 -0.627142 0.973599 0.232800 11.00000 0.25330 O 4 -0.668118 0.974427 0.222319 11.00000 0.25330 CB 1 -0.545444 0.899522 0.204535 11.00000 0.25330 CG 1 -0.482979 0.876871 0.182179 11.00000 0.31663 CD1 1 -0.438452 0.865077 0.197894 11.00000 0.31663 CD2 1 -0.458460 0.864645 0.137400 11.00000 0.31663 NE1 3 -0.387298 0.846056 0.165612 11.00000 0.31663 CE2 1 -0.398546 0.845762 0.128372 11.00000 0.31663 CE3 1 -0.482526 0.869138 0.105313 11.00000 0.31663 CZ2 1 -0.361663 0.830236 0.087659 11.00000 0.31663 CZ3 1 -0.445770 0.853451 0.064729 11.00000 0.31663 CH2 1 -0.386618 0.834512 0.056114 11.00000 0.31663 RESI 63 TRP N 3 -0.630571 0.984548 0.272030 11.00000 0.20264 CA 1 -0.681196 0.985887 0.306437 11.00000 0.20264 C 1 -0.722421 1.034276 0.327675 11.00000 0.25330 O 4 -0.774370 1.041090 0.342998 11.00000 0.25330 CB 1 -0.660527 0.951408 0.337851 11.00000 0.25330 CG 1 -0.622310 0.902652 0.316358 11.00000 0.31663 CD1 1 -0.564274 0.881962 0.305414 11.00000 0.31663 CD2 1 -0.640599 0.869875 0.301155 11.00000 0.31663 NE1 3 -0.544997 0.836437 0.286037 11.00000 0.31663 CE2 1 -0.591204 0.828702 0.282605 11.00000 0.31663 CE3 1 -0.693814 0.872118 0.301215 11.00000 0.31663 CZ2 1 -0.593981 0.789626 0.264827 11.00000 0.31663 CZ3 1 -0.697226 0.832745 0.284413 11.00000 0.31663 CH2 1 -0.646942 0.791588 0.265667 11.00000 0.31663 RESI 64 CYS N 3 -0.704234 1.067855 0.329930 11.00000 0.20264 CA 1 -0.745841 1.115946 0.351861 11.00000 0.20264 C 1 -0.728195 1.152863 0.328592 11.00000 0.25330 O 4 -0.680184 1.142412 0.303372 11.00000 0.25330 CB 1 -0.748385 1.118038 0.397777 11.00000 0.25330 SG 5 -0.679692 1.111594 0.403388 11.00000 0.25330 RESI 65 ASN N 3 -0.767441 1.196989 0.336508 11.00000 0.20264 CA 1 -0.754829 1.235349 0.315622 11.00000 0.20264 C 1 -0.743184 1.265312 0.345055 11.00000 0.25330 O 4 -0.778836 1.280722 0.380785 11.00000 0.25330 CB 1 -0.805969 1.265887 0.300517 11.00000 0.25330 CG 1 -0.792597 1.308184 0.283362 11.00000 0.34196 OD1 4 -0.753325 1.302015 0.250663 11.00000 0.44328 ND2 3 -0.822602 1.349609 0.306784 11.00000 0.44328 RESI 66 ASP N 3 -0.694887 1.271217 0.331184 11.00000 0.20264 CA 1 -0.676670 1.299892 0.352908 11.00000 0.20264 C 1 -0.667838 1.341311 0.329508 11.00000 0.25330 O 4 -0.649355 1.367123 0.344923 11.00000 0.25330 CB 1 -0.622154 1.271529 0.363003 11.00000 0.25330 CG 1 -0.566768 1.249071 0.329262 11.00000 0.34196 OD1 4 -0.559113 1.252460 0.291693 11.00000 0.44328 OD2 4 -0.525675 1.222762 0.342182 11.00000 0.44328 RESI 67 GLY N 3 -0.676868 1.345991 0.294451 11.00000 0.20264 CA 1 -0.674348 1.381947 0.266903 11.00000 0.20264 C 1 -0.615362 1.380264 0.245905 11.00000 0.25330 O 4 -0.608447 1.413244 0.225773 11.00000 0.25330 RESI 68 ARG N 3 -0.571781 1.342416 0.249248 11.00000 0.20264 CA 1 -0.513972 1.338243 0.230489 11.00000 0.20264 C 1 -0.472892 1.290583 0.206498 11.00000 0.25330 O 4 -0.421765 1.281003 0.200697 11.00000 0.25330 CB 1 -0.490878 1.350734 0.262926 11.00000 0.25330 RESI 69 THR N 3 -0.492169 1.261907 0.194477 11.00000 0.20264 CA 1 -0.455115 1.214455 0.171707 11.00000 0.20264 C 1 -0.468300 1.213958 0.130043 11.00000 0.25330 O 4 -0.506156 1.201149 0.127780 11.00000 0.25330 CB 1 -0.463246 1.172613 0.196165 11.00000 0.25330 OG1 4 -0.471562 1.182140 0.240851 11.00000 0.31663 CG2 1 -0.414740 1.123686 0.179903 11.00000 0.31663 RESI 70 PRO N 3 -0.441192 1.231478 0.099451 11.00000 0.20264 CA 1 -0.448283 1.232789 0.057918 11.00000 0.20264 C 1 -0.450073 1.186709 0.043784 11.00000 0.25330 O 4 -0.411877 1.147443 0.043238 11.00000 0.25330 CB 1 -0.397330 1.241359 0.029100 11.00000 0.25330 CG 1 -0.362639 1.244382 0.055846 11.00000 0.37995 CD 1 -0.401576 1.254211 0.101194 11.00000 0.25330 RESI 71 GLY N 3 -0.495658 1.193046 0.032352 11.00000 0.20264 CA 1 -0.507110 1.153400 0.019713 11.00000 0.20264 C 1 -0.514433 1.120544 0.053168 11.00000 0.25330 O 4 -0.490236 1.077171 0.043310 11.00000 0.25330 RESI 72 SER N 3 -0.546658 1.139368 0.091201 11.00000 0.20264 CA 1 -0.564898 1.111731 0.125510 11.00000 0.20264 C 1 -0.613425 1.103449 0.115314 11.00000 0.25330 O 4 -0.639815 1.131824 0.094446 11.00000 0.25330 CB 1 -0.581293 1.139169 0.167194 11.00000 0.25330 OG 4 -0.619654 1.130566 0.203819 11.00000 0.37995 RESI 73 ARG N 3 -0.625513 1.067139 0.128465 11.00000 0.20264 CA 1 -0.672544 1.057405 0.121076 11.00000 0.20264 C 1 -0.727457 1.071988 0.157220 11.00000 0.25330 O 4 -0.773808 1.075365 0.150872 11.00000 0.25330 CB 1 -0.647802 1.005335 0.103304 11.00000 0.25330 RESI 74 ASN N 3 -0.732116 1.085933 0.194949 11.00000 0.20264 CA 1 -0.780214 1.099267 0.233887 11.00000 0.20264 C 1 -0.811999 1.066146 0.241093 11.00000 0.25330 O 4 -0.864302 1.082853 0.249283 11.00000 0.25330 CB 1 -0.819827 1.151708 0.241149 11.00000 0.25330 CG 1 -0.859134 1.167662 0.286039 11.00000 0.34196 OD1 4 -0.850885 1.143985 0.314826 11.00000 0.44328 ND2 3 -0.905487 1.208310 0.295341 11.00000 0.44328 RESI 75 LEU N 3 -0.784510 1.020739 0.242691 11.00000 0.20264 CA 1 -0.811520 0.986256 0.245453 11.00000 0.20264 C 1 -0.857998 0.991719 0.286220 11.00000 0.25330 O 4 -0.900230 0.983172 0.286354 11.00000 0.25330 CB 1 -0.762996 0.937037 0.232068 11.00000 0.25330 CG 1 -0.751009 0.911351 0.190258 11.00000 0.31663 CD1 1 -0.778847 0.942630 0.161292 11.00000 0.31663 CD2 1 -0.686550 0.885603 0.170211 11.00000 0.31663 RESI 76 CYS N 3 -0.855215 1.006941 0.321849 11.00000 0.20264 CA 1 -0.898817 1.016018 0.362172 11.00000 0.20264 C 1 -0.945246 1.065872 0.370378 11.00000 0.25330 O 4 -0.984053 1.074776 0.404345 11.00000 0.25330 CB 1 -0.873583 1.006470 0.398020 11.00000 0.25330 SG 5 -0.823692 0.946389 0.393983 11.00000 0.25330 RESI 77 ASN N 3 -0.941708 1.095632 0.341906 11.00000 0.20264 CA 1 -0.987840 1.142705 0.347118 11.00000 0.20264 C 1 -1.002122 1.173028 0.387117 11.00000 0.25330 O 4 -1.052976 1.191895 0.410421 11.00000 0.25330 CB 1 -1.043453 1.137128 0.346070 11.00000 0.25330 CG 1 -1.078728 1.181298 0.329970 11.00000 0.34196 OD1 4 -1.055050 1.201671 0.303055 11.00000 0.44328 ND2 3 -1.135284 1.195969 0.346428 11.00000 0.44328 RESI 78 ILE N 3 -0.960211 1.179820 0.394528 11.00000 0.20264 CA 1 -0.966921 1.201872 0.435745 11.00000 0.20264 C 1 -0.920208 1.222085 0.427055 11.00000 0.25330 O 4 -0.874152 1.201341 0.399014 11.00000 0.25330 CB 1 -0.955927 1.160559 0.464232 11.00000 0.25330 CG1 1 -0.987717 1.178448 0.510959 11.00000 0.31663 CG2 1 -0.892552 1.129449 0.459129 11.00000 0.31663 CD1 1 -1.052278 1.193935 0.522446 11.00000 0.31663 RESI 79 PRO N 3 -0.934245 1.261632 0.449413 11.00000 0.20264 CA 1 -0.891427 1.281261 0.448514 11.00000 0.20264 C 1 -0.852458 1.248533 0.471044 11.00000 0.25330 O 4 -0.876365 1.234897 0.503783 11.00000 0.25330 CB 1 -0.925484 1.328450 0.475325 11.00000 0.25330 CG 1 -0.985360 1.332796 0.493881 11.00000 0.37995 CD 1 -0.989876 1.287436 0.481613 11.00000 0.25330 RESI 80 CYS N 3 -0.797149 1.239448 0.455951 11.00000 0.20264 CA 1 -0.758019 1.206584 0.476355 11.00000 0.20264 C 1 -0.774395 1.225147 0.521669 11.00000 0.25330 O 4 -0.764939 1.198997 0.550049 11.00000 0.25330 CB 1 -0.697169 1.203635 0.451782 11.00000 0.25330 SG 5 -0.673427 1.177215 0.397149 11.00000 0.25330 RESI 81 SER N 3 -0.800445 1.272282 0.529464 11.00000 0.20264 CA 1 -0.818144 1.294541 0.572993 11.00000 0.20264 C 1 -0.857243 1.276023 0.603720 11.00000 0.25330 O 4 -0.855430 1.273589 0.640923 11.00000 0.25330 CB 1 -0.843489 1.348809 0.576159 11.00000 0.25330 OG 4 -0.893644 1.365782 0.565881 11.00000 0.37995 RESI 82 ALA N 3 -0.892240 1.264065 0.590109 11.00000 0.20264 CA 1 -0.932243 1.245259 0.617593 11.00000 0.20264 C 1 -0.900545 1.198699 0.632512 11.00000 0.25330 O 4 -0.926040 1.185733 0.664262 11.00000 0.25330 CB 1 -0.968339 1.236862 0.593098 11.00000 0.25330 RESI 83 LEU N 3 -0.846884 1.172667 0.610211 11.00000 0.20264 CA 1 -0.812505 1.127750 0.621444 11.00000 0.20264 C 1 -0.786974 1.132045 0.655611 11.00000 0.25330 O 4 -0.757057 1.095367 0.666599 11.00000 0.25330 CB 1 -0.763908 1.100237 0.581586 11.00000 0.25330 CG 1 -0.783991 1.093934 0.545005 11.00000 0.31663 CD1 1 -0.732914 1.065539 0.507443 11.00000 0.31663 CD2 1 -0.824141 1.067770 0.560322 11.00000 0.31663 RESI 84 LEU N 3 -0.796182 1.174588 0.670037 11.00000 0.20264 CA 1 -0.773923 1.183219 0.702559 11.00000 0.20264 C 1 -0.820254 1.197765 0.745573 11.00000 0.25330 O 4 -0.805939 1.204464 0.776291 11.00000 0.25330 CB 1 -0.754141 1.224218 0.689982 11.00000 0.25330 CG 1 -0.706061 1.212728 0.647411 11.00000 0.31663 CD1 1 -0.680864 1.249628 0.641434 11.00000 0.31663 CD2 1 -0.660071 1.164557 0.648865 11.00000 0.31663 RESI 85 SER N 3 -0.871671 1.204640 0.747633 11.00000 0.20264 CA 1 -0.920120 1.221386 0.787405 11.00000 0.20264 C 1 -0.913538 1.188392 0.820556 11.00000 0.25330 O 4 -0.882465 1.145295 0.811985 11.00000 0.25330 CB 1 -0.974470 1.227217 0.776235 11.00000 0.25330 OG 4 -1.019577 1.233078 0.814613 11.00000 0.37995 RESI 86 SER N 3 -0.945910 1.206971 0.860219 11.00000 0.20264 CA 1 -0.943041 1.175691 0.894271 11.00000 0.20264 C 1 -0.974972 1.144002 0.893342 11.00000 0.25330 O 4 -0.964550 1.106549 0.910782 11.00000 0.25330 CB 1 -0.962993 1.204193 0.936699 11.00000 0.25330 OG 4 -1.016421 1.242490 0.943662 11.00000 0.37995 RESI 87 ASP N 3 -1.014706 1.158323 0.875515 11.00000 0.20264 CA 1 -1.045764 1.130234 0.867405 11.00000 0.20264 C 1 -1.007131 1.097083 0.826526 11.00000 0.25330 O 4 -0.999242 1.116596 0.793429 11.00000 0.25330 CB 1 -1.101784 1.163446 0.860587 11.00000 0.25330 CG 1 -1.137551 1.138339 0.852099 11.00000 0.34196 OD1 4 -1.118353 1.097298 0.834488 11.00000 0.44328 OD2 4 -1.190875 1.161318 0.864215 11.00000 0.44328 RESI 88 ILE N 3 -0.989193 1.051147 0.827174 11.00000 0.20264 CA 1 -0.947004 1.019345 0.788387 11.00000 0.20264 C 1 -0.974649 1.007236 0.760145 11.00000 0.25330 O 4 -0.947611 0.978102 0.727353 11.00000 0.25330 CB 1 -0.908623 0.971795 0.802441 11.00000 0.25330 CG1 1 -0.950750 0.950157 0.828796 11.00000 0.31663 CG2 1 -0.871629 0.979535 0.826712 11.00000 0.31663 CD1 1 -0.924667 0.896136 0.827217 11.00000 0.31663 RESI 89 THR N 3 -1.031368 1.028946 0.772107 11.00000 0.20264 CA 1 -1.060498 1.019091 0.743962 11.00000 0.20264 C 1 -1.033232 1.021369 0.698418 11.00000 0.25330 O 4 -1.024273 0.989438 0.671884 11.00000 0.25330 CB 1 -1.126704 1.052091 0.760400 11.00000 0.25330 OG1 4 -1.145181 1.040857 0.803217 11.00000 0.31663 CG2 1 -1.160437 1.044918 0.733598 11.00000 0.31663 RESI 90 ALA N 3 -1.018025 1.057115 0.685117 11.00000 0.20264 CA 1 -0.998658 1.058557 0.638891 11.00000 0.20264 C 1 -0.940458 1.018815 0.619355 11.00000 0.25330 O 4 -0.925486 0.997544 0.583756 11.00000 0.25330 CB 1 -1.001110 1.107553 0.629002 11.00000 0.25330 RESI 91 SER N 3 -0.906999 1.008991 0.643065 11.00000 0.20264 CA 1 -0.848007 0.972230 0.628546 11.00000 0.20264 C 1 -0.849730 0.923737 0.621488 11.00000 0.25330 O 4 -0.817005 0.895983 0.589330 11.00000 0.25330 CB 1 -0.818644 0.973239 0.660004 11.00000 0.25330 OG 4 -0.788675 1.003530 0.649791 11.00000 0.37995 RESI 92 VAL N 3 -0.884156 0.911763 0.652338 11.00000 0.20264 CA 1 -0.892339 0.867463 0.649665 11.00000 0.20264 C 1 -0.913507 0.862797 0.613555 11.00000 0.25330 O 4 -0.890406 0.824601 0.590116 11.00000 0.25330 CB 1 -0.933678 0.863224 0.691832 11.00000 0.25330 CG1 1 -0.953586 0.823059 0.687677 11.00000 0.31663 CG2 1 -0.905729 0.855463 0.725368 11.00000 0.31663 RESI 93 ASN N 3 -0.957347 0.899173 0.608906 11.00000 0.20264 CA 1 -0.980895 0.898778 0.574645 11.00000 0.20264 C 1 -0.935834 0.889373 0.531748 11.00000 0.25330 O 4 -0.932919 0.861076 0.503686 11.00000 0.25330 CB 1 -1.035560 0.942479 0.579159 11.00000 0.25330 CG 1 -1.085180 0.943024 0.617125 11.00000 0.34196 OD1 4 -1.131531 0.977677 0.626293 11.00000 0.44328 ND2 3 -1.076471 0.906920 0.639577 11.00000 0.44328 RESI 94 CYS N 3 -0.900495 0.911344 0.526493 11.00000 0.20264 CA 1 -0.853758 0.902964 0.485985 11.00000 0.20264 C 1 -0.807156 0.853542 0.478120 11.00000 0.25330 O 4 -0.782138 0.828531 0.443077 11.00000 0.25330 CB 1 -0.831176 0.942731 0.486991 11.00000 0.25330 SG 5 -0.781960 0.942359 0.436645 11.00000 0.25330 RESI 95 ALA N 3 -0.793060 0.837343 0.511427 11.00000 0.20264 CA 1 -0.749083 0.790423 0.510705 11.00000 0.20264 C 1 -0.765817 0.752484 0.495759 11.00000 0.25330 O 4 -0.729240 0.717672 0.471288 11.00000 0.25330 CB 1 -0.744277 0.785493 0.554773 11.00000 0.25330 RESI 96 LYS N 3 -0.820969 0.759583 0.510982 11.00000 0.20264 CA 1 -0.843836 0.727359 0.497785 11.00000 0.20264 C 1 -0.831316 0.723447 0.450698 11.00000 0.25330 O 4 -0.813245 0.684023 0.430714 11.00000 0.25330 CB 1 -0.906773 0.740759 0.520117 11.00000 0.25330 CG 1 -0.920795 0.730148 0.566427 11.00000 0.34196 CD 1 -0.985650 0.754111 0.587360 11.00000 0.44328 CE 1 -0.999307 0.733995 0.630325 11.00000 0.56993 NZ 3 -1.060041 0.762334 0.654709 11.00000 0.56993 RESI 97 LYS N 3 -0.839961 0.762061 0.431301 11.00000 0.20264 CA 1 -0.821720 0.760101 0.385191 11.00000 0.20264 C 1 -0.757257 0.736606 0.364353 11.00000 0.25330 O 4 -0.735648 0.709476 0.331255 11.00000 0.25330 CB 1 -0.841413 0.811064 0.373062 11.00000 0.25330 CG 1 -0.881030 0.820515 0.346215 11.00000 0.34196 CD 1 -0.941679 0.853957 0.371987 11.00000 0.44328 CE 1 -0.941899 0.900284 0.387012 11.00000 0.56993 NZ 3 -0.999733 0.935021 0.411003 11.00000 0.56993 RESI 98 ILE N 3 -0.723172 0.745987 0.381951 11.00000 0.20264 CA 1 -0.659831 0.722274 0.362188 11.00000 0.20264 C 1 -0.639607 0.669265 0.362686 11.00000 0.25330 O 4 -0.606728 0.642192 0.330619 11.00000 0.25330 CB 1 -0.625899 0.741245 0.383785 11.00000 0.25330 CG1 1 -0.644651 0.794275 0.383649 11.00000 0.31663 CG2 1 -0.560466 0.712150 0.363898 11.00000 0.31663 CD1 1 -0.630267 0.821124 0.413884 11.00000 0.31663 RESI 99 VAL N 3 -0.658616 0.654756 0.399828 11.00000 0.20264 CA 1 -0.637446 0.603760 0.403314 11.00000 0.20264 C 1 -0.656205 0.579379 0.374669 11.00000 0.25330 O 4 -0.629793 0.535826 0.363074 11.00000 0.25330 CB 1 -0.654674 0.594195 0.449428 11.00000 0.25330 CG1 1 -0.715949 0.600194 0.467239 11.00000 0.31663 CG2 1 -0.614307 0.545551 0.455559 11.00000 0.31663 RESI 100 SER N 3 -0.700185 0.606131 0.363365 11.00000 0.20264 CA 1 -0.723603 0.585008 0.337781 11.00000 0.20264 C 1 -0.693760 0.582111 0.290733 11.00000 0.25330 O 4 -0.705691 0.561283 0.266114 11.00000 0.25330 CB 1 -0.787484 0.613717 0.346055 11.00000 0.25330 OG 4 -0.817233 0.609893 0.387936 11.00000 0.37995 RESI 101 ASP N 3 -0.656632 0.601802 0.279530 11.00000 0.20264 CA 1 -0.629851 0.609243 0.236658 11.00000 0.20264 C 1 -0.583513 0.564886 0.208953 11.00000 0.25330 O 4 -0.559328 0.570292 0.171864 11.00000 0.25330 CB 1 -0.605668 0.646916 0.239318 11.00000 0.25330 CG 1 -0.600411 0.673910 0.201462 11.00000 0.34196 OD1 4 -0.554981 0.678843 0.183773 11.00000 0.44328 OD2 4 -0.643235 0.690363 0.189312 11.00000 0.44328 RESI 102 GLY N 3 -0.569690 0.524853 0.225341 11.00000 0.20264 CA 1 -0.527314 0.480560 0.198544 11.00000 0.20264 C 1 -0.474256 0.457419 0.211540 11.00000 0.25330 O 4 -0.449359 0.413381 0.203555 11.00000 0.25330 RESI 103 ASN N 3 -0.454060 0.482471 0.229664 11.00000 0.20264 CA 1 -0.404652 0.458119 0.244571 11.00000 0.20264 C 1 -0.420771 0.455922 0.291868 11.00000 0.25330 O 4 -0.381328 0.440751 0.307513 11.00000 0.25330 CB 1 -0.357108 0.476226 0.227003 11.00000 0.25330 CG 1 -0.343857 0.474528 0.179339 11.00000 0.34196 OD1 4 -0.307844 0.438627 0.156502 11.00000 0.44328 ND2 3 -0.375105 0.512769 0.165572 11.00000 0.44328 RESI 104 GLY N 3 -0.475005 0.467642 0.313884 11.00000 0.20264 CA 1 -0.492126 0.464699 0.360097 11.00000 0.20264 C 1 -0.471677 0.496190 0.381228 11.00000 0.25330 O 4 -0.469841 0.531851 0.365695 11.00000 0.25330 RESI 105 MET N 3 -0.455702 0.479515 0.413772 11.00000 0.20264 CA 1 -0.435504 0.503928 0.438839 11.00000 0.20264 C 1 -0.377534 0.504492 0.417591 11.00000 0.25330 O 4 -0.361424 0.531173 0.434649 11.00000 0.25330 CB 1 -0.442370 0.487489 0.482485 11.00000 0.25330 CG 1 -0.504411 0.506490 0.507290 11.00000 0.34196 SD 5 -0.515036 0.508530 0.563905 11.00000 0.34196 CE 1 -0.490862 0.556398 0.568715 11.00000 0.50660 RESI 106 ASN N 3 -0.347176 0.477915 0.380822 11.00000 0.20264 CA 1 -0.291041 0.476973 0.355935 11.00000 0.20264 C 1 -0.295583 0.525885 0.342000 11.00000 0.25330 O 4 -0.251171 0.533489 0.331063 11.00000 0.25330 CB 1 -0.260752 0.439371 0.317925 11.00000 0.25330 CG 1 -0.246614 0.389611 0.330346 11.00000 0.34196 OD1 4 -0.211245 0.371704 0.348347 11.00000 0.44328 ND2 3 -0.275529 0.366109 0.320669 11.00000 0.44328 RESI 107 ALA N 3 -0.345470 0.556614 0.342269 11.00000 0.20264 CA 1 -0.355160 0.605731 0.334692 11.00000 0.20264 C 1 -0.339904 0.629391 0.366309 11.00000 0.25330 O 4 -0.329702 0.664777 0.358524 11.00000 0.25330 CB 1 -0.418500 0.633419 0.339432 11.00000 0.25330 RESI 108 TRP N 3 -0.337767 0.610654 0.401946 11.00000 0.20264 CA 1 -0.325480 0.633199 0.434311 11.00000 0.20264 C 1 -0.264523 0.603978 0.432723 11.00000 0.25330 O 4 -0.257609 0.566612 0.447220 11.00000 0.25330 CB 1 -0.367057 0.635154 0.478145 11.00000 0.25330 CG 1 -0.423266 0.674900 0.486345 11.00000 0.31663 CD1 1 -0.432918 0.721723 0.497507 11.00000 0.31663 CD2 1 -0.475708 0.674760 0.484813 11.00000 0.31663 NE1 3 -0.489270 0.749689 0.503532 11.00000 0.31663 CE2 1 -0.515908 0.722647 0.494380 11.00000 0.31663 CE3 1 -0.492749 0.640727 0.474200 11.00000 0.31663 CZ2 1 -0.572028 0.735079 0.496928 11.00000 0.31663 CZ3 1 -0.549000 0.654097 0.474526 11.00000 0.31663 CH2 1 -0.589412 0.701087 0.486381 11.00000 0.31663 RESI 109 VAL N 3 -0.225184 0.620121 0.415543 11.00000 0.20264 CA 1 -0.164584 0.593552 0.408727 11.00000 0.20264 C 1 -0.150889 0.577104 0.448480 11.00000 0.25330 O 4 -0.110701 0.538771 0.446382 11.00000 0.25330 CB 1 -0.131884 0.626410 0.392228 11.00000 0.25330 CG1 1 -0.157822 0.671280 0.423263 11.00000 0.31663 CG2 1 -0.069055 0.600093 0.388050 11.00000 0.31663 RESI 110 ALA N 3 -0.179353 0.606893 0.482846 11.00000 0.20264 CA 1 -0.168379 0.592997 0.522330 11.00000 0.20264 C 1 -0.192045 0.555936 0.538301 11.00000 0.25330 O 4 -0.168355 0.528664 0.560189 11.00000 0.25330 CB 1 -0.194390 0.635742 0.555939 11.00000 0.25330 RESI 111 TRP N 3 -0.236170 0.554706 0.528356 11.00000 0.20264 CA 1 -0.255107 0.515061 0.539950 11.00000 0.20264 C 1 -0.209520 0.468433 0.516136 11.00000 0.25330 O 4 -0.193813 0.430850 0.533438 11.00000 0.25330 CB 1 -0.314138 0.525674 0.534368 11.00000 0.25330 CG 1 -0.332290 0.484962 0.544490 11.00000 0.31663 CD1 1 -0.357071 0.475177 0.584414 11.00000 0.31663 CD2 1 -0.321350 0.446050 0.516371 11.00000 0.31663 NE1 3 -0.361904 0.433075 0.581205 11.00000 0.31663 CE2 1 -0.342011 0.414854 0.540237 11.00000 0.31663 CE3 1 -0.295272 0.434520 0.472545 11.00000 0.31663 CZ2 1 -0.338432 0.373135 0.522134 11.00000 0.31663 CZ3 1 -0.294635 0.394540 0.454429 11.00000 0.31663 CH2 1 -0.313751 0.363177 0.479096 11.00000 0.31663 RESI 112 ARG N 3 -0.188048 0.469641 0.475021 11.00000 0.20264 CA 1 -0.145736 0.427586 0.446809 11.00000 0.20264 C 1 -0.091415 0.409174 0.460683 11.00000 0.25330 O 4 -0.068885 0.367311 0.464061 11.00000 0.25330 CB 1 -0.121736 0.431555 0.400347 11.00000 0.25330 CG 1 -0.154974 0.456327 0.373201 11.00000 0.34196 CD 1 -0.120232 0.442915 0.327246 11.00000 0.44328 NE 3 -0.099488 0.478170 0.308618 11.00000 0.56993 CZ 1 -0.046850 0.476774 0.303243 11.00000 0.56993 NH1 3 -0.007384 0.442984 0.315204 11.00000 0.56993 NH2 3 -0.033571 0.511232 0.283929 11.00000 0.56993 RESI 113 ASN N 3 -0.073898 0.440936 0.469768 11.00000 0.20264 CA 1 -0.021270 0.426823 0.481108 11.00000 0.20264 C 1 -0.026724 0.417451 0.525779 11.00000 0.25330 O 4 0.018386 0.390351 0.532759 11.00000 0.25330 CB 1 0.005525 0.463435 0.468833 11.00000 0.25330 CG 1 0.029400 0.461198 0.421708 11.00000 0.34196 OD1 4 0.048014 0.423482 0.398367 11.00000 0.44328 ND2 3 0.031549 0.501096 0.407375 11.00000 0.44328 RESI 114 ARG N 3 -0.077180 0.438810 0.554949 11.00000 0.20264 CA 1 -0.079007 0.436049 0.599752 11.00000 0.20264 C 1 -0.123006 0.419523 0.626573 11.00000 0.25330 O 4 -0.120878 0.409249 0.662147 11.00000 0.25330 CB 1 -0.093361 0.486973 0.618006 11.00000 0.25330 CG 1 -0.050267 0.506079 0.591871 11.00000 0.34196 CD 1 -0.054750 0.548978 0.613386 11.00000 0.44328 NE 3 -0.030049 0.540130 0.647891 11.00000 0.56993 CZ 1 -0.032043 0.579149 0.668117 11.00000 0.56993 NH1 3 -0.015842 0.577437 0.701103 11.00000 0.56993 NH2 3 -0.052384 0.619256 0.651502 11.00000 0.56993 RESI 115 CYS N 3 -0.160313 0.417141 0.609414 11.00000 0.20264 CA 1 -0.206427 0.401697 0.631151 11.00000 0.20264 C 1 -0.202206 0.355629 0.612558 11.00000 0.25330 O 4 -0.210312 0.325081 0.635473 11.00000 0.25330 CB 1 -0.263559 0.440414 0.632326 11.00000 0.25330 SG 5 -0.275766 0.495711 0.660269 11.00000 0.25330 RESI 116 LYS N 3 -0.193013 0.352759 0.571685 11.00000 0.20264 CA 1 -0.190981 0.313525 0.547394 11.00000 0.20264 C 1 -0.150646 0.266933 0.557395 11.00000 0.25330 O 4 -0.100645 0.262020 0.551587 11.00000 0.25330 CB 1 -0.166320 0.315593 0.500089 11.00000 0.25330 CG 1 -0.176104 0.281139 0.473064 11.00000 0.34196 CD 1 -0.149639 0.289015 0.426004 11.00000 0.44328 CE 1 -0.167341 0.261967 0.398424 11.00000 0.56993 NZ 3 -0.149719 0.276757 0.354350 11.00000 0.56993 RESI 117 GLY N 3 -0.173318 0.235715 0.569615 11.00000 0.20264 CA 1 -0.137492 0.188479 0.577842 11.00000 0.20264 C 1 -0.127552 0.188525 0.619691 11.00000 0.25330 O 4 -0.094611 0.150995 0.628875 11.00000 0.25330 RESI 118 THR N 3 -0.152536 0.227902 0.645518 11.00000 0.20264 CA 1 -0.143892 0.228694 0.687750 11.00000 0.20264 C 1 -0.196605 0.224440 0.718724 11.00000 0.25330 O 4 -0.236616 0.223886 0.707585 11.00000 0.25330 CB 1 -0.134833 0.273991 0.698542 11.00000 0.25330 OG1 4 -0.190439 0.314067 0.705203 11.00000 0.31663 CG2 1 -0.088250 0.282059 0.663383 11.00000 0.31663 RESI 119 ASP N 3 -0.197300 0.221054 0.757892 11.00000 0.20264 CA 1 -0.249146 0.218338 0.789041 11.00000 0.20264 C 1 -0.293518 0.268668 0.803481 11.00000 0.25330 O 4 -0.297285 0.289103 0.837050 11.00000 0.25330 CB 1 -0.231129 0.191914 0.824637 11.00000 0.25330 CG 1 -0.283078 0.193070 0.860119 11.00000 0.34196 OD1 4 -0.327439 0.200694 0.851485 11.00000 0.44328 OD2 4 -0.277214 0.187149 0.895488 11.00000 0.44328 RESI 120 VAL N 3 -0.328564 0.286478 0.782037 11.00000 0.20264 CA 1 -0.368423 0.336361 0.789374 11.00000 0.20264 C 1 -0.416065 0.345435 0.830388 11.00000 0.25330 O 4 -0.442467 0.384969 0.850753 11.00000 0.25330 CB 1 -0.388750 0.351789 0.751243 11.00000 0.25330 CG1 1 -0.340890 0.356458 0.714242 11.00000 0.31663 CG2 1 -0.412029 0.319555 0.736924 11.00000 0.31663 RESI 121 GLN N 3 -0.425120 0.307495 0.843582 11.00000 0.20264 CA 1 -0.471413 0.312887 0.883003 11.00000 0.20264 C 1 -0.461297 0.333484 0.919364 11.00000 0.25330 O 4 -0.502209 0.352660 0.951873 11.00000 0.25330 CB 1 -0.478360 0.265961 0.890836 11.00000 0.25330 CG 1 -0.535089 0.268512 0.888015 11.00000 0.34196 CD 1 -0.551224 0.230434 0.910400 11.00000 0.44328 OE1 4 -0.589899 0.239895 0.944052 11.00000 0.44328 NE2 3 -0.519930 0.186955 0.890572 11.00000 0.44328 RESI 122 ALA N 3 -0.408852 0.328697 0.915755 11.00000 0.20264 CA 1 -0.396201 0.348935 0.949001 11.00000 0.20264 C 1 -0.427997 0.402443 0.957915 11.00000 0.25330 O 4 -0.438974 0.421835 0.993487 11.00000 0.25330 CB 1 -0.332060 0.335772 0.938102 11.00000 0.25330 RESI 123 TRP N 3 -0.441647 0.426260 0.927201 11.00000 0.20264 CA 1 -0.472325 0.477789 0.931955 11.00000 0.20264 C 1 -0.534206 0.495505 0.959014 11.00000 0.25330 O 4 -0.560896 0.538244 0.973805 11.00000 0.25330 CB 1 -0.466367 0.494706 0.887439 11.00000 0.25330 CG 1 -0.404843 0.485157 0.864510 11.00000 0.31663 CD1 1 -0.366266 0.449461 0.834804 11.00000 0.31663 CD2 1 -0.376191 0.514098 0.871699 11.00000 0.31663 NE1 3 -0.313872 0.454177 0.822154 11.00000 0.31663 CE2 1 -0.318740 0.492432 0.845535 11.00000 0.31663 CE3 1 -0.393196 0.555236 0.897484 11.00000 0.31663 CZ2 1 -0.280138 0.512587 0.844543 11.00000 0.31663 CZ3 1 -0.354986 0.574953 0.897997 11.00000 0.31663 CH2 1 -0.298454 0.553043 0.871874 11.00000 0.31663 RESI 124 ILE N 3 -0.559175 0.464329 0.965749 11.00000 0.20264 CA 1 -0.619789 0.482791 0.994703 11.00000 0.20264 C 1 -0.624479 0.459863 1.034603 11.00000 0.25330 O 4 -0.672638 0.468547 1.060831 11.00000 0.25330 CB 1 -0.659598 0.478046 0.970601 11.00000 0.25330 CG1 1 -0.639670 0.426257 0.952211 11.00000 0.31663 CG2 1 -0.664643 0.510787 0.935185 11.00000 0.31663 CD1 1 -0.689957 0.418861 0.941339 11.00000 0.31663 RESI 125 ARG N 3 -0.576068 0.429556 1.038690 11.00000 0.20264 CA 1 -0.575688 0.407090 1.077608 11.00000 0.20264 C 1 -0.600464 0.444904 1.114853 11.00000 0.25330 O 4 -0.593095 0.482597 1.113274 11.00000 0.25330 CB 1 -0.517807 0.370609 1.076292 11.00000 0.25330 RESI 126 GLY N 3 -0.632057 0.433331 1.149180 11.00000 0.20264 CA 1 -0.657863 0.463824 1.189087 11.00000 0.20264 C 1 -0.712353 0.504831 1.190731 11.00000 0.25330 O 4 -0.745229 0.527704 1.225629 11.00000 0.25330 RESI 127 CYS N 3 -0.723972 0.514096 1.154835 11.00000 0.20264 CA 1 -0.776641 0.556794 1.156426 11.00000 0.20264 C 1 -0.830433 0.547555 1.171920 11.00000 0.25330 O 4 -0.832784 0.509958 1.160854 11.00000 0.25330 CB 1 -0.772172 0.572877 1.112584 11.00000 0.25330 SG 5 -0.706183 0.582076 1.089828 11.00000 0.25330 RESI 128 ARG N 3 -0.875703 0.585098 1.193450 11.00000 0.20264 CA 1 -0.932622 0.582554 1.208663 11.00000 0.20264 C 1 -0.958718 0.593879 1.173535 11.00000 0.25330 O 4 -0.984337 0.634140 1.166374 11.00000 0.25330 CB 1 -0.969274 0.613410 1.250190 11.00000 0.25330 RESI 129 LEU N 3 -0.948818 0.557168 1.149919 11.00000 0.20264 CA 1 -0.962492 0.543911 1.115531 11.00000 0.20264 C 1 -0.947310 0.489332 1.116327 11.00000 0.25330 OT1 4 -0.937825 0.474152 1.149825 11.00000 0.25330 CB 1 -0.935603 0.555320 1.072893 11.00000 0.25330 CG 1 -0.883287 0.566589 1.060626 11.00000 0.31663 CD1 1 -0.837076 0.536358 1.021049 11.00000 0.31663 CD2 1 -0.900656 0.618085 1.051666 11.00000 0.31663 OT2 4 -0.944757 0.466493 1.085403 11.00000 0.31663 HKLF 4 REM P1 lysozyme after mol rep REM R1(Free) = 0.4744 for 177 Fo > 4sig(Fo) and 0.4744 for all 177 data REM R1 = 0.4643 for 2990 Fo > 4sig(Fo) and 0.4652 for all 2997 data REM 980 parameters refined using 4022 restraints END WGHT 0.2000 0.0000 REM Highest difference peak 0.948, deepest hole -0.797, 1-sigma level 0.189 Q2 4 -0.9588 1.3070 0.3588 11.00000 0.75 0.92 Q3 4 -0.5483 0.5267 1.0628 11.00000 0.75 0.92 Q7 4 -1.0263 0.6121 0.8219 11.00000 0.75 0.76 Q10 4 -0.7672 0.8250 1.1464 11.00000 0.75 0.72 Q13 4 -0.4258 0.7802 0.3854 11.00000 0.75 0.71 Q19 4 -1.1448 0.8854 1.0388 11.00000 0.75 0.67 Q23 4 -0.7593 1.1357 1.0533 11.00000 0.75 0.65 Q28 4 -0.0786 0.8634 0.0817 11.00000 0.75 0.63 Q29 4 -0.7572 1.3165 0.4575 11.00000 0.75 0.63 Q33 4 -1.1387 1.1572 0.4775 11.00000 0.75 0.62 Q34 4 -0.4003 0.7424 0.1056 11.00000 0.75 0.61 Q36 4 -0.0690 1.0357 0.0207 11.00000 0.75 0.61 Q41 4 -0.2071 0.7267 0.7767 11.00000 0.75 0.59 Q44 4 -0.0681 1.1058 0.2224 11.00000 0.75 0.58 Q48 4 -0.4403 0.9635 0.9017 11.00000 0.75 0.58 Q49 4 -1.1237 0.9519 1.0163 11.00000 0.75 0.58 Q54 4 -0.6035 0.4379 0.3970 11.00000 0.75 0.56 Q55 4 -0.3714 0.5788 0.0626 11.00000 0.75 0.56 Q58 4 -0.3240 0.8171 0.2589 11.00000 0.75 0.56 Q61 4 -0.3519 1.1367 0.6678 11.00000 0.75 0.56 Q62 4 -1.1684 0.6959 0.9984 11.00000 0.75 0.56 Q66 4 -1.0313 1.0108 0.9190 11.00000 0.75 0.55 Q70 4 -0.2545 0.3601 0.7813 11.00000 0.75 0.55 Q72 4 -0.9996 1.1466 0.7118 11.00000 0.75 0.55 Q75 4 -1.2083 1.0723 0.8973 11.00000 0.75 0.54 Q76 4 -0.1731 0.5634 0.3237 11.00000 0.75 0.54 Q80 4 -0.6247 0.3583 0.8526 11.00000 0.75 0.54 Q81 4 -0.3936 0.6973 0.9898 11.00000 0.75 0.53 Q82 4 -0.9641 0.9853 0.4746 11.00000 0.75 0.53 Q83 4 -0.4163 0.3683 0.1148 11.00000 0.75 0.53 Q84 4 -0.3112 0.8132 0.4580 11.00000 0.75 0.53 Q85 4 -0.4682 0.2805 0.5077 11.00000 0.75 0.53 Q86 4 -1.1029 0.8544 0.5531 11.00000 0.75 0.53 Q92 4 -0.9468 1.3083 0.7206 11.00000 0.75 0.52 Q94 4 -0.2589 0.8982 0.1460 11.00000 0.75 0.52 Q97 4 -0.9713 0.3794 0.9196 11.00000 0.75 0.51 Q107 4 -0.2747 0.6523 0.2670 11.00000 0.75 0.50 Q120 4 -0.7529 0.7265 0.2240 11.00000 0.75 0.49 Q122 4 -0.2215 1.1238 0.5220 11.00000 0.75 0.49 Q133 4 -0.3698 0.2024 0.7969 11.00000 0.75 0.48 Q135 4 -0.3487 0.4829 0.9578 11.00000 0.75 0.48 Q137 4 0.0498 0.5296 0.3283 11.00000 0.75 0.48 Q139 4 -0.2973 0.2356 0.5467 11.00000 0.75 0.48 Q140 4 -0.2729 0.7361 0.3820 11.00000 0.75 0.48 Q144 4 -0.1632 0.4083 0.7661 11.00000 0.75 0.47 Q148 4 -1.0716 1.0534 0.5700 11.00000 0.75 0.47 Q154 4 -0.3783 1.0726 0.7577 11.00000 0.75 0.46 Q155 4 -0.7551 0.4057 1.0538 11.00000 0.75 0.46 Q156 4 -1.2512 1.0129 0.8065 11.00000 0.75 0.46 Q162 4 -1.0470 1.1646 1.0203 11.00000 0.75 0.46 Q166 4 -0.7271 0.3809 1.1408 11.00000 0.75 0.45 Q171 4 -0.9783 1.0482 0.5341 11.00000 0.75 0.45 Q173 4 -0.2954 1.2846 0.2064 11.00000 0.75 0.45 Q174 4 -0.4172 1.2069 0.3059 11.00000 0.75 0.45 Q176 4 -0.5982 1.4582 0.2975 11.00000 0.75 0.45 Q177 4 -0.1006 0.6705 0.6016 11.00000 0.75 0.45 Q179 4 -0.1518 0.4616 0.2191 11.00000 0.75 0.44 Q192 4 -0.8240 1.2571 0.9618 11.00000 0.75 0.43 Q195 4 -0.8966 1.1025 0.1673 11.00000 0.75 0.43