HEADER 12-JUL-22 SMS21101 TITLE SOLUTION STRUCTURE OF U9-MYRTX-TB1A FROM ANT PEPTIDE VENOM. COMPND MOL_ID: 1; COMPND 2 MOLECULE: U9-MYRTX-TB1A; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1 KEYWDS HELIX-TURN-HELIX EXPDTA NMR NUMMDL 15 AUTHOR F.PAQUET,L.JOUVENSAL,K.LOTH JRNL AUTH S.ASCOET,F.PAQUET,L.JOUVENSAL,K.LOTH,M.TREILHOU JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : ARIA 2.3.1, CCPNMR 2.1 REMARK 3 AUTHORS : LINGE, O'DONOGHUE AND NILGES (ARIA), CCPN (CCPNMR) REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: AND CARTESIAN SPACE DYNAMICS REMARK 4 REMARK 4 NULL COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON NULL. REMARK 100 THE BMRB ID CODE IS SMS21101. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 5.2 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-1H NOESY; 2D 1H-1H TOCSY; REMARK 210 2D 1H-15N HSQC; 2D 1H-13C HSQC REMARK 210 SPECTROMETER FIELD STRENGTH : 700 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : CCPNMR 2.1, TOPSPIN 3.6.2 REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 1000 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 15 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LOWEST REMARK 210 ENERGY REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 C ILE A 2 N VAL A 3 1.32 REMARK 500 C LYS A 9 N GLY A 10 1.32 REMARK 500 C LEU A 6 N ILE A 7 1.32 REMARK 500 C GLY A 1 N ILE A 2 1.32 REMARK 500 C GLY A 14 N LEU A 15 1.32 REMARK 500 C LEU A 15 N LYS A 16 1.33 REMARK 500 C LYS A 16 N MET A 17 1.33 REMARK 500 C VAL A 11 N LYS A 12 1.33 REMARK 500 C MET A 17 N ALA A 18 1.33 REMARK 500 C LEU A 13 N GLY A 14 1.33 REMARK 500 C VAL A 3 N THR A 4 1.33 REMARK 500 C LYS A 8 N LYS A 9 1.33 REMARK 500 C ALA A 18 N LEU A 19 1.33 REMARK 500 C THR A 4 N LYS A 5 1.33 REMARK 500 C LYS A 5 N LEU A 6 1.33 REMARK 500 C ILE A 7 N LYS A 8 1.34 REMARK 500 C LYS A 12 N LEU A 13 1.34 REMARK 500 C GLY A 10 N VAL A 11 1.34 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: SMS21098 RELATED DB: BMRB REMARK 900 RELATED ID: SMS21099 RELATED DB: BMRB REMARK 900 RELATED ID: SMS21100 RELATED DB: BMRB REMARK 900 RELATED ID: SMS21101 RELATED DB: BMRB SEQRES 1 A 19 GLY ILE VAL THR LYS LEU ILE LYS LYS GLY VAL LYS LEU SEQRES 2 A 19 GLY LEU LYS MET ALA LEU CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 MODEL 1 ATOM 1 N GLY A 1 8.846 6.504 2.192 1.00 1.26 N ATOM 2 CA GLY A 1 7.472 6.932 2.548 1.00 0.47 C ATOM 3 C GLY A 1 6.519 5.758 2.596 1.00 0.35 C ATOM 4 O GLY A 1 6.943 4.605 2.500 1.00 0.42 O ATOM 5 H1 GLY A 1 9.456 7.291 2.164 1.00 1.79 H ATOM 6 H2 GLY A 1 8.846 6.062 1.294 1.00 1.72 H ATOM 7 H3 GLY A 1 9.187 5.851 2.871 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.490 7.408 3.516 1.00 0.89 H ATOM 9 HA3 GLY A 1 7.122 7.641 1.813 1.00 0.90 H ATOM 10 N ILE A 2 5.232 6.031 2.738 1.00 0.27 N ATOM 11 CA ILE A 2 4.256 4.959 2.817 1.00 0.21 C ATOM 12 C ILE A 2 3.853 4.490 1.432 1.00 0.14 C ATOM 13 O ILE A 2 3.440 3.350 1.243 1.00 0.22 O ATOM 14 CB ILE A 2 2.997 5.363 3.607 1.00 0.27 C ATOM 15 CG1 ILE A 2 2.133 4.129 3.847 1.00 0.31 C ATOM 16 CG2 ILE A 2 2.198 6.423 2.861 1.00 0.33 C ATOM 17 CD1 ILE A 2 1.299 4.213 5.102 1.00 0.77 C ATOM 18 H ILE A 2 4.934 6.965 2.794 1.00 0.31 H ATOM 19 HA ILE A 2 4.720 4.132 3.337 1.00 0.27 H ATOM 20 HB ILE A 2 3.304 5.771 4.554 1.00 0.34 H ATOM 21 HG12 ILE A 2 1.462 4.005 3.010 1.00 0.63 H ATOM 22 HG13 ILE A 2 2.772 3.258 3.914 1.00 0.74 H ATOM 23 HG21 ILE A 2 2.827 7.277 2.661 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.355 6.729 3.464 1.00 1.10 H ATOM 25 HG23 ILE A 2 1.840 6.009 1.928 1.00 1.08 H ATOM 26 HD11 ILE A 2 0.630 5.057 5.034 1.00 1.38 H ATOM 27 HD12 ILE A 2 1.949 4.337 5.955 1.00 1.38 H ATOM 28 HD13 ILE A 2 0.724 3.306 5.216 1.00 1.42 H ATOM 29 N VAL A 3 3.986 5.360 0.453 1.00 0.14 N ATOM 30 CA VAL A 3 3.594 5.000 -0.891 1.00 0.20 C ATOM 31 C VAL A 3 4.569 3.974 -1.470 1.00 0.16 C ATOM 32 O VAL A 3 4.200 3.150 -2.303 1.00 0.19 O ATOM 33 CB VAL A 3 3.495 6.234 -1.819 1.00 0.33 C ATOM 34 CG1 VAL A 3 4.847 6.913 -1.969 1.00 0.92 C ATOM 35 CG2 VAL A 3 2.935 5.849 -3.182 1.00 0.94 C ATOM 36 H VAL A 3 4.341 6.255 0.640 1.00 0.20 H ATOM 37 HA VAL A 3 2.613 4.545 -0.814 1.00 0.25 H ATOM 38 HB VAL A 3 2.816 6.942 -1.366 1.00 0.65 H ATOM 39 HG11 VAL A 3 4.751 7.773 -2.613 1.00 1.51 H ATOM 40 HG12 VAL A 3 5.552 6.215 -2.399 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.200 7.227 -0.998 1.00 1.49 H ATOM 42 HG21 VAL A 3 2.896 6.722 -3.815 1.00 1.54 H ATOM 43 HG22 VAL A 3 1.940 5.446 -3.062 1.00 1.49 H ATOM 44 HG23 VAL A 3 3.574 5.104 -3.636 1.00 1.53 H ATOM 45 N THR A 4 5.813 4.015 -1.005 1.00 0.17 N ATOM 46 CA THR A 4 6.807 3.040 -1.415 1.00 0.21 C ATOM 47 C THR A 4 6.545 1.692 -0.750 1.00 0.18 C ATOM 48 O THR A 4 6.795 0.632 -1.343 1.00 0.21 O ATOM 49 CB THR A 4 8.231 3.531 -1.097 1.00 0.32 C ATOM 50 OG1 THR A 4 8.235 4.235 0.151 1.00 0.63 O ATOM 51 CG2 THR A 4 8.746 4.439 -2.203 1.00 0.66 C ATOM 52 H THR A 4 6.070 4.720 -0.375 1.00 0.21 H ATOM 53 HA THR A 4 6.723 2.915 -2.486 1.00 0.24 H ATOM 54 HB THR A 4 8.883 2.673 -1.021 1.00 0.54 H ATOM 55 HG1 THR A 4 8.420 3.615 0.868 1.00 1.24 H ATOM 56 HG21 THR A 4 8.790 3.887 -3.130 1.00 1.24 H ATOM 57 HG22 THR A 4 9.733 4.793 -1.948 1.00 1.30 H ATOM 58 HG23 THR A 4 8.079 5.281 -2.317 1.00 1.28 H ATOM 59 N LYS A 5 6.022 1.722 0.476 1.00 0.18 N ATOM 60 CA LYS A 5 5.577 0.492 1.106 1.00 0.27 C ATOM 61 C LYS A 5 4.421 -0.060 0.281 1.00 0.21 C ATOM 62 O LYS A 5 4.418 -1.230 -0.088 1.00 0.22 O ATOM 63 CB LYS A 5 5.179 0.698 2.590 1.00 0.46 C ATOM 64 CG LYS A 5 3.696 0.941 2.855 1.00 0.94 C ATOM 65 CD LYS A 5 3.329 0.587 4.292 1.00 0.90 C ATOM 66 CE LYS A 5 1.820 0.585 4.516 1.00 0.81 C ATOM 67 NZ LYS A 5 1.473 0.340 5.942 1.00 1.23 N ATOM 68 H LYS A 5 5.943 2.575 0.955 1.00 0.19 H ATOM 69 HA LYS A 5 6.397 -0.210 1.055 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.468 -0.173 3.149 1.00 1.25 H ATOM 71 HB3 LYS A 5 5.728 1.548 2.974 1.00 1.15 H ATOM 72 HG2 LYS A 5 3.481 1.984 2.685 1.00 1.72 H ATOM 73 HG3 LYS A 5 3.110 0.340 2.180 1.00 1.75 H ATOM 74 HD2 LYS A 5 3.713 -0.395 4.518 1.00 1.31 H ATOM 75 HD3 LYS A 5 3.781 1.311 4.953 1.00 1.33 H ATOM 76 HE2 LYS A 5 1.421 1.541 4.217 1.00 1.09 H ATOM 77 HE3 LYS A 5 1.377 -0.196 3.909 1.00 0.97 H ATOM 78 HZ1 LYS A 5 1.752 -0.582 6.211 1.00 1.66 H ATOM 79 HZ2 LYS A 5 0.489 0.428 6.080 1.00 1.71 H ATOM 80 HZ3 LYS A 5 1.941 1.003 6.530 1.00 1.67 H ATOM 81 N LEU A 6 3.498 0.835 -0.077 1.00 0.21 N ATOM 82 CA LEU A 6 2.325 0.515 -0.891 1.00 0.25 C ATOM 83 C LEU A 6 2.709 -0.196 -2.190 1.00 0.21 C ATOM 84 O LEU A 6 1.876 -0.838 -2.829 1.00 0.26 O ATOM 85 CB LEU A 6 1.551 1.815 -1.163 1.00 0.36 C ATOM 86 CG LEU A 6 0.561 1.809 -2.331 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.591 2.752 -2.039 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.252 2.237 -3.618 1.00 1.21 C ATOM 89 H LEU A 6 3.611 1.763 0.228 1.00 0.22 H ATOM 90 HA LEU A 6 1.695 -0.144 -0.314 1.00 0.32 H ATOM 91 HB2 LEU A 6 1.000 2.062 -0.268 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.272 2.598 -1.342 1.00 0.85 H ATOM 93 HG LEU A 6 0.164 0.813 -2.467 1.00 1.34 H ATOM 94 HD11 LEU A 6 -0.207 3.745 -1.864 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.119 2.409 -1.162 1.00 1.71 H ATOM 96 HD13 LEU A 6 -1.265 2.769 -2.882 1.00 1.70 H ATOM 97 HD21 LEU A 6 0.536 2.247 -4.425 1.00 1.76 H ATOM 98 HD22 LEU A 6 2.045 1.541 -3.847 1.00 1.73 H ATOM 99 HD23 LEU A 6 1.667 3.224 -3.489 1.00 1.81 H ATOM 100 N ILE A 7 3.968 -0.076 -2.577 1.00 0.16 N ATOM 101 CA ILE A 7 4.458 -0.746 -3.761 1.00 0.18 C ATOM 102 C ILE A 7 4.605 -2.256 -3.534 1.00 0.16 C ATOM 103 O ILE A 7 3.838 -3.042 -4.094 1.00 0.19 O ATOM 104 CB ILE A 7 5.807 -0.156 -4.226 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.674 1.353 -4.441 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.280 -0.835 -5.504 1.00 0.27 C ATOM 107 CD1 ILE A 7 6.959 2.026 -4.876 1.00 1.07 C ATOM 108 H ILE A 7 4.579 0.479 -2.051 1.00 0.16 H ATOM 109 HA ILE A 7 3.736 -0.588 -4.549 1.00 0.23 H ATOM 110 HB ILE A 7 6.540 -0.339 -3.457 1.00 0.20 H ATOM 111 HG12 ILE A 7 4.931 1.540 -5.200 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.356 1.810 -3.514 1.00 0.79 H ATOM 113 HG21 ILE A 7 5.551 -0.680 -6.285 1.00 1.06 H ATOM 114 HG22 ILE A 7 6.401 -1.893 -5.325 1.00 1.06 H ATOM 115 HG23 ILE A 7 7.227 -0.410 -5.804 1.00 1.06 H ATOM 116 HD11 ILE A 7 6.788 3.085 -4.999 1.00 1.67 H ATOM 117 HD12 ILE A 7 7.288 1.603 -5.812 1.00 1.67 H ATOM 118 HD13 ILE A 7 7.720 1.870 -4.124 1.00 1.64 H ATOM 119 N LYS A 8 5.579 -2.668 -2.717 1.00 0.13 N ATOM 120 CA LYS A 8 5.916 -4.098 -2.649 1.00 0.12 C ATOM 121 C LYS A 8 5.182 -4.849 -1.537 1.00 0.11 C ATOM 122 O LYS A 8 4.230 -5.576 -1.795 1.00 0.13 O ATOM 123 CB LYS A 8 7.419 -4.312 -2.440 1.00 0.17 C ATOM 124 CG LYS A 8 8.321 -3.312 -3.153 1.00 0.49 C ATOM 125 CD LYS A 8 8.623 -2.104 -2.277 1.00 0.78 C ATOM 126 CE LYS A 8 9.535 -1.112 -2.984 1.00 0.98 C ATOM 127 NZ LYS A 8 10.852 -1.711 -3.328 1.00 1.70 N ATOM 128 H LYS A 8 6.055 -2.015 -2.153 1.00 0.13 H ATOM 129 HA LYS A 8 5.636 -4.538 -3.594 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.624 -4.259 -1.381 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.670 -5.302 -2.790 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.250 -3.798 -3.408 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.829 -2.978 -4.054 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.697 -1.610 -2.022 1.00 1.28 H ATOM 135 HD3 LYS A 8 9.110 -2.443 -1.373 1.00 1.16 H ATOM 136 HE2 LYS A 8 9.051 -0.784 -3.893 1.00 1.43 H ATOM 137 HE3 LYS A 8 9.693 -0.262 -2.336 1.00 1.50 H ATOM 138 HZ1 LYS A 8 10.735 -2.446 -3.996 1.00 2.17 H ATOM 139 HZ2 LYS A 8 11.285 -2.090 -2.510 1.00 2.16 H ATOM 140 HZ3 LYS A 8 11.458 -1.017 -3.716 1.00 2.17 H ATOM 141 N LYS A 9 5.640 -4.673 -0.298 1.00 0.12 N ATOM 142 CA LYS A 9 5.110 -5.441 0.832 1.00 0.14 C ATOM 143 C LYS A 9 4.016 -4.664 1.534 1.00 0.13 C ATOM 144 O LYS A 9 2.984 -5.210 1.926 1.00 0.17 O ATOM 145 CB LYS A 9 6.220 -5.802 1.822 1.00 0.21 C ATOM 146 CG LYS A 9 7.320 -6.663 1.221 1.00 0.84 C ATOM 147 CD LYS A 9 6.790 -7.997 0.715 1.00 1.34 C ATOM 148 CE LYS A 9 6.210 -8.840 1.840 1.00 2.00 C ATOM 149 NZ LYS A 9 5.736 -10.159 1.349 1.00 2.66 N ATOM 150 H LYS A 9 6.338 -4.003 -0.136 1.00 0.13 H ATOM 151 HA LYS A 9 4.690 -6.347 0.432 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.669 -4.893 2.188 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.787 -6.337 2.652 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.766 -6.132 0.396 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.070 -6.850 1.977 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.016 -7.810 -0.014 1.00 1.78 H ATOM 157 HD3 LYS A 9 7.599 -8.540 0.250 1.00 1.82 H ATOM 158 HE2 LYS A 9 6.974 -8.997 2.586 1.00 2.46 H ATOM 159 HE3 LYS A 9 5.380 -8.310 2.280 1.00 2.44 H ATOM 160 HZ1 LYS A 9 5.365 -10.696 2.107 1.00 3.04 H ATOM 161 HZ2 LYS A 9 6.490 -10.667 0.937 1.00 3.03 H ATOM 162 HZ3 LYS A 9 5.019 -10.033 0.662 1.00 3.05 H ATOM 163 N GLY A 10 4.273 -3.378 1.675 1.00 0.14 N ATOM 164 CA GLY A 10 3.321 -2.435 2.219 1.00 0.17 C ATOM 165 C GLY A 10 2.047 -2.370 1.407 1.00 0.16 C ATOM 166 O GLY A 10 1.072 -1.764 1.841 1.00 0.20 O ATOM 167 H GLY A 10 5.150 -3.043 1.382 1.00 0.15 H ATOM 168 HA2 GLY A 10 3.080 -2.719 3.232 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.776 -1.457 2.225 1.00 0.21 H ATOM 170 N VAL A 11 2.133 -2.907 0.182 1.00 0.14 N ATOM 171 CA VAL A 11 1.080 -2.875 -0.845 1.00 0.16 C ATOM 172 C VAL A 11 -0.348 -2.993 -0.292 1.00 0.16 C ATOM 173 O VAL A 11 -1.298 -2.553 -0.937 1.00 0.18 O ATOM 174 CB VAL A 11 1.330 -4.001 -1.876 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.205 -5.368 -1.227 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.393 -3.880 -3.065 1.00 0.23 C ATOM 177 H VAL A 11 2.972 -3.357 -0.050 1.00 0.14 H ATOM 178 HA VAL A 11 1.169 -1.936 -1.366 1.00 0.19 H ATOM 179 HB VAL A 11 2.343 -3.900 -2.240 1.00 0.19 H ATOM 180 HG11 VAL A 11 1.948 -5.464 -0.448 1.00 1.03 H ATOM 181 HG12 VAL A 11 1.364 -6.136 -1.971 1.00 1.04 H ATOM 182 HG13 VAL A 11 0.220 -5.477 -0.800 1.00 1.04 H ATOM 183 HG21 VAL A 11 -0.628 -3.964 -2.727 1.00 1.06 H ATOM 184 HG22 VAL A 11 0.608 -4.667 -3.772 1.00 1.04 H ATOM 185 HG23 VAL A 11 0.538 -2.921 -3.538 1.00 1.04 H ATOM 186 N LYS A 12 -0.494 -3.580 0.889 1.00 0.16 N ATOM 187 CA LYS A 12 -1.760 -3.567 1.615 1.00 0.19 C ATOM 188 C LYS A 12 -2.371 -2.160 1.637 1.00 0.15 C ATOM 189 O LYS A 12 -3.583 -2.008 1.517 1.00 0.14 O ATOM 190 CB LYS A 12 -1.527 -4.058 3.047 1.00 0.27 C ATOM 191 CG LYS A 12 -2.759 -4.012 3.938 1.00 0.46 C ATOM 192 CD LYS A 12 -3.906 -4.819 3.348 1.00 0.97 C ATOM 193 CE LYS A 12 -4.959 -5.138 4.393 1.00 1.65 C ATOM 194 NZ LYS A 12 -4.456 -6.100 5.412 1.00 2.26 N ATOM 195 H LYS A 12 0.274 -4.038 1.284 1.00 0.16 H ATOM 196 HA LYS A 12 -2.443 -4.242 1.115 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.178 -5.079 3.009 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.761 -3.445 3.499 1.00 0.33 H ATOM 199 HG2 LYS A 12 -2.506 -4.418 4.906 1.00 0.85 H ATOM 200 HG3 LYS A 12 -3.071 -2.979 4.047 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.364 -4.246 2.555 1.00 1.47 H ATOM 202 HD3 LYS A 12 -3.516 -5.742 2.947 1.00 1.42 H ATOM 203 HE2 LYS A 12 -5.244 -4.222 4.888 1.00 2.23 H ATOM 204 HE3 LYS A 12 -5.820 -5.565 3.900 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -5.150 -6.249 6.116 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -3.628 -5.749 5.847 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -4.239 -6.978 4.980 1.00 2.67 H ATOM 208 N LEU A 13 -1.519 -1.138 1.770 1.00 0.15 N ATOM 209 CA LEU A 13 -1.961 0.251 1.773 1.00 0.15 C ATOM 210 C LEU A 13 -2.708 0.557 0.474 1.00 0.13 C ATOM 211 O LEU A 13 -3.713 1.261 0.477 1.00 0.15 O ATOM 212 CB LEU A 13 -0.743 1.177 1.939 1.00 0.20 C ATOM 213 CG LEU A 13 -1.010 2.598 2.465 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.783 3.438 1.466 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.748 2.549 3.795 1.00 0.38 C ATOM 216 H LEU A 13 -0.557 -1.328 1.863 1.00 0.19 H ATOM 217 HA LEU A 13 -2.632 0.390 2.606 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.055 0.697 2.619 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.257 1.264 0.981 1.00 0.21 H ATOM 220 HG LEU A 13 -0.063 3.086 2.631 1.00 0.30 H ATOM 221 HD11 LEU A 13 -1.205 3.545 0.561 1.00 1.08 H ATOM 222 HD12 LEU A 13 -1.975 4.414 1.887 1.00 1.08 H ATOM 223 HD13 LEU A 13 -2.719 2.951 1.241 1.00 1.09 H ATOM 224 HD21 LEU A 13 -1.169 1.983 4.508 1.00 1.09 H ATOM 225 HD22 LEU A 13 -2.711 2.078 3.658 1.00 1.09 H ATOM 226 HD23 LEU A 13 -1.890 3.554 4.164 1.00 1.10 H ATOM 227 N GLY A 14 -2.230 -0.014 -0.625 1.00 0.18 N ATOM 228 CA GLY A 14 -2.869 0.186 -1.910 1.00 0.23 C ATOM 229 C GLY A 14 -4.274 -0.376 -1.934 1.00 0.22 C ATOM 230 O GLY A 14 -5.201 0.260 -2.441 1.00 0.29 O ATOM 231 H GLY A 14 -1.445 -0.598 -0.558 1.00 0.22 H ATOM 232 HA2 GLY A 14 -2.911 1.245 -2.120 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.282 -0.301 -2.673 1.00 0.29 H ATOM 234 N LEU A 15 -4.437 -1.561 -1.365 1.00 0.22 N ATOM 235 CA LEU A 15 -5.746 -2.187 -1.266 1.00 0.29 C ATOM 236 C LEU A 15 -6.607 -1.448 -0.249 1.00 0.28 C ATOM 237 O LEU A 15 -7.834 -1.477 -0.315 1.00 0.39 O ATOM 238 CB LEU A 15 -5.624 -3.662 -0.869 1.00 0.35 C ATOM 239 CG LEU A 15 -5.063 -4.611 -1.939 1.00 0.41 C ATOM 240 CD1 LEU A 15 -5.816 -4.450 -3.249 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.571 -4.396 -2.148 1.00 0.39 C ATOM 242 H LEU A 15 -3.654 -2.030 -1.003 1.00 0.22 H ATOM 243 HA LEU A 15 -6.220 -2.120 -2.234 1.00 0.36 H ATOM 244 HB2 LEU A 15 -4.986 -3.723 0.001 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.607 -4.013 -0.593 1.00 0.41 H ATOM 246 HG LEU A 15 -5.204 -5.628 -1.603 1.00 0.51 H ATOM 247 HD11 LEU A 15 -6.867 -4.636 -3.085 1.00 1.13 H ATOM 248 HD12 LEU A 15 -5.435 -5.155 -3.972 1.00 1.16 H ATOM 249 HD13 LEU A 15 -5.683 -3.445 -3.623 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.396 -3.379 -2.466 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.213 -5.077 -2.907 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.046 -4.580 -1.222 1.00 1.10 H ATOM 253 N LYS A 16 -5.946 -0.784 0.689 1.00 0.21 N ATOM 254 CA LYS A 16 -6.628 0.007 1.701 1.00 0.28 C ATOM 255 C LYS A 16 -7.049 1.359 1.138 1.00 0.34 C ATOM 256 O LYS A 16 -7.861 2.061 1.735 1.00 0.46 O ATOM 257 CB LYS A 16 -5.726 0.197 2.924 1.00 0.34 C ATOM 258 CG LYS A 16 -5.500 -1.079 3.725 1.00 0.39 C ATOM 259 CD LYS A 16 -6.778 -1.556 4.404 1.00 1.31 C ATOM 260 CE LYS A 16 -7.320 -0.527 5.388 1.00 1.54 C ATOM 261 NZ LYS A 16 -6.377 -0.267 6.508 1.00 2.08 N ATOM 262 H LYS A 16 -4.965 -0.832 0.704 1.00 0.18 H ATOM 263 HA LYS A 16 -7.513 -0.534 1.999 1.00 0.35 H ATOM 264 HB2 LYS A 16 -4.765 0.561 2.591 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.172 0.933 3.574 1.00 0.43 H ATOM 266 HG2 LYS A 16 -5.156 -1.852 3.054 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.746 -0.897 4.479 1.00 0.78 H ATOM 268 HD2 LYS A 16 -7.527 -1.742 3.648 1.00 2.01 H ATOM 269 HD3 LYS A 16 -6.569 -2.472 4.936 1.00 1.98 H ATOM 270 HE2 LYS A 16 -7.496 0.398 4.861 1.00 2.03 H ATOM 271 HE3 LYS A 16 -8.253 -0.891 5.792 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -6.185 -1.117 7.001 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -6.773 0.391 7.144 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -5.517 0.106 6.156 1.00 2.48 H ATOM 275 N MET A 17 -6.486 1.726 -0.006 1.00 0.37 N ATOM 276 CA MET A 17 -6.889 2.945 -0.694 1.00 0.49 C ATOM 277 C MET A 17 -8.020 2.649 -1.668 1.00 0.55 C ATOM 278 O MET A 17 -9.010 3.378 -1.726 1.00 0.66 O ATOM 279 CB MET A 17 -5.718 3.574 -1.459 1.00 0.60 C ATOM 280 CG MET A 17 -4.575 4.054 -0.578 1.00 0.69 C ATOM 281 SD MET A 17 -3.360 5.033 -1.488 1.00 1.70 S ATOM 282 CE MET A 17 -4.349 6.451 -1.959 1.00 2.33 C ATOM 283 H MET A 17 -5.775 1.170 -0.390 1.00 0.37 H ATOM 284 HA MET A 17 -7.242 3.645 0.049 1.00 0.54 H ATOM 285 HB2 MET A 17 -5.324 2.844 -2.150 1.00 1.19 H ATOM 286 HB3 MET A 17 -6.088 4.420 -2.020 1.00 1.22 H ATOM 287 HG2 MET A 17 -4.979 4.657 0.221 1.00 1.19 H ATOM 288 HG3 MET A 17 -4.074 3.190 -0.159 1.00 1.28 H ATOM 289 HE1 MET A 17 -5.150 6.133 -2.609 1.00 2.74 H ATOM 290 HE2 MET A 17 -3.728 7.167 -2.477 1.00 2.78 H ATOM 291 HE3 MET A 17 -4.764 6.909 -1.074 1.00 2.74 H ATOM 292 N ALA A 18 -7.866 1.564 -2.417 1.00 0.57 N ATOM 293 CA ALA A 18 -8.822 1.199 -3.456 1.00 0.70 C ATOM 294 C ALA A 18 -10.091 0.584 -2.874 1.00 0.79 C ATOM 295 O ALA A 18 -11.191 0.868 -3.349 1.00 1.34 O ATOM 296 CB ALA A 18 -8.176 0.234 -4.441 1.00 0.81 C ATOM 297 H ALA A 18 -7.080 0.994 -2.273 1.00 0.58 H ATOM 298 HA ALA A 18 -9.084 2.098 -3.995 1.00 0.78 H ATOM 299 HB1 ALA A 18 -7.284 0.684 -4.854 1.00 1.33 H ATOM 300 HB2 ALA A 18 -8.870 0.016 -5.239 1.00 1.31 H ATOM 301 HB3 ALA A 18 -7.914 -0.682 -3.931 1.00 1.33 H ATOM 302 N LEU A 19 -9.929 -0.239 -1.838 1.00 0.75 N ATOM 303 CA LEU A 19 -11.038 -0.987 -1.243 1.00 0.82 C ATOM 304 C LEU A 19 -11.681 -1.903 -2.279 1.00 1.31 C ATOM 305 O LEU A 19 -12.729 -1.527 -2.851 1.00 1.89 O ATOM 306 CB LEU A 19 -12.102 -0.061 -0.627 1.00 1.07 C ATOM 307 CG LEU A 19 -11.757 0.556 0.733 1.00 1.32 C ATOM 308 CD1 LEU A 19 -10.684 1.620 0.596 1.00 2.07 C ATOM 309 CD2 LEU A 19 -13.001 1.141 1.382 1.00 1.78 C ATOM 310 OXT LEU A 19 -11.125 -2.992 -2.526 1.00 1.90 O ATOM 311 H LEU A 19 -9.030 -0.356 -1.465 1.00 1.05 H ATOM 312 HA LEU A 19 -10.622 -1.605 -0.458 1.00 0.82 H ATOM 313 HB2 LEU A 19 -12.286 0.745 -1.323 1.00 1.70 H ATOM 314 HB3 LEU A 19 -13.015 -0.626 -0.516 1.00 1.39 H ATOM 315 HG LEU A 19 -11.374 -0.218 1.383 1.00 1.78 H ATOM 316 HD11 LEU A 19 -9.790 1.178 0.180 1.00 2.52 H ATOM 317 HD12 LEU A 19 -10.462 2.034 1.568 1.00 2.57 H ATOM 318 HD13 LEU A 19 -11.036 2.404 -0.058 1.00 2.47 H ATOM 319 HD21 LEU A 19 -13.730 0.358 1.533 1.00 2.23 H ATOM 320 HD22 LEU A 19 -13.417 1.903 0.741 1.00 2.18 H ATOM 321 HD23 LEU A 19 -12.739 1.576 2.335 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 2 ATOM 1 N GLY A 1 8.866 6.696 2.439 1.00 1.26 N ATOM 2 CA GLY A 1 7.427 7.050 2.359 1.00 0.47 C ATOM 3 C GLY A 1 6.537 5.835 2.510 1.00 0.35 C ATOM 4 O GLY A 1 7.015 4.702 2.469 1.00 0.42 O ATOM 5 H1 GLY A 1 9.428 7.520 2.349 1.00 1.79 H ATOM 6 H2 GLY A 1 9.104 6.062 1.706 1.00 1.72 H ATOM 7 H3 GLY A 1 9.063 6.261 3.316 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.192 7.755 3.140 1.00 0.89 H ATOM 9 HA3 GLY A 1 7.233 7.506 1.401 1.00 0.90 H ATOM 10 N ILE A 2 5.244 6.059 2.681 1.00 0.27 N ATOM 11 CA ILE A 2 4.312 4.954 2.811 1.00 0.21 C ATOM 12 C ILE A 2 3.862 4.477 1.445 1.00 0.14 C ATOM 13 O ILE A 2 3.480 3.327 1.269 1.00 0.22 O ATOM 14 CB ILE A 2 3.078 5.314 3.660 1.00 0.27 C ATOM 15 CG1 ILE A 2 2.239 4.062 3.895 1.00 0.31 C ATOM 16 CG2 ILE A 2 2.238 6.391 2.985 1.00 0.33 C ATOM 17 CD1 ILE A 2 1.438 4.111 5.174 1.00 0.77 C ATOM 18 H ILE A 2 4.908 6.982 2.711 1.00 0.31 H ATOM 19 HA ILE A 2 4.830 4.144 3.304 1.00 0.27 H ATOM 20 HB ILE A 2 3.419 5.695 4.607 1.00 0.34 H ATOM 21 HG12 ILE A 2 1.546 3.942 3.074 1.00 0.63 H ATOM 22 HG13 ILE A 2 2.894 3.200 3.930 1.00 0.74 H ATOM 23 HG21 ILE A 2 2.842 7.272 2.823 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.399 6.641 3.617 1.00 1.10 H ATOM 25 HG23 ILE A 2 1.876 6.021 2.036 1.00 1.08 H ATOM 26 HD11 ILE A 2 2.110 4.208 6.012 1.00 1.38 H ATOM 27 HD12 ILE A 2 0.864 3.203 5.275 1.00 1.38 H ATOM 28 HD13 ILE A 2 0.771 4.959 5.147 1.00 1.42 H ATOM 29 N VAL A 3 3.921 5.358 0.467 1.00 0.14 N ATOM 30 CA VAL A 3 3.491 4.998 -0.867 1.00 0.20 C ATOM 31 C VAL A 3 4.464 3.990 -1.481 1.00 0.16 C ATOM 32 O VAL A 3 4.082 3.160 -2.299 1.00 0.19 O ATOM 33 CB VAL A 3 3.350 6.233 -1.790 1.00 0.33 C ATOM 34 CG1 VAL A 3 4.701 6.886 -2.043 1.00 0.92 C ATOM 35 CG2 VAL A 3 2.680 5.852 -3.105 1.00 0.94 C ATOM 36 H VAL A 3 4.247 6.266 0.649 1.00 0.20 H ATOM 37 HA VAL A 3 2.520 4.529 -0.763 1.00 0.25 H ATOM 38 HB VAL A 3 2.719 6.954 -1.292 1.00 0.65 H ATOM 39 HG11 VAL A 3 4.571 7.757 -2.669 1.00 1.51 H ATOM 40 HG12 VAL A 3 5.352 6.180 -2.540 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.142 7.180 -1.103 1.00 1.49 H ATOM 42 HG21 VAL A 3 1.684 5.484 -2.909 1.00 1.54 H ATOM 43 HG22 VAL A 3 3.259 5.081 -3.593 1.00 1.49 H ATOM 44 HG23 VAL A 3 2.624 6.719 -3.744 1.00 1.53 H ATOM 45 N THR A 4 5.722 4.052 -1.058 1.00 0.17 N ATOM 46 CA THR A 4 6.723 3.111 -1.526 1.00 0.21 C ATOM 47 C THR A 4 6.538 1.756 -0.851 1.00 0.18 C ATOM 48 O THR A 4 6.757 0.701 -1.463 1.00 0.21 O ATOM 49 CB THR A 4 8.144 3.647 -1.286 1.00 0.32 C ATOM 50 OG1 THR A 4 8.234 4.221 0.025 1.00 0.63 O ATOM 51 CG2 THR A 4 8.507 4.693 -2.330 1.00 0.66 C ATOM 52 H THR A 4 5.983 4.748 -0.420 1.00 0.21 H ATOM 53 HA THR A 4 6.583 2.986 -2.592 1.00 0.24 H ATOM 54 HB THR A 4 8.841 2.826 -1.361 1.00 0.54 H ATOM 55 HG1 THR A 4 8.901 3.748 0.537 1.00 1.24 H ATOM 56 HG21 THR A 4 9.501 5.068 -2.132 1.00 1.24 H ATOM 57 HG22 THR A 4 7.800 5.507 -2.286 1.00 1.30 H ATOM 58 HG23 THR A 4 8.480 4.244 -3.312 1.00 1.28 H ATOM 59 N LYS A 5 6.113 1.776 0.412 1.00 0.18 N ATOM 60 CA LYS A 5 5.732 0.541 1.072 1.00 0.27 C ATOM 61 C LYS A 5 4.521 -0.026 0.344 1.00 0.21 C ATOM 62 O LYS A 5 4.480 -1.206 0.011 1.00 0.22 O ATOM 63 CB LYS A 5 5.447 0.752 2.577 1.00 0.46 C ATOM 64 CG LYS A 5 3.991 0.984 2.950 1.00 0.94 C ATOM 65 CD LYS A 5 3.752 0.688 4.422 1.00 0.90 C ATOM 66 CE LYS A 5 2.271 0.572 4.752 1.00 0.81 C ATOM 67 NZ LYS A 5 2.049 0.327 6.201 1.00 1.23 N ATOM 68 H LYS A 5 6.066 2.630 0.899 1.00 0.19 H ATOM 69 HA LYS A 5 6.552 -0.153 0.962 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.782 -0.111 3.118 1.00 1.25 H ATOM 71 HB3 LYS A 5 6.014 1.608 2.912 1.00 1.15 H ATOM 72 HG2 LYS A 5 3.742 2.015 2.754 1.00 1.72 H ATOM 73 HG3 LYS A 5 3.363 0.346 2.352 1.00 1.75 H ATOM 74 HD2 LYS A 5 4.237 -0.244 4.673 1.00 1.31 H ATOM 75 HD3 LYS A 5 4.180 1.485 5.012 1.00 1.33 H ATOM 76 HE2 LYS A 5 1.777 1.489 4.471 1.00 1.09 H ATOM 77 HE3 LYS A 5 1.849 -0.251 4.188 1.00 0.97 H ATOM 78 HZ1 LYS A 5 1.072 0.231 6.390 1.00 1.66 H ATOM 79 HZ2 LYS A 5 2.406 1.090 6.738 1.00 1.71 H ATOM 80 HZ3 LYS A 5 2.519 -0.511 6.485 1.00 1.67 H ATOM 81 N LEU A 6 3.582 0.868 0.034 1.00 0.21 N ATOM 82 CA LEU A 6 2.364 0.552 -0.711 1.00 0.25 C ATOM 83 C LEU A 6 2.673 -0.163 -2.024 1.00 0.21 C ATOM 84 O LEU A 6 1.804 -0.810 -2.608 1.00 0.26 O ATOM 85 CB LEU A 6 1.595 1.862 -0.946 1.00 0.36 C ATOM 86 CG LEU A 6 0.510 1.860 -2.025 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.586 2.839 -1.649 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.096 2.243 -3.374 1.00 1.21 C ATOM 89 H LEU A 6 3.714 1.797 0.328 1.00 0.22 H ATOM 90 HA LEU A 6 1.758 -0.097 -0.098 1.00 0.32 H ATOM 91 HB2 LEU A 6 1.131 2.142 -0.014 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.316 2.623 -1.203 1.00 0.85 H ATOM 93 HG LEU A 6 0.077 0.873 -2.105 1.00 1.34 H ATOM 94 HD11 LEU A 6 -1.050 2.517 -0.731 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.325 2.872 -2.436 1.00 1.71 H ATOM 96 HD13 LEU A 6 -0.159 3.821 -1.512 1.00 1.70 H ATOM 97 HD21 LEU A 6 1.868 1.538 -3.644 1.00 1.76 H ATOM 98 HD22 LEU A 6 1.521 3.234 -3.312 1.00 1.73 H ATOM 99 HD23 LEU A 6 0.319 2.231 -4.123 1.00 1.81 H ATOM 100 N ILE A 7 3.904 -0.045 -2.485 1.00 0.16 N ATOM 101 CA ILE A 7 4.316 -0.700 -3.707 1.00 0.18 C ATOM 102 C ILE A 7 4.488 -2.210 -3.509 1.00 0.16 C ATOM 103 O ILE A 7 3.722 -2.995 -4.070 1.00 0.19 O ATOM 104 CB ILE A 7 5.621 -0.090 -4.262 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.441 1.411 -4.497 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.032 -0.786 -5.554 1.00 0.27 C ATOM 107 CD1 ILE A 7 6.683 2.106 -5.014 1.00 1.07 C ATOM 108 H ILE A 7 4.549 0.503 -1.992 1.00 0.16 H ATOM 109 HA ILE A 7 3.539 -0.539 -4.439 1.00 0.23 H ATOM 110 HB ILE A 7 6.404 -0.241 -3.534 1.00 0.20 H ATOM 111 HG12 ILE A 7 4.653 1.564 -5.218 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.163 1.878 -3.563 1.00 0.79 H ATOM 113 HG21 ILE A 7 6.941 -0.341 -5.928 1.00 1.06 H ATOM 114 HG22 ILE A 7 5.248 -0.673 -6.287 1.00 1.06 H ATOM 115 HG23 ILE A 7 6.197 -1.835 -5.360 1.00 1.06 H ATOM 116 HD11 ILE A 7 6.966 1.677 -5.963 1.00 1.67 H ATOM 117 HD12 ILE A 7 7.489 1.977 -4.306 1.00 1.67 H ATOM 118 HD13 ILE A 7 6.480 3.160 -5.140 1.00 1.64 H ATOM 119 N LYS A 8 5.480 -2.630 -2.722 1.00 0.13 N ATOM 120 CA LYS A 8 5.817 -4.060 -2.684 1.00 0.12 C ATOM 121 C LYS A 8 5.109 -4.830 -1.571 1.00 0.11 C ATOM 122 O LYS A 8 4.144 -5.546 -1.815 1.00 0.13 O ATOM 123 CB LYS A 8 7.323 -4.280 -2.511 1.00 0.17 C ATOM 124 CG LYS A 8 8.211 -3.331 -3.306 1.00 0.49 C ATOM 125 CD LYS A 8 8.510 -2.058 -2.526 1.00 0.78 C ATOM 126 CE LYS A 8 9.310 -1.065 -3.354 1.00 0.98 C ATOM 127 NZ LYS A 8 10.647 -1.594 -3.733 1.00 1.70 N ATOM 128 H LYS A 8 5.969 -1.983 -2.160 1.00 0.13 H ATOM 129 HA LYS A 8 5.517 -4.484 -3.630 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.562 -4.177 -1.462 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.553 -5.291 -2.815 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.142 -3.828 -3.531 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.708 -3.071 -4.225 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.578 -1.597 -2.233 1.00 1.28 H ATOM 135 HD3 LYS A 8 9.077 -2.314 -1.644 1.00 1.16 H ATOM 136 HE2 LYS A 8 8.756 -0.840 -4.253 1.00 1.43 H ATOM 137 HE3 LYS A 8 9.440 -0.160 -2.778 1.00 1.50 H ATOM 138 HZ1 LYS A 8 11.149 -0.907 -4.263 1.00 2.17 H ATOM 139 HZ2 LYS A 8 10.552 -2.418 -4.288 1.00 2.16 H ATOM 140 HZ3 LYS A 8 11.176 -1.816 -2.914 1.00 2.17 H ATOM 141 N LYS A 9 5.601 -4.682 -0.347 1.00 0.12 N ATOM 142 CA LYS A 9 5.112 -5.479 0.778 1.00 0.14 C ATOM 143 C LYS A 9 4.033 -4.730 1.538 1.00 0.13 C ATOM 144 O LYS A 9 3.064 -5.308 2.035 1.00 0.17 O ATOM 145 CB LYS A 9 6.264 -5.860 1.712 1.00 0.21 C ATOM 146 CG LYS A 9 7.340 -6.697 1.039 1.00 0.84 C ATOM 147 CD LYS A 9 6.815 -8.066 0.626 1.00 1.34 C ATOM 148 CE LYS A 9 7.861 -8.860 -0.142 1.00 2.00 C ATOM 149 NZ LYS A 9 9.096 -9.089 0.656 1.00 2.66 N ATOM 150 H LYS A 9 6.299 -4.011 -0.191 1.00 0.13 H ATOM 151 HA LYS A 9 4.687 -6.378 0.367 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.721 -4.958 2.087 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.865 -6.424 2.542 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.687 -6.178 0.159 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.160 -6.830 1.727 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.540 -8.617 1.512 1.00 1.78 H ATOM 157 HD3 LYS A 9 5.948 -7.933 -0.002 1.00 1.82 H ATOM 158 HE2 LYS A 9 7.440 -9.816 -0.414 1.00 2.46 H ATOM 159 HE3 LYS A 9 8.120 -8.315 -1.038 1.00 2.44 H ATOM 160 HZ1 LYS A 9 8.878 -9.597 1.488 1.00 3.04 H ATOM 161 HZ2 LYS A 9 9.512 -8.217 0.913 1.00 3.03 H ATOM 162 HZ3 LYS A 9 9.759 -9.613 0.121 1.00 3.05 H ATOM 163 N GLY A 10 4.239 -3.430 1.616 1.00 0.14 N ATOM 164 CA GLY A 10 3.293 -2.510 2.207 1.00 0.17 C ATOM 165 C GLY A 10 2.000 -2.452 1.431 1.00 0.16 C ATOM 166 O GLY A 10 1.034 -1.854 1.894 1.00 0.20 O ATOM 167 H GLY A 10 5.071 -3.066 1.237 1.00 0.15 H ATOM 168 HA2 GLY A 10 3.083 -2.821 3.218 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.733 -1.527 2.223 1.00 0.21 H ATOM 170 N VAL A 11 2.057 -2.981 0.200 1.00 0.14 N ATOM 171 CA VAL A 11 0.983 -2.939 -0.803 1.00 0.16 C ATOM 172 C VAL A 11 -0.435 -3.081 -0.222 1.00 0.16 C ATOM 173 O VAL A 11 -1.407 -2.686 -0.862 1.00 0.18 O ATOM 174 CB VAL A 11 1.222 -4.033 -1.872 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.097 -5.423 -1.273 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.281 -3.864 -3.050 1.00 0.23 C ATOM 177 H VAL A 11 2.887 -3.432 -0.051 1.00 0.14 H ATOM 178 HA VAL A 11 1.050 -1.985 -1.300 1.00 0.19 H ATOM 179 HB VAL A 11 2.234 -3.922 -2.238 1.00 0.19 H ATOM 180 HG11 VAL A 11 1.849 -5.552 -0.508 1.00 1.03 H ATOM 181 HG12 VAL A 11 1.241 -6.164 -2.046 1.00 1.04 H ATOM 182 HG13 VAL A 11 0.117 -5.541 -0.838 1.00 1.04 H ATOM 183 HG21 VAL A 11 -0.739 -3.949 -2.707 1.00 1.06 H ATOM 184 HG22 VAL A 11 0.483 -4.631 -3.783 1.00 1.04 H ATOM 185 HG23 VAL A 11 0.433 -2.892 -3.493 1.00 1.04 H ATOM 186 N LYS A 12 -0.550 -3.651 0.969 1.00 0.16 N ATOM 187 CA LYS A 12 -1.780 -3.584 1.753 1.00 0.19 C ATOM 188 C LYS A 12 -2.391 -2.176 1.701 1.00 0.15 C ATOM 189 O LYS A 12 -3.598 -2.025 1.523 1.00 0.14 O ATOM 190 CB LYS A 12 -1.475 -3.975 3.201 1.00 0.27 C ATOM 191 CG LYS A 12 -2.627 -3.752 4.172 1.00 0.46 C ATOM 192 CD LYS A 12 -3.901 -4.462 3.729 1.00 0.97 C ATOM 193 CE LYS A 12 -3.719 -5.972 3.630 1.00 1.65 C ATOM 194 NZ LYS A 12 -3.335 -6.585 4.931 1.00 2.26 N ATOM 195 H LYS A 12 0.215 -4.142 1.331 1.00 0.16 H ATOM 196 HA LYS A 12 -2.485 -4.289 1.339 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.207 -5.019 3.227 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.631 -3.393 3.542 1.00 0.33 H ATOM 199 HG2 LYS A 12 -2.342 -4.125 5.144 1.00 0.85 H ATOM 200 HG3 LYS A 12 -2.821 -2.688 4.236 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.681 -4.255 4.443 1.00 1.47 H ATOM 202 HD3 LYS A 12 -4.193 -4.080 2.761 1.00 1.42 H ATOM 203 HE2 LYS A 12 -4.650 -6.410 3.301 1.00 2.23 H ATOM 204 HE3 LYS A 12 -2.950 -6.180 2.903 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -2.423 -6.274 5.205 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -3.321 -7.581 4.851 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -3.993 -6.329 5.639 1.00 2.67 H ATOM 208 N LEU A 13 -1.544 -1.154 1.828 1.00 0.15 N ATOM 209 CA LEU A 13 -1.981 0.234 1.786 1.00 0.15 C ATOM 210 C LEU A 13 -2.617 0.533 0.425 1.00 0.13 C ATOM 211 O LEU A 13 -3.590 1.278 0.328 1.00 0.15 O ATOM 212 CB LEU A 13 -0.763 1.140 2.030 1.00 0.20 C ATOM 213 CG LEU A 13 -1.022 2.500 2.697 1.00 0.29 C ATOM 214 CD1 LEU A 13 -2.013 3.342 1.914 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.500 2.308 4.127 1.00 0.38 C ATOM 216 H LEU A 13 -0.583 -1.340 1.944 1.00 0.19 H ATOM 217 HA LEU A 13 -2.714 0.385 2.567 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.069 0.595 2.653 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.288 1.318 1.081 1.00 0.21 H ATOM 220 HG LEU A 13 -0.090 3.047 2.730 1.00 0.30 H ATOM 221 HD11 LEU A 13 -2.937 2.795 1.798 1.00 1.08 H ATOM 222 HD12 LEU A 13 -1.604 3.570 0.942 1.00 1.08 H ATOM 223 HD13 LEU A 13 -2.204 4.261 2.449 1.00 1.09 H ATOM 224 HD21 LEU A 13 -0.768 1.736 4.678 1.00 1.09 H ATOM 225 HD22 LEU A 13 -2.440 1.781 4.123 1.00 1.09 H ATOM 226 HD23 LEU A 13 -1.630 3.271 4.595 1.00 1.10 H ATOM 227 N GLY A 14 -2.073 -0.082 -0.618 1.00 0.18 N ATOM 228 CA GLY A 14 -2.614 0.084 -1.954 1.00 0.23 C ATOM 229 C GLY A 14 -4.011 -0.483 -2.066 1.00 0.22 C ATOM 230 O GLY A 14 -4.860 0.061 -2.776 1.00 0.29 O ATOM 231 H GLY A 14 -1.303 -0.671 -0.477 1.00 0.22 H ATOM 232 HA2 GLY A 14 -2.639 1.136 -2.198 1.00 0.26 H ATOM 233 HA3 GLY A 14 -1.972 -0.425 -2.659 1.00 0.29 H ATOM 234 N LEU A 15 -4.254 -1.576 -1.354 1.00 0.22 N ATOM 235 CA LEU A 15 -5.584 -2.162 -1.290 1.00 0.29 C ATOM 236 C LEU A 15 -6.504 -1.285 -0.453 1.00 0.28 C ATOM 237 O LEU A 15 -7.706 -1.222 -0.698 1.00 0.39 O ATOM 238 CB LEU A 15 -5.545 -3.584 -0.709 1.00 0.35 C ATOM 239 CG LEU A 15 -5.114 -4.698 -1.675 1.00 0.41 C ATOM 240 CD1 LEU A 15 -5.991 -4.705 -2.918 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.648 -4.562 -2.060 1.00 0.39 C ATOM 242 H LEU A 15 -3.518 -1.999 -0.860 1.00 0.22 H ATOM 243 HA LEU A 15 -5.973 -2.204 -2.296 1.00 0.36 H ATOM 244 HB2 LEU A 15 -4.865 -3.585 0.130 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.533 -3.820 -0.344 1.00 0.41 H ATOM 246 HG LEU A 15 -5.239 -5.652 -1.183 1.00 0.51 H ATOM 247 HD11 LEU A 15 -5.862 -3.779 -3.458 1.00 1.13 H ATOM 248 HD12 LEU A 15 -7.026 -4.808 -2.626 1.00 1.16 H ATOM 249 HD13 LEU A 15 -5.712 -5.533 -3.551 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.036 -4.633 -1.174 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.488 -3.605 -2.533 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.381 -5.352 -2.747 1.00 1.10 H ATOM 253 N LYS A 16 -5.930 -0.603 0.532 1.00 0.21 N ATOM 254 CA LYS A 16 -6.689 0.322 1.366 1.00 0.28 C ATOM 255 C LYS A 16 -7.079 1.560 0.561 1.00 0.34 C ATOM 256 O LYS A 16 -8.103 2.192 0.825 1.00 0.46 O ATOM 257 CB LYS A 16 -5.877 0.738 2.596 1.00 0.34 C ATOM 258 CG LYS A 16 -5.374 -0.433 3.428 1.00 0.39 C ATOM 259 CD LYS A 16 -4.761 0.026 4.742 1.00 1.31 C ATOM 260 CE LYS A 16 -5.798 0.647 5.667 1.00 1.54 C ATOM 261 NZ LYS A 16 -6.880 -0.312 6.014 1.00 2.08 N ATOM 262 H LYS A 16 -4.973 -0.734 0.710 1.00 0.18 H ATOM 263 HA LYS A 16 -7.587 -0.181 1.689 1.00 0.35 H ATOM 264 HB2 LYS A 16 -5.022 1.312 2.268 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.495 1.361 3.224 1.00 0.43 H ATOM 266 HG2 LYS A 16 -6.199 -1.088 3.639 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.625 -0.972 2.862 1.00 0.78 H ATOM 268 HD2 LYS A 16 -4.318 -0.826 5.237 1.00 2.01 H ATOM 269 HD3 LYS A 16 -3.997 0.757 4.532 1.00 1.98 H ATOM 270 HE2 LYS A 16 -5.308 0.964 6.574 1.00 2.03 H ATOM 271 HE3 LYS A 16 -6.233 1.505 5.177 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -7.383 -0.577 5.190 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -7.520 0.105 6.656 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -6.492 -1.133 6.432 1.00 2.48 H ATOM 275 N MET A 17 -6.248 1.903 -0.416 1.00 0.37 N ATOM 276 CA MET A 17 -6.525 3.027 -1.304 1.00 0.49 C ATOM 277 C MET A 17 -7.643 2.685 -2.282 1.00 0.55 C ATOM 278 O MET A 17 -8.557 3.481 -2.500 1.00 0.66 O ATOM 279 CB MET A 17 -5.268 3.427 -2.088 1.00 0.60 C ATOM 280 CG MET A 17 -4.197 4.117 -1.253 1.00 0.69 C ATOM 281 SD MET A 17 -4.798 5.627 -0.471 1.00 1.70 S ATOM 282 CE MET A 17 -3.282 6.265 0.239 1.00 2.33 C ATOM 283 H MET A 17 -5.418 1.392 -0.536 1.00 0.37 H ATOM 284 HA MET A 17 -6.837 3.862 -0.694 1.00 0.54 H ATOM 285 HB2 MET A 17 -4.834 2.540 -2.521 1.00 1.19 H ATOM 286 HB3 MET A 17 -5.557 4.098 -2.885 1.00 1.22 H ATOM 287 HG2 MET A 17 -3.856 3.437 -0.485 1.00 1.19 H ATOM 288 HG3 MET A 17 -3.368 4.370 -1.898 1.00 1.28 H ATOM 289 HE1 MET A 17 -2.560 6.435 -0.546 1.00 2.74 H ATOM 290 HE2 MET A 17 -2.886 5.549 0.943 1.00 2.78 H ATOM 291 HE3 MET A 17 -3.487 7.195 0.747 1.00 2.74 H ATOM 292 N ALA A 18 -7.569 1.495 -2.862 1.00 0.57 N ATOM 293 CA ALA A 18 -8.528 1.076 -3.876 1.00 0.70 C ATOM 294 C ALA A 18 -9.836 0.594 -3.257 1.00 0.79 C ATOM 295 O ALA A 18 -10.917 0.935 -3.742 1.00 1.34 O ATOM 296 CB ALA A 18 -7.922 -0.013 -4.747 1.00 0.81 C ATOM 297 H ALA A 18 -6.845 0.884 -2.608 1.00 0.58 H ATOM 298 HA ALA A 18 -8.736 1.928 -4.507 1.00 0.78 H ATOM 299 HB1 ALA A 18 -7.732 -0.891 -4.146 1.00 1.33 H ATOM 300 HB2 ALA A 18 -6.995 0.340 -5.173 1.00 1.31 H ATOM 301 HB3 ALA A 18 -8.610 -0.264 -5.541 1.00 1.33 H ATOM 302 N LEU A 19 -9.721 -0.181 -2.180 1.00 0.75 N ATOM 303 CA LEU A 19 -10.868 -0.813 -1.529 1.00 0.82 C ATOM 304 C LEU A 19 -11.513 -1.838 -2.457 1.00 1.31 C ATOM 305 O LEU A 19 -11.044 -2.995 -2.470 1.00 1.89 O ATOM 306 CB LEU A 19 -11.901 0.222 -1.067 1.00 1.07 C ATOM 307 CG LEU A 19 -11.426 1.180 0.026 1.00 1.32 C ATOM 308 CD1 LEU A 19 -12.525 2.166 0.383 1.00 2.07 C ATOM 309 CD2 LEU A 19 -10.983 0.409 1.261 1.00 1.78 C ATOM 310 OXT LEU A 19 -12.479 -1.491 -3.170 1.00 1.90 O ATOM 311 H LEU A 19 -8.827 -0.335 -1.804 1.00 1.05 H ATOM 312 HA LEU A 19 -10.493 -1.337 -0.661 1.00 0.82 H ATOM 313 HB2 LEU A 19 -12.198 0.808 -1.925 1.00 1.70 H ATOM 314 HB3 LEU A 19 -12.768 -0.306 -0.698 1.00 1.39 H ATOM 315 HG LEU A 19 -10.578 1.742 -0.340 1.00 1.78 H ATOM 316 HD11 LEU A 19 -12.798 2.735 -0.494 1.00 2.52 H ATOM 317 HD12 LEU A 19 -12.173 2.836 1.152 1.00 2.57 H ATOM 318 HD13 LEU A 19 -13.389 1.627 0.743 1.00 2.47 H ATOM 319 HD21 LEU A 19 -11.797 -0.209 1.610 1.00 2.23 H ATOM 320 HD22 LEU A 19 -10.702 1.105 2.036 1.00 2.18 H ATOM 321 HD23 LEU A 19 -10.138 -0.215 1.012 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 3 ATOM 1 N GLY A 1 8.418 6.841 3.040 1.00 1.26 N ATOM 2 CA GLY A 1 6.998 7.135 2.742 1.00 0.47 C ATOM 3 C GLY A 1 6.167 5.874 2.678 1.00 0.35 C ATOM 4 O GLY A 1 6.698 4.787 2.440 1.00 0.42 O ATOM 5 H1 GLY A 1 8.945 7.687 3.069 1.00 1.79 H ATOM 6 H2 GLY A 1 8.803 6.249 2.332 1.00 1.72 H ATOM 7 H3 GLY A 1 8.495 6.376 3.923 1.00 1.76 H ATOM 8 HA2 GLY A 1 6.602 7.776 3.514 1.00 0.89 H ATOM 9 HA3 GLY A 1 6.936 7.645 1.793 1.00 0.90 H ATOM 10 N ILE A 2 4.868 6.008 2.886 1.00 0.27 N ATOM 11 CA ILE A 2 3.987 4.858 2.873 1.00 0.21 C ATOM 12 C ILE A 2 3.760 4.375 1.444 1.00 0.14 C ATOM 13 O ILE A 2 3.422 3.217 1.219 1.00 0.22 O ATOM 14 CB ILE A 2 2.623 5.168 3.539 1.00 0.27 C ATOM 15 CG1 ILE A 2 1.882 3.869 3.850 1.00 0.31 C ATOM 16 CG2 ILE A 2 1.768 6.077 2.665 1.00 0.33 C ATOM 17 CD1 ILE A 2 2.401 3.172 5.085 1.00 0.77 C ATOM 18 H ILE A 2 4.492 6.904 3.051 1.00 0.31 H ATOM 19 HA ILE A 2 4.466 4.068 3.435 1.00 0.27 H ATOM 20 HB ILE A 2 2.817 5.685 4.465 1.00 0.34 H ATOM 21 HG12 ILE A 2 0.833 4.073 3.995 1.00 0.63 H ATOM 22 HG13 ILE A 2 1.999 3.192 3.016 1.00 0.74 H ATOM 23 HG21 ILE A 2 0.818 6.252 3.148 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.602 5.605 1.708 1.00 1.10 H ATOM 25 HG23 ILE A 2 2.276 7.018 2.517 1.00 1.08 H ATOM 26 HD11 ILE A 2 1.848 2.258 5.240 1.00 1.38 H ATOM 27 HD12 ILE A 2 2.275 3.818 5.941 1.00 1.38 H ATOM 28 HD13 ILE A 2 3.448 2.943 4.957 1.00 1.42 H ATOM 29 N VAL A 3 3.975 5.268 0.482 1.00 0.14 N ATOM 30 CA VAL A 3 3.718 4.955 -0.919 1.00 0.20 C ATOM 31 C VAL A 3 4.701 3.905 -1.452 1.00 0.16 C ATOM 32 O VAL A 3 4.318 3.029 -2.223 1.00 0.19 O ATOM 33 CB VAL A 3 3.760 6.221 -1.810 1.00 0.33 C ATOM 34 CG1 VAL A 3 5.145 6.849 -1.817 1.00 0.92 C ATOM 35 CG2 VAL A 3 3.304 5.897 -3.227 1.00 0.94 C ATOM 36 H VAL A 3 4.299 6.163 0.724 1.00 0.20 H ATOM 37 HA VAL A 3 2.719 4.545 -0.973 1.00 0.25 H ATOM 38 HB VAL A 3 3.071 6.944 -1.397 1.00 0.65 H ATOM 39 HG11 VAL A 3 5.855 6.148 -2.231 1.00 1.51 H ATOM 40 HG12 VAL A 3 5.432 7.094 -0.806 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.133 7.746 -2.417 1.00 1.49 H ATOM 42 HG21 VAL A 3 3.952 5.144 -3.650 1.00 1.54 H ATOM 43 HG22 VAL A 3 3.348 6.789 -3.832 1.00 1.49 H ATOM 44 HG23 VAL A 3 2.290 5.527 -3.204 1.00 1.53 H ATOM 45 N THR A 4 5.959 3.980 -1.030 1.00 0.17 N ATOM 46 CA THR A 4 6.955 3.007 -1.449 1.00 0.21 C ATOM 47 C THR A 4 6.679 1.658 -0.800 1.00 0.18 C ATOM 48 O THR A 4 6.854 0.600 -1.422 1.00 0.21 O ATOM 49 CB THR A 4 8.376 3.483 -1.105 1.00 0.32 C ATOM 50 OG1 THR A 4 8.366 4.159 0.160 1.00 0.63 O ATOM 51 CG2 THR A 4 8.914 4.413 -2.181 1.00 0.66 C ATOM 52 H THR A 4 6.224 4.703 -0.423 1.00 0.21 H ATOM 53 HA THR A 4 6.881 2.895 -2.525 1.00 0.24 H ATOM 54 HB THR A 4 9.024 2.619 -1.040 1.00 0.54 H ATOM 55 HG1 THR A 4 8.789 3.601 0.824 1.00 1.24 H ATOM 56 HG21 THR A 4 8.261 5.268 -2.277 1.00 1.24 H ATOM 57 HG22 THR A 4 8.959 3.887 -3.122 1.00 1.30 H ATOM 58 HG23 THR A 4 9.904 4.746 -1.907 1.00 1.28 H ATOM 59 N LYS A 5 6.236 1.702 0.452 1.00 0.18 N ATOM 60 CA LYS A 5 5.739 0.516 1.115 1.00 0.27 C ATOM 61 C LYS A 5 4.601 -0.054 0.278 1.00 0.21 C ATOM 62 O LYS A 5 4.640 -1.210 -0.139 1.00 0.22 O ATOM 63 CB LYS A 5 5.240 0.857 2.525 1.00 0.46 C ATOM 64 CG LYS A 5 5.592 -0.195 3.563 1.00 0.94 C ATOM 65 CD LYS A 5 4.917 0.062 4.909 1.00 0.90 C ATOM 66 CE LYS A 5 3.398 -0.082 4.834 1.00 0.81 C ATOM 67 NZ LYS A 5 2.763 -0.013 6.179 1.00 1.23 N ATOM 68 H LYS A 5 6.259 2.551 0.943 1.00 0.19 H ATOM 69 HA LYS A 5 6.540 -0.204 1.174 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.679 1.796 2.831 1.00 1.25 H ATOM 71 HB3 LYS A 5 4.167 0.963 2.499 1.00 1.15 H ATOM 72 HG2 LYS A 5 5.287 -1.163 3.200 1.00 1.72 H ATOM 73 HG3 LYS A 5 6.663 -0.187 3.704 1.00 1.75 H ATOM 74 HD2 LYS A 5 5.297 -0.646 5.627 1.00 1.31 H ATOM 75 HD3 LYS A 5 5.158 1.064 5.232 1.00 1.33 H ATOM 76 HE2 LYS A 5 3.000 0.715 4.222 1.00 1.09 H ATOM 77 HE3 LYS A 5 3.155 -1.034 4.383 1.00 0.97 H ATOM 78 HZ1 LYS A 5 1.767 -0.055 6.091 1.00 1.66 H ATOM 79 HZ2 LYS A 5 3.007 0.841 6.634 1.00 1.71 H ATOM 80 HZ3 LYS A 5 3.070 -0.779 6.747 1.00 1.67 H ATOM 81 N LEU A 6 3.627 0.811 -0.007 1.00 0.21 N ATOM 82 CA LEU A 6 2.441 0.486 -0.808 1.00 0.25 C ATOM 83 C LEU A 6 2.789 -0.210 -2.127 1.00 0.21 C ATOM 84 O LEU A 6 1.938 -0.855 -2.738 1.00 0.26 O ATOM 85 CB LEU A 6 1.655 1.783 -1.061 1.00 0.36 C ATOM 86 CG LEU A 6 0.650 1.768 -2.216 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.546 2.633 -1.873 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.304 2.279 -3.493 1.00 1.21 C ATOM 89 H LEU A 6 3.706 1.726 0.345 1.00 0.22 H ATOM 90 HA LEU A 6 1.822 -0.178 -0.224 1.00 0.32 H ATOM 91 HB2 LEU A 6 1.118 2.029 -0.160 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.370 2.570 -1.253 1.00 0.85 H ATOM 93 HG LEU A 6 0.308 0.759 -2.386 1.00 1.34 H ATOM 94 HD11 LEU A 6 -1.044 2.226 -1.005 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.231 2.648 -2.707 1.00 1.71 H ATOM 96 HD13 LEU A 6 -0.215 3.638 -1.659 1.00 1.70 H ATOM 97 HD21 LEU A 6 2.167 1.671 -3.723 1.00 1.76 H ATOM 98 HD22 LEU A 6 1.613 3.303 -3.353 1.00 1.73 H ATOM 99 HD23 LEU A 6 0.596 2.222 -4.306 1.00 1.81 H ATOM 100 N ILE A 7 4.026 -0.078 -2.570 1.00 0.16 N ATOM 101 CA ILE A 7 4.450 -0.721 -3.794 1.00 0.18 C ATOM 102 C ILE A 7 4.622 -2.233 -3.600 1.00 0.16 C ATOM 103 O ILE A 7 3.885 -3.022 -4.192 1.00 0.19 O ATOM 104 CB ILE A 7 5.758 -0.106 -4.339 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.580 1.397 -4.565 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.168 -0.789 -5.634 1.00 0.27 C ATOM 107 CD1 ILE A 7 6.830 2.094 -5.062 1.00 1.07 C ATOM 108 H ILE A 7 4.664 0.463 -2.060 1.00 0.16 H ATOM 109 HA ILE A 7 3.677 -0.560 -4.529 1.00 0.23 H ATOM 110 HB ILE A 7 6.537 -0.264 -3.609 1.00 0.20 H ATOM 111 HG12 ILE A 7 4.803 1.554 -5.297 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.289 1.861 -3.634 1.00 0.79 H ATOM 113 HG21 ILE A 7 6.297 -1.846 -5.458 1.00 1.06 H ATOM 114 HG22 ILE A 7 7.099 -0.365 -5.981 1.00 1.06 H ATOM 115 HG23 ILE A 7 5.403 -0.637 -6.379 1.00 1.06 H ATOM 116 HD11 ILE A 7 7.629 1.954 -4.348 1.00 1.67 H ATOM 117 HD12 ILE A 7 6.632 3.149 -5.178 1.00 1.67 H ATOM 118 HD13 ILE A 7 7.120 1.676 -6.014 1.00 1.64 H ATOM 119 N LYS A 8 5.586 -2.650 -2.778 1.00 0.13 N ATOM 120 CA LYS A 8 5.886 -4.083 -2.677 1.00 0.12 C ATOM 121 C LYS A 8 5.137 -4.790 -1.549 1.00 0.11 C ATOM 122 O LYS A 8 4.172 -5.512 -1.785 1.00 0.13 O ATOM 123 CB LYS A 8 7.385 -4.331 -2.475 1.00 0.17 C ATOM 124 CG LYS A 8 8.264 -3.994 -3.673 1.00 0.49 C ATOM 125 CD LYS A 8 8.506 -2.496 -3.816 1.00 0.78 C ATOM 126 CE LYS A 8 9.309 -1.930 -2.652 1.00 0.98 C ATOM 127 NZ LYS A 8 10.654 -2.550 -2.543 1.00 1.70 N ATOM 128 H LYS A 8 6.082 -1.997 -2.232 1.00 0.13 H ATOM 129 HA LYS A 8 5.585 -4.536 -3.608 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.719 -3.735 -1.640 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.526 -5.375 -2.231 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.216 -4.487 -3.555 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.782 -4.357 -4.571 1.00 0.87 H ATOM 134 HD2 LYS A 8 9.049 -2.316 -4.731 1.00 1.28 H ATOM 135 HD3 LYS A 8 7.552 -1.994 -3.857 1.00 1.16 H ATOM 136 HE2 LYS A 8 9.426 -0.867 -2.798 1.00 1.43 H ATOM 137 HE3 LYS A 8 8.765 -2.106 -1.736 1.00 1.50 H ATOM 138 HZ1 LYS A 8 11.153 -2.445 -3.404 1.00 2.17 H ATOM 139 HZ2 LYS A 8 10.573 -3.523 -2.335 1.00 2.16 H ATOM 140 HZ3 LYS A 8 11.176 -2.109 -1.812 1.00 2.17 H ATOM 141 N LYS A 9 5.595 -4.582 -0.325 1.00 0.12 N ATOM 142 CA LYS A 9 5.071 -5.317 0.826 1.00 0.14 C ATOM 143 C LYS A 9 3.963 -4.529 1.500 1.00 0.13 C ATOM 144 O LYS A 9 2.934 -5.072 1.900 1.00 0.17 O ATOM 145 CB LYS A 9 6.190 -5.624 1.821 1.00 0.21 C ATOM 146 CG LYS A 9 7.322 -6.449 1.229 1.00 0.84 C ATOM 147 CD LYS A 9 6.841 -7.823 0.797 1.00 1.34 C ATOM 148 CE LYS A 9 7.958 -8.628 0.157 1.00 2.00 C ATOM 149 NZ LYS A 9 7.513 -10.000 -0.198 1.00 2.66 N ATOM 150 H LYS A 9 6.294 -3.906 -0.186 1.00 0.13 H ATOM 151 HA LYS A 9 4.666 -6.246 0.456 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.601 -4.694 2.179 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.774 -6.169 2.654 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.720 -5.931 0.369 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.095 -6.565 1.973 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.478 -8.356 1.663 1.00 1.78 H ATOM 157 HD3 LYS A 9 6.039 -7.706 0.082 1.00 1.82 H ATOM 158 HE2 LYS A 9 8.282 -8.121 -0.739 1.00 2.46 H ATOM 159 HE3 LYS A 9 8.782 -8.693 0.850 1.00 2.44 H ATOM 160 HZ1 LYS A 9 7.230 -10.493 0.624 1.00 3.04 H ATOM 161 HZ2 LYS A 9 8.257 -10.504 -0.634 1.00 3.03 H ATOM 162 HZ3 LYS A 9 6.738 -9.957 -0.831 1.00 3.05 H ATOM 163 N GLY A 10 4.210 -3.236 1.604 1.00 0.14 N ATOM 164 CA GLY A 10 3.240 -2.282 2.103 1.00 0.17 C ATOM 165 C GLY A 10 1.968 -2.273 1.297 1.00 0.16 C ATOM 166 O GLY A 10 1.002 -1.648 1.703 1.00 0.20 O ATOM 167 H GLY A 10 5.088 -2.903 1.312 1.00 0.15 H ATOM 168 HA2 GLY A 10 3.002 -2.529 3.126 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.673 -1.293 2.072 1.00 0.21 H ATOM 170 N VAL A 11 2.041 -2.872 0.102 1.00 0.14 N ATOM 171 CA VAL A 11 0.962 -2.910 -0.898 1.00 0.16 C ATOM 172 C VAL A 11 -0.440 -3.053 -0.280 1.00 0.16 C ATOM 173 O VAL A 11 -1.437 -2.695 -0.903 1.00 0.18 O ATOM 174 CB VAL A 11 1.217 -4.060 -1.899 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.053 -5.415 -1.230 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.309 -3.940 -3.107 1.00 0.23 C ATOM 177 H VAL A 11 2.873 -3.332 -0.118 1.00 0.14 H ATOM 178 HA VAL A 11 1.001 -1.984 -1.448 1.00 0.19 H ATOM 179 HB VAL A 11 2.242 -3.984 -2.243 1.00 0.19 H ATOM 180 HG11 VAL A 11 1.761 -5.501 -0.418 1.00 1.03 H ATOM 181 HG12 VAL A 11 1.235 -6.197 -1.951 1.00 1.04 H ATOM 182 HG13 VAL A 11 0.049 -5.506 -0.843 1.00 1.04 H ATOM 183 HG21 VAL A 11 0.487 -2.995 -3.596 1.00 1.06 H ATOM 184 HG22 VAL A 11 -0.720 -3.994 -2.787 1.00 1.04 H ATOM 185 HG23 VAL A 11 0.518 -4.747 -3.793 1.00 1.04 H ATOM 186 N LYS A 12 -0.498 -3.597 0.929 1.00 0.16 N ATOM 187 CA LYS A 12 -1.675 -3.514 1.788 1.00 0.19 C ATOM 188 C LYS A 12 -2.336 -2.126 1.699 1.00 0.15 C ATOM 189 O LYS A 12 -3.550 -2.020 1.517 1.00 0.14 O ATOM 190 CB LYS A 12 -1.235 -3.811 3.229 1.00 0.27 C ATOM 191 CG LYS A 12 -2.166 -3.278 4.316 1.00 0.46 C ATOM 192 CD LYS A 12 -3.588 -3.811 4.187 1.00 0.97 C ATOM 193 CE LYS A 12 -3.667 -5.302 4.482 1.00 1.65 C ATOM 194 NZ LYS A 12 -3.317 -5.616 5.894 1.00 2.26 N ATOM 195 H LYS A 12 0.289 -4.077 1.256 1.00 0.16 H ATOM 196 HA LYS A 12 -2.381 -4.265 1.470 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.150 -4.878 3.348 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.260 -3.371 3.383 1.00 0.33 H ATOM 199 HG2 LYS A 12 -1.775 -3.574 5.277 1.00 0.85 H ATOM 200 HG3 LYS A 12 -2.183 -2.198 4.256 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.223 -3.280 4.879 1.00 1.47 H ATOM 202 HD3 LYS A 12 -3.932 -3.636 3.177 1.00 1.42 H ATOM 203 HE2 LYS A 12 -4.675 -5.639 4.291 1.00 2.23 H ATOM 204 HE3 LYS A 12 -2.986 -5.823 3.826 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -2.396 -5.289 6.105 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -3.346 -6.605 6.043 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -3.968 -5.180 6.515 1.00 2.67 H ATOM 208 N LEU A 13 -1.522 -1.078 1.820 1.00 0.15 N ATOM 209 CA LEU A 13 -1.982 0.302 1.710 1.00 0.15 C ATOM 210 C LEU A 13 -2.734 0.507 0.400 1.00 0.13 C ATOM 211 O LEU A 13 -3.744 1.199 0.356 1.00 0.15 O ATOM 212 CB LEU A 13 -0.774 1.237 1.752 1.00 0.20 C ATOM 213 CG LEU A 13 -0.977 2.589 2.451 1.00 0.29 C ATOM 214 CD1 LEU A 13 -2.059 3.408 1.771 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.312 2.387 3.921 1.00 0.38 C ATOM 216 H LEU A 13 -0.564 -1.238 1.990 1.00 0.19 H ATOM 217 HA LEU A 13 -2.635 0.516 2.541 1.00 0.16 H ATOM 218 HB2 LEU A 13 0.032 0.717 2.244 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.475 1.432 0.735 1.00 0.21 H ATOM 220 HG LEU A 13 -0.054 3.151 2.392 1.00 0.30 H ATOM 221 HD11 LEU A 13 -1.805 3.543 0.731 1.00 1.08 H ATOM 222 HD12 LEU A 13 -2.136 4.371 2.251 1.00 1.08 H ATOM 223 HD13 LEU A 13 -3.004 2.890 1.847 1.00 1.09 H ATOM 224 HD21 LEU A 13 -0.508 1.852 4.403 1.00 1.09 H ATOM 225 HD22 LEU A 13 -2.227 1.820 4.009 1.00 1.09 H ATOM 226 HD23 LEU A 13 -1.439 3.349 4.395 1.00 1.10 H ATOM 227 N GLY A 14 -2.223 -0.103 -0.658 1.00 0.18 N ATOM 228 CA GLY A 14 -2.865 -0.028 -1.959 1.00 0.23 C ATOM 229 C GLY A 14 -4.296 -0.524 -1.921 1.00 0.22 C ATOM 230 O GLY A 14 -5.198 0.120 -2.455 1.00 0.29 O ATOM 231 H GLY A 14 -1.393 -0.616 -0.552 1.00 0.22 H ATOM 232 HA2 GLY A 14 -2.859 0.999 -2.294 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.306 -0.629 -2.661 1.00 0.29 H ATOM 234 N LEU A 15 -4.513 -1.658 -1.264 1.00 0.22 N ATOM 235 CA LEU A 15 -5.853 -2.208 -1.120 1.00 0.29 C ATOM 236 C LEU A 15 -6.683 -1.336 -0.188 1.00 0.28 C ATOM 237 O LEU A 15 -7.899 -1.245 -0.327 1.00 0.39 O ATOM 238 CB LEU A 15 -5.817 -3.646 -0.584 1.00 0.35 C ATOM 239 CG LEU A 15 -5.278 -4.716 -1.545 1.00 0.41 C ATOM 240 CD1 LEU A 15 -5.878 -4.552 -2.931 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.760 -4.688 -1.606 1.00 0.39 C ATOM 242 H LEU A 15 -3.754 -2.131 -0.862 1.00 0.22 H ATOM 243 HA LEU A 15 -6.316 -2.208 -2.096 1.00 0.36 H ATOM 244 HB2 LEU A 15 -5.206 -3.656 0.306 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.823 -3.920 -0.308 1.00 0.41 H ATOM 246 HG LEU A 15 -5.574 -5.688 -1.176 1.00 0.51 H ATOM 247 HD11 LEU A 15 -6.954 -4.590 -2.864 1.00 1.13 H ATOM 248 HD12 LEU A 15 -5.531 -5.351 -3.571 1.00 1.16 H ATOM 249 HD13 LEU A 15 -5.576 -3.602 -3.345 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.432 -3.721 -1.957 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.413 -5.453 -2.284 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.356 -4.869 -0.621 1.00 1.10 H ATOM 253 N LYS A 16 -6.014 -0.697 0.760 1.00 0.21 N ATOM 254 CA LYS A 16 -6.680 0.217 1.678 1.00 0.28 C ATOM 255 C LYS A 16 -7.077 1.503 0.957 1.00 0.34 C ATOM 256 O LYS A 16 -8.097 2.112 1.274 1.00 0.46 O ATOM 257 CB LYS A 16 -5.779 0.520 2.881 1.00 0.34 C ATOM 258 CG LYS A 16 -5.517 -0.697 3.765 1.00 0.39 C ATOM 259 CD LYS A 16 -6.778 -1.169 4.484 1.00 1.31 C ATOM 260 CE LYS A 16 -7.354 -0.086 5.386 1.00 1.54 C ATOM 261 NZ LYS A 16 -8.519 -0.573 6.173 1.00 2.08 N ATOM 262 H LYS A 16 -5.046 -0.848 0.847 1.00 0.18 H ATOM 263 HA LYS A 16 -7.578 -0.269 2.028 1.00 0.35 H ATOM 264 HB2 LYS A 16 -4.829 0.888 2.520 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.246 1.283 3.483 1.00 0.43 H ATOM 266 HG2 LYS A 16 -5.154 -1.503 3.144 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.765 -0.447 4.500 1.00 0.78 H ATOM 268 HD2 LYS A 16 -7.520 -1.441 3.749 1.00 2.01 H ATOM 269 HD3 LYS A 16 -6.534 -2.032 5.086 1.00 1.98 H ATOM 270 HE2 LYS A 16 -6.585 0.244 6.066 1.00 2.03 H ATOM 271 HE3 LYS A 16 -7.670 0.744 4.773 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -8.226 -1.274 6.824 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -9.208 -0.969 5.569 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -8.935 0.184 6.679 1.00 2.48 H ATOM 275 N MET A 17 -6.267 1.915 -0.014 1.00 0.37 N ATOM 276 CA MET A 17 -6.610 3.050 -0.864 1.00 0.49 C ATOM 277 C MET A 17 -7.764 2.676 -1.786 1.00 0.55 C ATOM 278 O MET A 17 -8.725 3.429 -1.937 1.00 0.66 O ATOM 279 CB MET A 17 -5.411 3.505 -1.709 1.00 0.60 C ATOM 280 CG MET A 17 -4.337 4.256 -0.937 1.00 0.69 C ATOM 281 SD MET A 17 -3.133 5.045 -2.029 1.00 1.70 S ATOM 282 CE MET A 17 -2.163 5.986 -0.852 1.00 2.33 C ATOM 283 H MET A 17 -5.411 1.448 -0.155 1.00 0.37 H ATOM 284 HA MET A 17 -6.923 3.862 -0.225 1.00 0.54 H ATOM 285 HB2 MET A 17 -4.955 2.634 -2.152 1.00 1.19 H ATOM 286 HB3 MET A 17 -5.770 4.149 -2.497 1.00 1.22 H ATOM 287 HG2 MET A 17 -4.808 5.016 -0.331 1.00 1.19 H ATOM 288 HG3 MET A 17 -3.815 3.557 -0.296 1.00 1.28 H ATOM 289 HE1 MET A 17 -2.807 6.667 -0.318 1.00 2.74 H ATOM 290 HE2 MET A 17 -1.404 6.546 -1.378 1.00 2.78 H ATOM 291 HE3 MET A 17 -1.691 5.312 -0.154 1.00 2.74 H ATOM 292 N ALA A 18 -7.664 1.497 -2.387 1.00 0.57 N ATOM 293 CA ALA A 18 -8.690 1.002 -3.295 1.00 0.70 C ATOM 294 C ALA A 18 -9.763 0.219 -2.543 1.00 0.79 C ATOM 295 O ALA A 18 -10.459 -0.613 -3.126 1.00 1.34 O ATOM 296 CB ALA A 18 -8.060 0.130 -4.370 1.00 0.81 C ATOM 297 H ALA A 18 -6.867 0.944 -2.224 1.00 0.58 H ATOM 298 HA ALA A 18 -9.148 1.853 -3.776 1.00 0.78 H ATOM 299 HB1 ALA A 18 -8.820 -0.182 -5.071 1.00 1.33 H ATOM 300 HB2 ALA A 18 -7.613 -0.741 -3.911 1.00 1.31 H ATOM 301 HB3 ALA A 18 -7.299 0.693 -4.891 1.00 1.33 H ATOM 302 N LEU A 19 -9.874 0.482 -1.248 1.00 0.75 N ATOM 303 CA LEU A 19 -10.863 -0.168 -0.398 1.00 0.82 C ATOM 304 C LEU A 19 -12.270 0.108 -0.925 1.00 1.31 C ATOM 305 O LEU A 19 -12.756 1.245 -0.756 1.00 1.89 O ATOM 306 CB LEU A 19 -10.713 0.339 1.045 1.00 1.07 C ATOM 307 CG LEU A 19 -11.290 -0.556 2.151 1.00 1.32 C ATOM 308 CD1 LEU A 19 -10.830 -0.062 3.513 1.00 2.07 C ATOM 309 CD2 LEU A 19 -12.810 -0.589 2.104 1.00 1.78 C ATOM 310 OXT LEU A 19 -12.884 -0.814 -1.500 1.00 1.90 O ATOM 311 H LEU A 19 -9.257 1.125 -0.845 1.00 1.05 H ATOM 312 HA LEU A 19 -10.677 -1.231 -0.422 1.00 0.82 H ATOM 313 HB2 LEU A 19 -9.661 0.475 1.243 1.00 1.70 H ATOM 314 HB3 LEU A 19 -11.196 1.302 1.110 1.00 1.39 H ATOM 315 HG LEU A 19 -10.926 -1.564 2.019 1.00 1.78 H ATOM 316 HD11 LEU A 19 -11.165 0.954 3.659 1.00 2.52 H ATOM 317 HD12 LEU A 19 -9.752 -0.097 3.563 1.00 2.57 H ATOM 318 HD13 LEU A 19 -11.247 -0.693 4.283 1.00 2.47 H ATOM 319 HD21 LEU A 19 -13.180 -1.214 2.903 1.00 2.23 H ATOM 320 HD22 LEU A 19 -13.133 -0.989 1.154 1.00 2.18 H ATOM 321 HD23 LEU A 19 -13.197 0.412 2.224 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 4 ATOM 1 N GLY A 1 8.638 6.249 3.134 1.00 1.26 N ATOM 2 CA GLY A 1 7.219 6.655 3.249 1.00 0.47 C ATOM 3 C GLY A 1 6.278 5.489 3.052 1.00 0.35 C ATOM 4 O GLY A 1 6.719 4.348 2.907 1.00 0.42 O ATOM 5 H1 GLY A 1 9.234 7.040 3.276 1.00 1.79 H ATOM 6 H2 GLY A 1 8.813 5.876 2.224 1.00 1.72 H ATOM 7 H3 GLY A 1 8.852 5.551 3.816 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.052 7.078 4.229 1.00 0.89 H ATOM 9 HA3 GLY A 1 7.007 7.406 2.504 1.00 0.90 H ATOM 10 N ILE A 2 4.983 5.768 3.035 1.00 0.27 N ATOM 11 CA ILE A 2 3.988 4.718 2.891 1.00 0.21 C ATOM 12 C ILE A 2 3.786 4.359 1.421 1.00 0.14 C ATOM 13 O ILE A 2 3.373 3.247 1.103 1.00 0.22 O ATOM 14 CB ILE A 2 2.629 5.118 3.516 1.00 0.27 C ATOM 15 CG1 ILE A 2 1.688 3.914 3.566 1.00 0.31 C ATOM 16 CG2 ILE A 2 1.984 6.263 2.745 1.00 0.33 C ATOM 17 CD1 ILE A 2 2.066 2.895 4.614 1.00 0.77 C ATOM 18 H ILE A 2 4.690 6.704 3.123 1.00 0.31 H ATOM 19 HA ILE A 2 4.354 3.846 3.412 1.00 0.27 H ATOM 20 HB ILE A 2 2.814 5.457 4.521 1.00 0.34 H ATOM 21 HG12 ILE A 2 0.683 4.246 3.775 1.00 0.63 H ATOM 22 HG13 ILE A 2 1.704 3.419 2.606 1.00 0.74 H ATOM 23 HG21 ILE A 2 1.057 6.542 3.223 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.785 5.945 1.733 1.00 1.10 H ATOM 25 HG23 ILE A 2 2.653 7.109 2.733 1.00 1.08 H ATOM 26 HD11 ILE A 2 2.070 3.363 5.587 1.00 1.38 H ATOM 27 HD12 ILE A 2 3.048 2.503 4.398 1.00 1.38 H ATOM 28 HD13 ILE A 2 1.349 2.088 4.607 1.00 1.42 H ATOM 29 N VAL A 3 4.096 5.290 0.526 1.00 0.14 N ATOM 30 CA VAL A 3 3.891 5.061 -0.901 1.00 0.20 C ATOM 31 C VAL A 3 4.839 3.980 -1.429 1.00 0.16 C ATOM 32 O VAL A 3 4.446 3.148 -2.242 1.00 0.19 O ATOM 33 CB VAL A 3 4.047 6.360 -1.732 1.00 0.33 C ATOM 34 CG1 VAL A 3 5.467 6.903 -1.658 1.00 0.92 C ATOM 35 CG2 VAL A 3 3.637 6.121 -3.180 1.00 0.94 C ATOM 36 H VAL A 3 4.456 6.150 0.834 1.00 0.20 H ATOM 37 HA VAL A 3 2.873 4.710 -1.022 1.00 0.25 H ATOM 38 HB VAL A 3 3.385 7.105 -1.317 1.00 0.65 H ATOM 39 HG11 VAL A 3 5.525 7.838 -2.194 1.00 1.51 H ATOM 40 HG12 VAL A 3 6.147 6.192 -2.103 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.740 7.061 -0.626 1.00 1.49 H ATOM 42 HG21 VAL A 3 2.593 5.848 -3.217 1.00 1.54 H ATOM 43 HG22 VAL A 3 4.231 5.320 -3.596 1.00 1.49 H ATOM 44 HG23 VAL A 3 3.795 7.022 -3.753 1.00 1.53 H ATOM 45 N THR A 4 6.078 3.980 -0.947 1.00 0.17 N ATOM 46 CA THR A 4 7.047 2.967 -1.338 1.00 0.21 C ATOM 47 C THR A 4 6.669 1.623 -0.735 1.00 0.18 C ATOM 48 O THR A 4 6.838 0.568 -1.361 1.00 0.21 O ATOM 49 CB THR A 4 8.466 3.368 -0.898 1.00 0.32 C ATOM 50 OG1 THR A 4 8.424 3.918 0.428 1.00 0.63 O ATOM 51 CG2 THR A 4 9.064 4.386 -1.857 1.00 0.66 C ATOM 52 H THR A 4 6.346 4.676 -0.313 1.00 0.21 H ATOM 53 HA THR A 4 7.029 2.884 -2.419 1.00 0.24 H ATOM 54 HB THR A 4 9.091 2.487 -0.895 1.00 0.54 H ATOM 55 HG1 THR A 4 8.720 3.251 1.059 1.00 1.24 H ATOM 56 HG21 THR A 4 9.116 3.960 -2.848 1.00 1.24 H ATOM 57 HG22 THR A 4 10.056 4.654 -1.527 1.00 1.30 H ATOM 58 HG23 THR A 4 8.441 5.269 -1.877 1.00 1.28 H ATOM 59 N LYS A 5 6.142 1.675 0.482 1.00 0.18 N ATOM 60 CA LYS A 5 5.559 0.506 1.106 1.00 0.27 C ATOM 61 C LYS A 5 4.463 -0.032 0.200 1.00 0.21 C ATOM 62 O LYS A 5 4.511 -1.184 -0.230 1.00 0.22 O ATOM 63 CB LYS A 5 4.978 0.868 2.477 1.00 0.46 C ATOM 64 CG LYS A 5 5.501 0.014 3.626 1.00 0.94 C ATOM 65 CD LYS A 5 4.805 0.364 4.936 1.00 0.90 C ATOM 66 CE LYS A 5 3.413 -0.258 5.036 1.00 0.81 C ATOM 67 NZ LYS A 5 3.469 -1.670 5.497 1.00 1.23 N ATOM 68 H LYS A 5 6.148 2.526 0.970 1.00 0.19 H ATOM 69 HA LYS A 5 6.329 -0.240 1.221 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.216 1.899 2.692 1.00 1.25 H ATOM 71 HB3 LYS A 5 3.905 0.761 2.438 1.00 1.15 H ATOM 72 HG2 LYS A 5 5.320 -1.026 3.401 1.00 1.72 H ATOM 73 HG3 LYS A 5 6.562 0.184 3.735 1.00 1.75 H ATOM 74 HD2 LYS A 5 5.406 0.003 5.756 1.00 1.31 H ATOM 75 HD3 LYS A 5 4.713 1.439 5.004 1.00 1.33 H ATOM 76 HE2 LYS A 5 2.823 0.314 5.735 1.00 1.09 H ATOM 77 HE3 LYS A 5 2.941 -0.225 4.063 1.00 0.97 H ATOM 78 HZ1 LYS A 5 3.866 -1.715 6.414 1.00 1.66 H ATOM 79 HZ2 LYS A 5 4.031 -2.219 4.881 1.00 1.71 H ATOM 80 HZ3 LYS A 5 2.547 -2.060 5.527 1.00 1.67 H ATOM 81 N LEU A 6 3.512 0.849 -0.123 1.00 0.21 N ATOM 82 CA LEU A 6 2.357 0.539 -0.976 1.00 0.25 C ATOM 83 C LEU A 6 2.756 -0.174 -2.270 1.00 0.21 C ATOM 84 O LEU A 6 1.928 -0.829 -2.906 1.00 0.26 O ATOM 85 CB LEU A 6 1.599 1.846 -1.280 1.00 0.36 C ATOM 86 CG LEU A 6 0.711 1.849 -2.526 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.559 2.636 -2.261 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.461 2.456 -3.705 1.00 1.21 C ATOM 89 H LEU A 6 3.590 1.765 0.232 1.00 0.22 H ATOM 90 HA LEU A 6 1.704 -0.110 -0.414 1.00 0.32 H ATOM 91 HB2 LEU A 6 0.974 2.078 -0.430 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.328 2.635 -1.388 1.00 0.85 H ATOM 93 HG LEU A 6 0.439 0.835 -2.780 1.00 1.34 H ATOM 94 HD11 LEU A 6 -1.107 2.171 -1.455 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.169 2.646 -3.151 1.00 1.71 H ATOM 96 HD13 LEU A 6 -0.306 3.648 -1.986 1.00 1.70 H ATOM 97 HD21 LEU A 6 0.834 2.428 -4.584 1.00 1.76 H ATOM 98 HD22 LEU A 6 2.364 1.891 -3.887 1.00 1.73 H ATOM 99 HD23 LEU A 6 1.718 3.479 -3.477 1.00 1.81 H ATOM 100 N ILE A 7 4.012 -0.051 -2.653 1.00 0.16 N ATOM 101 CA ILE A 7 4.506 -0.717 -3.837 1.00 0.18 C ATOM 102 C ILE A 7 4.620 -2.231 -3.615 1.00 0.16 C ATOM 103 O ILE A 7 3.845 -3.004 -4.185 1.00 0.19 O ATOM 104 CB ILE A 7 5.873 -0.144 -4.273 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.774 1.373 -4.472 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.355 -0.815 -5.551 1.00 0.27 C ATOM 107 CD1 ILE A 7 7.074 2.018 -4.903 1.00 1.07 C ATOM 108 H ILE A 7 4.622 0.503 -2.122 1.00 0.16 H ATOM 109 HA ILE A 7 3.798 -0.538 -4.632 1.00 0.23 H ATOM 110 HB ILE A 7 6.591 -0.351 -3.495 1.00 0.20 H ATOM 111 HG12 ILE A 7 5.032 1.586 -5.228 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.470 1.829 -3.541 1.00 0.79 H ATOM 113 HG21 ILE A 7 5.639 -0.642 -6.340 1.00 1.06 H ATOM 114 HG22 ILE A 7 6.459 -1.875 -5.383 1.00 1.06 H ATOM 115 HG23 ILE A 7 7.311 -0.398 -5.833 1.00 1.06 H ATOM 116 HD11 ILE A 7 6.929 3.083 -5.012 1.00 1.67 H ATOM 117 HD12 ILE A 7 7.387 1.599 -5.847 1.00 1.67 H ATOM 118 HD13 ILE A 7 7.832 1.833 -4.156 1.00 1.64 H ATOM 119 N LYS A 8 5.573 -2.662 -2.786 1.00 0.13 N ATOM 120 CA LYS A 8 5.866 -4.097 -2.682 1.00 0.12 C ATOM 121 C LYS A 8 5.116 -4.791 -1.542 1.00 0.11 C ATOM 122 O LYS A 8 4.157 -5.525 -1.769 1.00 0.13 O ATOM 123 CB LYS A 8 7.369 -4.353 -2.490 1.00 0.17 C ATOM 124 CG LYS A 8 8.291 -3.360 -3.190 1.00 0.49 C ATOM 125 CD LYS A 8 8.583 -2.150 -2.312 1.00 0.78 C ATOM 126 CE LYS A 8 9.484 -1.148 -3.017 1.00 0.98 C ATOM 127 NZ LYS A 8 10.824 -1.716 -3.316 1.00 1.70 N ATOM 128 H LYS A 8 6.064 -2.013 -2.232 1.00 0.13 H ATOM 129 HA LYS A 8 5.555 -4.551 -3.610 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.585 -4.325 -1.432 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.597 -5.342 -2.862 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.222 -3.853 -3.426 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.817 -3.027 -4.102 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.654 -1.665 -2.059 1.00 1.28 H ATOM 135 HD3 LYS A 8 9.072 -2.484 -1.410 1.00 1.16 H ATOM 136 HE2 LYS A 8 9.015 -0.851 -3.943 1.00 1.43 H ATOM 137 HE3 LYS A 8 9.602 -0.282 -2.383 1.00 1.50 H ATOM 138 HZ1 LYS A 8 11.397 -1.026 -3.759 1.00 2.17 H ATOM 139 HZ2 LYS A 8 10.739 -2.499 -3.929 1.00 2.16 H ATOM 140 HZ3 LYS A 8 11.268 -2.014 -2.473 1.00 2.17 H ATOM 141 N LYS A 9 5.575 -4.566 -0.315 1.00 0.12 N ATOM 142 CA LYS A 9 5.049 -5.284 0.848 1.00 0.14 C ATOM 143 C LYS A 9 3.947 -4.475 1.506 1.00 0.13 C ATOM 144 O LYS A 9 2.885 -4.989 1.860 1.00 0.17 O ATOM 145 CB LYS A 9 6.169 -5.578 1.849 1.00 0.21 C ATOM 146 CG LYS A 9 7.398 -6.206 1.211 1.00 0.84 C ATOM 147 CD LYS A 9 7.087 -7.567 0.607 1.00 1.34 C ATOM 148 CE LYS A 9 8.282 -8.128 -0.150 1.00 2.00 C ATOM 149 NZ LYS A 9 9.500 -8.205 0.698 1.00 2.66 N ATOM 150 H LYS A 9 6.273 -3.888 -0.182 1.00 0.13 H ATOM 151 HA LYS A 9 4.637 -6.215 0.496 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.464 -4.657 2.324 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.795 -6.257 2.601 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.756 -5.553 0.430 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.162 -6.322 1.965 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.823 -8.251 1.399 1.00 1.78 H ATOM 157 HD3 LYS A 9 6.257 -7.465 -0.075 1.00 1.82 H ATOM 158 HE2 LYS A 9 8.036 -9.119 -0.497 1.00 2.46 H ATOM 159 HE3 LYS A 9 8.484 -7.491 -0.999 1.00 2.44 H ATOM 160 HZ1 LYS A 9 10.246 -8.637 0.188 1.00 3.04 H ATOM 161 HZ2 LYS A 9 9.319 -8.744 1.518 1.00 3.03 H ATOM 162 HZ3 LYS A 9 9.788 -7.286 0.971 1.00 3.05 H ATOM 163 N GLY A 10 4.234 -3.194 1.652 1.00 0.14 N ATOM 164 CA GLY A 10 3.274 -2.211 2.112 1.00 0.17 C ATOM 165 C GLY A 10 2.005 -2.191 1.293 1.00 0.16 C ATOM 166 O GLY A 10 1.049 -1.533 1.679 1.00 0.20 O ATOM 167 H GLY A 10 5.142 -2.893 1.428 1.00 0.15 H ATOM 168 HA2 GLY A 10 3.021 -2.429 3.139 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.732 -1.234 2.065 1.00 0.21 H ATOM 170 N VAL A 11 2.067 -2.814 0.105 1.00 0.14 N ATOM 171 CA VAL A 11 0.973 -2.876 -0.878 1.00 0.16 C ATOM 172 C VAL A 11 -0.418 -3.010 -0.236 1.00 0.16 C ATOM 173 O VAL A 11 -1.425 -2.684 -0.858 1.00 0.18 O ATOM 174 CB VAL A 11 1.208 -4.051 -1.857 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.043 -5.391 -1.155 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.286 -3.951 -3.058 1.00 0.23 C ATOM 177 H VAL A 11 2.904 -3.266 -0.122 1.00 0.14 H ATOM 178 HA VAL A 11 1.001 -1.963 -1.450 1.00 0.19 H ATOM 179 HB VAL A 11 2.229 -3.988 -2.215 1.00 0.19 H ATOM 180 HG11 VAL A 11 1.761 -5.466 -0.352 1.00 1.03 H ATOM 181 HG12 VAL A 11 1.208 -6.190 -1.862 1.00 1.04 H ATOM 182 HG13 VAL A 11 0.044 -5.465 -0.753 1.00 1.04 H ATOM 183 HG21 VAL A 11 0.486 -4.771 -3.733 1.00 1.06 H ATOM 184 HG22 VAL A 11 0.458 -3.015 -3.566 1.00 1.04 H ATOM 185 HG23 VAL A 11 -0.740 -4.000 -2.725 1.00 1.04 H ATOM 186 N LYS A 12 -0.456 -3.510 0.993 1.00 0.16 N ATOM 187 CA LYS A 12 -1.627 -3.408 1.861 1.00 0.19 C ATOM 188 C LYS A 12 -2.312 -2.040 1.717 1.00 0.15 C ATOM 189 O LYS A 12 -3.529 -1.964 1.563 1.00 0.14 O ATOM 190 CB LYS A 12 -1.174 -3.624 3.313 1.00 0.27 C ATOM 191 CG LYS A 12 -2.149 -3.120 4.372 1.00 0.46 C ATOM 192 CD LYS A 12 -3.496 -3.825 4.302 1.00 0.97 C ATOM 193 CE LYS A 12 -3.392 -5.277 4.738 1.00 1.65 C ATOM 194 NZ LYS A 12 -4.691 -5.986 4.620 1.00 2.26 N ATOM 195 H LYS A 12 0.336 -3.975 1.327 1.00 0.16 H ATOM 196 HA LYS A 12 -2.324 -4.187 1.585 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.018 -4.679 3.471 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.234 -3.112 3.456 1.00 0.33 H ATOM 199 HG2 LYS A 12 -1.720 -3.297 5.348 1.00 0.85 H ATOM 200 HG3 LYS A 12 -2.294 -2.056 4.232 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.193 -3.312 4.949 1.00 1.47 H ATOM 202 HD3 LYS A 12 -3.856 -3.789 3.283 1.00 1.42 H ATOM 203 HE2 LYS A 12 -2.663 -5.776 4.118 1.00 2.23 H ATOM 204 HE3 LYS A 12 -3.069 -5.305 5.768 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -5.394 -5.508 5.146 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -4.609 -6.918 4.968 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -4.976 -6.026 3.660 1.00 2.67 H ATOM 208 N LEU A 13 -1.515 -0.971 1.747 1.00 0.15 N ATOM 209 CA LEU A 13 -2.015 0.392 1.604 1.00 0.15 C ATOM 210 C LEU A 13 -2.787 0.531 0.292 1.00 0.13 C ATOM 211 O LEU A 13 -3.802 1.218 0.226 1.00 0.15 O ATOM 212 CB LEU A 13 -0.826 1.366 1.643 1.00 0.20 C ATOM 213 CG LEU A 13 -1.125 2.829 2.028 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.961 3.537 0.980 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.811 2.893 3.383 1.00 0.38 C ATOM 216 H LEU A 13 -0.546 -1.104 1.867 1.00 0.19 H ATOM 217 HA LEU A 13 -2.676 0.599 2.431 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.107 0.980 2.350 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.370 1.363 0.668 1.00 0.21 H ATOM 220 HG LEU A 13 -0.188 3.363 2.107 1.00 0.30 H ATOM 221 HD11 LEU A 13 -2.162 4.549 1.303 1.00 1.08 H ATOM 222 HD12 LEU A 13 -2.892 3.009 0.848 1.00 1.08 H ATOM 223 HD13 LEU A 13 -1.423 3.560 0.045 1.00 1.09 H ATOM 224 HD21 LEU A 13 -1.951 3.926 3.664 1.00 1.09 H ATOM 225 HD22 LEU A 13 -1.199 2.398 4.121 1.00 1.09 H ATOM 226 HD23 LEU A 13 -2.771 2.404 3.324 1.00 1.10 H ATOM 227 N GLY A 14 -2.311 -0.154 -0.739 1.00 0.18 N ATOM 228 CA GLY A 14 -2.974 -0.132 -2.027 1.00 0.23 C ATOM 229 C GLY A 14 -4.368 -0.722 -1.957 1.00 0.22 C ATOM 230 O GLY A 14 -5.294 -0.216 -2.591 1.00 0.29 O ATOM 231 H GLY A 14 -1.506 -0.701 -0.619 1.00 0.22 H ATOM 232 HA2 GLY A 14 -3.043 0.891 -2.368 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.388 -0.699 -2.733 1.00 0.29 H ATOM 234 N LEU A 15 -4.520 -1.784 -1.174 1.00 0.22 N ATOM 235 CA LEU A 15 -5.823 -2.402 -0.966 1.00 0.29 C ATOM 236 C LEU A 15 -6.670 -1.533 -0.049 1.00 0.28 C ATOM 237 O LEU A 15 -7.895 -1.518 -0.141 1.00 0.39 O ATOM 238 CB LEU A 15 -5.686 -3.806 -0.362 1.00 0.35 C ATOM 239 CG LEU A 15 -5.159 -4.903 -1.300 1.00 0.41 C ATOM 240 CD1 LEU A 15 -5.986 -4.969 -2.573 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.689 -4.692 -1.628 1.00 0.39 C ATOM 242 H LEU A 15 -3.735 -2.160 -0.721 1.00 0.22 H ATOM 243 HA LEU A 15 -6.314 -2.475 -1.925 1.00 0.36 H ATOM 244 HB2 LEU A 15 -5.021 -3.741 0.486 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.661 -4.108 -0.008 1.00 0.41 H ATOM 246 HG LEU A 15 -5.251 -5.857 -0.800 1.00 0.51 H ATOM 247 HD11 LEU A 15 -5.626 -5.776 -3.193 1.00 1.13 H ATOM 248 HD12 LEU A 15 -5.894 -4.037 -3.111 1.00 1.16 H ATOM 249 HD13 LEU A 15 -7.021 -5.140 -2.324 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.359 -5.464 -2.307 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.105 -4.738 -0.720 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.559 -3.725 -2.091 1.00 1.10 H ATOM 253 N LYS A 16 -6.000 -0.810 0.838 1.00 0.21 N ATOM 254 CA LYS A 16 -6.665 0.142 1.718 1.00 0.28 C ATOM 255 C LYS A 16 -7.202 1.314 0.903 1.00 0.34 C ATOM 256 O LYS A 16 -8.197 1.938 1.268 1.00 0.46 O ATOM 257 CB LYS A 16 -5.693 0.638 2.796 1.00 0.34 C ATOM 258 CG LYS A 16 -5.156 -0.473 3.692 1.00 0.39 C ATOM 259 CD LYS A 16 -6.210 -0.986 4.664 1.00 1.31 C ATOM 260 CE LYS A 16 -6.217 -0.209 5.974 1.00 1.54 C ATOM 261 NZ LYS A 16 -6.599 1.220 5.801 1.00 2.08 N ATOM 262 H LYS A 16 -5.027 -0.926 0.910 1.00 0.18 H ATOM 263 HA LYS A 16 -7.493 -0.363 2.190 1.00 0.35 H ATOM 264 HB2 LYS A 16 -4.854 1.119 2.314 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.202 1.358 3.419 1.00 0.43 H ATOM 266 HG2 LYS A 16 -4.834 -1.294 3.068 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.311 -0.100 4.253 1.00 0.78 H ATOM 268 HD2 LYS A 16 -7.181 -0.895 4.205 1.00 2.01 H ATOM 269 HD3 LYS A 16 -6.010 -2.027 4.877 1.00 1.98 H ATOM 270 HE2 LYS A 16 -6.920 -0.675 6.648 1.00 2.03 H ATOM 271 HE3 LYS A 16 -5.227 -0.255 6.406 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -5.927 1.692 5.230 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -6.638 1.677 6.689 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -7.498 1.286 5.367 1.00 2.48 H ATOM 275 N MET A 17 -6.533 1.603 -0.208 1.00 0.37 N ATOM 276 CA MET A 17 -6.982 2.640 -1.130 1.00 0.49 C ATOM 277 C MET A 17 -8.093 2.112 -2.032 1.00 0.55 C ATOM 278 O MET A 17 -9.085 2.795 -2.279 1.00 0.66 O ATOM 279 CB MET A 17 -5.831 3.147 -2.006 1.00 0.60 C ATOM 280 CG MET A 17 -4.719 3.852 -1.247 1.00 0.69 C ATOM 281 SD MET A 17 -3.638 4.802 -2.338 1.00 1.70 S ATOM 282 CE MET A 17 -4.794 6.009 -2.987 1.00 2.33 C ATOM 283 H MET A 17 -5.705 1.113 -0.406 1.00 0.37 H ATOM 284 HA MET A 17 -7.369 3.460 -0.545 1.00 0.54 H ATOM 285 HB2 MET A 17 -5.399 2.306 -2.527 1.00 1.19 H ATOM 286 HB3 MET A 17 -6.231 3.836 -2.732 1.00 1.22 H ATOM 287 HG2 MET A 17 -5.158 4.523 -0.525 1.00 1.19 H ATOM 288 HG3 MET A 17 -4.120 3.109 -0.734 1.00 1.28 H ATOM 289 HE1 MET A 17 -4.271 6.699 -3.629 1.00 2.74 H ATOM 290 HE2 MET A 17 -5.248 6.550 -2.169 1.00 2.78 H ATOM 291 HE3 MET A 17 -5.562 5.504 -3.553 1.00 2.74 H ATOM 292 N ALA A 18 -7.909 0.896 -2.530 1.00 0.57 N ATOM 293 CA ALA A 18 -8.850 0.299 -3.467 1.00 0.70 C ATOM 294 C ALA A 18 -10.167 -0.060 -2.786 1.00 0.79 C ATOM 295 O ALA A 18 -11.228 0.418 -3.191 1.00 1.34 O ATOM 296 CB ALA A 18 -8.235 -0.932 -4.117 1.00 0.81 C ATOM 297 H ALA A 18 -7.112 0.389 -2.264 1.00 0.58 H ATOM 298 HA ALA A 18 -9.047 1.023 -4.244 1.00 0.78 H ATOM 299 HB1 ALA A 18 -8.072 -1.692 -3.368 1.00 1.33 H ATOM 300 HB2 ALA A 18 -7.290 -0.664 -4.569 1.00 1.31 H ATOM 301 HB3 ALA A 18 -8.903 -1.310 -4.876 1.00 1.33 H ATOM 302 N LEU A 19 -10.082 -0.886 -1.748 1.00 0.75 N ATOM 303 CA LEU A 19 -11.254 -1.362 -1.016 1.00 0.82 C ATOM 304 C LEU A 19 -12.266 -2.007 -1.960 1.00 1.31 C ATOM 305 O LEU A 19 -13.389 -1.476 -2.102 1.00 1.89 O ATOM 306 CB LEU A 19 -11.909 -0.215 -0.238 1.00 1.07 C ATOM 307 CG LEU A 19 -11.062 0.386 0.883 1.00 1.32 C ATOM 308 CD1 LEU A 19 -11.786 1.557 1.523 1.00 2.07 C ATOM 309 CD2 LEU A 19 -10.733 -0.668 1.929 1.00 1.78 C ATOM 310 OXT LEU A 19 -11.927 -3.037 -2.573 1.00 1.90 O ATOM 311 H LEU A 19 -9.195 -1.188 -1.455 1.00 1.05 H ATOM 312 HA LEU A 19 -10.915 -2.111 -0.314 1.00 0.82 H ATOM 313 HB2 LEU A 19 -12.149 0.572 -0.938 1.00 1.70 H ATOM 314 HB3 LEU A 19 -12.828 -0.580 0.194 1.00 1.39 H ATOM 315 HG LEU A 19 -10.132 0.751 0.469 1.00 1.78 H ATOM 316 HD11 LEU A 19 -11.178 1.967 2.315 1.00 2.52 H ATOM 317 HD12 LEU A 19 -12.728 1.221 1.928 1.00 2.57 H ATOM 318 HD13 LEU A 19 -11.967 2.318 0.778 1.00 2.47 H ATOM 319 HD21 LEU A 19 -11.650 -1.073 2.331 1.00 2.23 H ATOM 320 HD22 LEU A 19 -10.159 -0.218 2.724 1.00 2.18 H ATOM 321 HD23 LEU A 19 -10.159 -1.461 1.474 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 5 ATOM 1 N GLY A 1 8.496 6.467 2.343 1.00 1.26 N ATOM 2 CA GLY A 1 7.120 6.846 2.745 1.00 0.47 C ATOM 3 C GLY A 1 6.195 5.654 2.720 1.00 0.35 C ATOM 4 O GLY A 1 6.644 4.524 2.542 1.00 0.42 O ATOM 5 H1 GLY A 1 8.860 5.784 2.979 1.00 1.79 H ATOM 6 H2 GLY A 1 9.092 7.264 2.350 1.00 1.72 H ATOM 7 H3 GLY A 1 8.489 6.077 1.422 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.142 7.253 3.744 1.00 0.89 H ATOM 9 HA3 GLY A 1 6.749 7.598 2.064 1.00 0.90 H ATOM 10 N ILE A 2 4.902 5.887 2.882 1.00 0.27 N ATOM 11 CA ILE A 2 3.944 4.795 2.857 1.00 0.21 C ATOM 12 C ILE A 2 3.697 4.338 1.420 1.00 0.14 C ATOM 13 O ILE A 2 3.285 3.205 1.182 1.00 0.22 O ATOM 14 CB ILE A 2 2.598 5.176 3.518 1.00 0.27 C ATOM 15 CG1 ILE A 2 1.773 3.917 3.798 1.00 0.31 C ATOM 16 CG2 ILE A 2 1.815 6.152 2.653 1.00 0.33 C ATOM 17 CD1 ILE A 2 2.202 3.185 5.049 1.00 0.77 C ATOM 18 H ILE A 2 4.589 6.807 3.028 1.00 0.31 H ATOM 19 HA ILE A 2 4.372 3.971 3.412 1.00 0.27 H ATOM 20 HB ILE A 2 2.815 5.665 4.455 1.00 0.34 H ATOM 21 HG12 ILE A 2 0.730 4.178 3.905 1.00 0.63 H ATOM 22 HG13 ILE A 2 1.882 3.237 2.965 1.00 0.74 H ATOM 23 HG21 ILE A 2 0.877 6.386 3.132 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.625 5.705 1.689 1.00 1.10 H ATOM 25 HG23 ILE A 2 2.388 7.058 2.522 1.00 1.08 H ATOM 26 HD11 ILE A 2 2.098 3.839 5.901 1.00 1.38 H ATOM 27 HD12 ILE A 2 3.233 2.880 4.951 1.00 1.38 H ATOM 28 HD13 ILE A 2 1.580 2.313 5.186 1.00 1.42 H ATOM 29 N VAL A 3 3.971 5.222 0.463 1.00 0.14 N ATOM 30 CA VAL A 3 3.747 4.917 -0.944 1.00 0.20 C ATOM 31 C VAL A 3 4.758 3.885 -1.453 1.00 0.16 C ATOM 32 O VAL A 3 4.419 3.029 -2.263 1.00 0.19 O ATOM 33 CB VAL A 3 3.797 6.191 -1.823 1.00 0.33 C ATOM 34 CG1 VAL A 3 5.190 6.800 -1.838 1.00 0.92 C ATOM 35 CG2 VAL A 3 3.323 5.890 -3.237 1.00 0.94 C ATOM 36 H VAL A 3 4.317 6.106 0.713 1.00 0.20 H ATOM 37 HA VAL A 3 2.756 4.495 -1.026 1.00 0.25 H ATOM 38 HB VAL A 3 3.123 6.918 -1.394 1.00 0.65 H ATOM 39 HG11 VAL A 3 5.189 7.689 -2.450 1.00 1.51 H ATOM 40 HG12 VAL A 3 5.890 6.084 -2.244 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.482 7.055 -0.831 1.00 1.49 H ATOM 42 HG21 VAL A 3 3.363 6.793 -3.829 1.00 1.54 H ATOM 43 HG22 VAL A 3 2.307 5.525 -3.207 1.00 1.49 H ATOM 44 HG23 VAL A 3 3.962 5.141 -3.679 1.00 1.53 H ATOM 45 N THR A 4 5.990 3.954 -0.960 1.00 0.17 N ATOM 46 CA THR A 4 7.014 2.993 -1.342 1.00 0.21 C ATOM 47 C THR A 4 6.693 1.633 -0.745 1.00 0.18 C ATOM 48 O THR A 4 6.891 0.588 -1.381 1.00 0.21 O ATOM 49 CB THR A 4 8.411 3.458 -0.890 1.00 0.32 C ATOM 50 OG1 THR A 4 8.357 3.923 0.463 1.00 0.63 O ATOM 51 CG2 THR A 4 8.926 4.571 -1.786 1.00 0.66 C ATOM 52 H THR A 4 6.216 4.662 -0.325 1.00 0.21 H ATOM 53 HA THR A 4 7.007 2.909 -2.423 1.00 0.24 H ATOM 54 HB THR A 4 9.092 2.621 -0.953 1.00 0.54 H ATOM 55 HG1 THR A 4 8.787 3.277 1.041 1.00 1.24 H ATOM 56 HG21 THR A 4 8.982 4.217 -2.804 1.00 1.24 H ATOM 57 HG22 THR A 4 9.909 4.873 -1.454 1.00 1.30 H ATOM 58 HG23 THR A 4 8.254 5.415 -1.734 1.00 1.28 H ATOM 59 N LYS A 5 6.184 1.656 0.481 1.00 0.18 N ATOM 60 CA LYS A 5 5.656 0.463 1.101 1.00 0.27 C ATOM 61 C LYS A 5 4.532 -0.077 0.223 1.00 0.21 C ATOM 62 O LYS A 5 4.577 -1.225 -0.214 1.00 0.22 O ATOM 63 CB LYS A 5 5.135 0.775 2.510 1.00 0.46 C ATOM 64 CG LYS A 5 5.505 -0.279 3.544 1.00 0.94 C ATOM 65 CD LYS A 5 4.834 -0.032 4.891 1.00 0.90 C ATOM 66 CE LYS A 5 3.312 -0.096 4.806 1.00 0.81 C ATOM 67 NZ LYS A 5 2.681 0.006 6.146 1.00 1.23 N ATOM 68 H LYS A 5 6.175 2.498 0.980 1.00 0.19 H ATOM 69 HA LYS A 5 6.446 -0.269 1.160 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.542 1.722 2.829 1.00 1.25 H ATOM 71 HB3 LYS A 5 4.058 0.851 2.473 1.00 1.15 H ATOM 72 HG2 LYS A 5 5.212 -1.251 3.181 1.00 1.72 H ATOM 73 HG3 LYS A 5 6.576 -0.259 3.680 1.00 1.75 H ATOM 74 HD2 LYS A 5 5.172 -0.782 5.591 1.00 1.31 H ATOM 75 HD3 LYS A 5 5.123 0.946 5.249 1.00 1.33 H ATOM 76 HE2 LYS A 5 2.961 0.720 4.192 1.00 1.09 H ATOM 77 HE3 LYS A 5 3.022 -1.033 4.354 1.00 0.97 H ATOM 78 HZ1 LYS A 5 3.014 0.820 6.623 1.00 1.66 H ATOM 79 HZ2 LYS A 5 2.903 -0.799 6.694 1.00 1.71 H ATOM 80 HZ3 LYS A 5 1.688 0.067 6.054 1.00 1.67 H ATOM 81 N LEU A 6 3.559 0.794 -0.066 1.00 0.21 N ATOM 82 CA LEU A 6 2.400 0.479 -0.915 1.00 0.25 C ATOM 83 C LEU A 6 2.798 -0.232 -2.209 1.00 0.21 C ATOM 84 O LEU A 6 1.985 -0.932 -2.818 1.00 0.26 O ATOM 85 CB LEU A 6 1.634 1.779 -1.222 1.00 0.36 C ATOM 86 CG LEU A 6 0.712 1.761 -2.447 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.514 2.616 -2.192 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.452 2.272 -3.677 1.00 1.21 C ATOM 89 H LEU A 6 3.622 1.701 0.312 1.00 0.22 H ATOM 90 HA LEU A 6 1.749 -0.174 -0.353 1.00 0.32 H ATOM 91 HB2 LEU A 6 1.032 2.024 -0.361 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.359 2.565 -1.363 1.00 0.85 H ATOM 93 HG LEU A 6 0.387 0.749 -2.639 1.00 1.34 H ATOM 94 HD11 LEU A 6 -0.208 3.627 -1.966 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.063 2.211 -1.355 1.00 1.71 H ATOM 96 HD13 LEU A 6 -1.142 2.617 -3.070 1.00 1.70 H ATOM 97 HD21 LEU A 6 2.313 1.646 -3.865 1.00 1.76 H ATOM 98 HD22 LEU A 6 1.777 3.287 -3.504 1.00 1.73 H ATOM 99 HD23 LEU A 6 0.793 2.244 -4.532 1.00 1.81 H ATOM 100 N ILE A 7 4.037 -0.047 -2.630 1.00 0.16 N ATOM 101 CA ILE A 7 4.530 -0.701 -3.821 1.00 0.18 C ATOM 102 C ILE A 7 4.672 -2.213 -3.607 1.00 0.16 C ATOM 103 O ILE A 7 3.904 -2.991 -4.174 1.00 0.19 O ATOM 104 CB ILE A 7 5.878 -0.105 -4.282 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.735 1.397 -4.541 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.373 -0.807 -5.534 1.00 0.27 C ATOM 107 CD1 ILE A 7 7.029 2.072 -4.946 1.00 1.07 C ATOM 108 H ILE A 7 4.631 0.545 -2.124 1.00 0.16 H ATOM 109 HA ILE A 7 3.807 -0.535 -4.606 1.00 0.23 H ATOM 110 HB ILE A 7 6.602 -0.258 -3.499 1.00 0.20 H ATOM 111 HG12 ILE A 7 5.020 1.551 -5.335 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.376 1.876 -3.642 1.00 0.79 H ATOM 113 HG21 ILE A 7 5.639 -0.704 -6.318 1.00 1.06 H ATOM 114 HG22 ILE A 7 6.531 -1.854 -5.322 1.00 1.06 H ATOM 115 HG23 ILE A 7 7.302 -0.358 -5.849 1.00 1.06 H ATOM 116 HD11 ILE A 7 6.853 3.128 -5.091 1.00 1.67 H ATOM 117 HD12 ILE A 7 7.389 1.638 -5.868 1.00 1.67 H ATOM 118 HD13 ILE A 7 7.766 1.932 -4.170 1.00 1.64 H ATOM 119 N LYS A 8 5.639 -2.642 -2.792 1.00 0.13 N ATOM 120 CA LYS A 8 5.911 -4.079 -2.682 1.00 0.12 C ATOM 121 C LYS A 8 5.156 -4.748 -1.535 1.00 0.11 C ATOM 122 O LYS A 8 4.172 -5.452 -1.751 1.00 0.13 O ATOM 123 CB LYS A 8 7.406 -4.374 -2.484 1.00 0.17 C ATOM 124 CG LYS A 8 8.368 -3.569 -3.351 1.00 0.49 C ATOM 125 CD LYS A 8 8.666 -2.203 -2.752 1.00 0.78 C ATOM 126 CE LYS A 8 9.863 -1.537 -3.416 1.00 0.98 C ATOM 127 NZ LYS A 8 9.700 -1.408 -4.889 1.00 1.70 N ATOM 128 H LYS A 8 6.151 -1.993 -2.252 1.00 0.13 H ATOM 129 HA LYS A 8 5.587 -4.536 -3.604 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.650 -4.189 -1.449 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.572 -5.422 -2.688 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.294 -4.116 -3.446 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.929 -3.435 -4.328 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.803 -1.573 -2.878 1.00 1.28 H ATOM 135 HD3 LYS A 8 8.872 -2.323 -1.699 1.00 1.16 H ATOM 136 HE2 LYS A 8 9.989 -0.552 -2.991 1.00 1.43 H ATOM 137 HE3 LYS A 8 10.744 -2.128 -3.211 1.00 1.50 H ATOM 138 HZ1 LYS A 8 10.461 -0.881 -5.273 1.00 2.17 H ATOM 139 HZ2 LYS A 8 8.848 -0.942 -5.105 1.00 2.16 H ATOM 140 HZ3 LYS A 8 9.689 -2.314 -5.317 1.00 2.17 H ATOM 141 N LYS A 9 5.625 -4.516 -0.312 1.00 0.12 N ATOM 142 CA LYS A 9 5.120 -5.237 0.856 1.00 0.14 C ATOM 143 C LYS A 9 3.987 -4.470 1.506 1.00 0.13 C ATOM 144 O LYS A 9 2.957 -5.029 1.879 1.00 0.17 O ATOM 145 CB LYS A 9 6.237 -5.471 1.860 1.00 0.21 C ATOM 146 CG LYS A 9 7.387 -6.272 1.289 1.00 0.84 C ATOM 147 CD LYS A 9 8.282 -6.774 2.395 1.00 1.34 C ATOM 148 CE LYS A 9 9.465 -7.559 1.856 1.00 2.00 C ATOM 149 NZ LYS A 9 10.358 -8.025 2.947 1.00 2.66 N ATOM 150 H LYS A 9 6.320 -3.834 -0.189 1.00 0.13 H ATOM 151 HA LYS A 9 4.759 -6.192 0.520 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.617 -4.516 2.193 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.839 -6.007 2.709 1.00 0.64 H ATOM 154 HG2 LYS A 9 6.994 -7.114 0.742 1.00 1.45 H ATOM 155 HG3 LYS A 9 7.962 -5.641 0.628 1.00 1.47 H ATOM 156 HD2 LYS A 9 8.643 -5.931 2.958 1.00 1.78 H ATOM 157 HD3 LYS A 9 7.697 -7.414 3.035 1.00 1.82 H ATOM 158 HE2 LYS A 9 9.097 -8.415 1.311 1.00 2.46 H ATOM 159 HE3 LYS A 9 10.028 -6.923 1.189 1.00 2.44 H ATOM 160 HZ1 LYS A 9 11.103 -8.575 2.572 1.00 3.04 H ATOM 161 HZ2 LYS A 9 9.845 -8.583 3.599 1.00 3.03 H ATOM 162 HZ3 LYS A 9 10.746 -7.240 3.433 1.00 3.05 H ATOM 163 N GLY A 10 4.210 -3.175 1.616 1.00 0.14 N ATOM 164 CA GLY A 10 3.218 -2.231 2.088 1.00 0.17 C ATOM 165 C GLY A 10 1.950 -2.256 1.280 1.00 0.16 C ATOM 166 O GLY A 10 0.982 -1.622 1.666 1.00 0.20 O ATOM 167 H GLY A 10 5.093 -2.833 1.352 1.00 0.15 H ATOM 168 HA2 GLY A 10 2.979 -2.463 3.112 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.632 -1.233 2.040 1.00 0.21 H ATOM 170 N VAL A 11 2.028 -2.891 0.104 1.00 0.14 N ATOM 171 CA VAL A 11 0.955 -2.956 -0.899 1.00 0.16 C ATOM 172 C VAL A 11 -0.447 -3.048 -0.282 1.00 0.16 C ATOM 173 O VAL A 11 -1.431 -2.652 -0.905 1.00 0.18 O ATOM 174 CB VAL A 11 1.188 -4.166 -1.832 1.00 0.18 C ATOM 175 CG1 VAL A 11 0.979 -5.476 -1.085 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.296 -4.089 -3.056 1.00 0.23 C ATOM 177 H VAL A 11 2.860 -3.360 -0.097 1.00 0.14 H ATOM 178 HA VAL A 11 1.012 -2.061 -1.498 1.00 0.19 H ATOM 179 HB VAL A 11 2.220 -4.137 -2.167 1.00 0.19 H ATOM 180 HG11 VAL A 11 1.098 -6.304 -1.767 1.00 1.03 H ATOM 181 HG12 VAL A 11 -0.018 -5.494 -0.663 1.00 1.04 H ATOM 182 HG13 VAL A 11 1.706 -5.556 -0.291 1.00 1.04 H ATOM 183 HG21 VAL A 11 0.469 -4.951 -3.682 1.00 1.06 H ATOM 184 HG22 VAL A 11 0.523 -3.190 -3.608 1.00 1.04 H ATOM 185 HG23 VAL A 11 -0.738 -4.070 -2.745 1.00 1.04 H ATOM 186 N LYS A 12 -0.522 -3.583 0.929 1.00 0.16 N ATOM 187 CA LYS A 12 -1.711 -3.487 1.767 1.00 0.19 C ATOM 188 C LYS A 12 -2.346 -2.087 1.682 1.00 0.15 C ATOM 189 O LYS A 12 -3.551 -1.966 1.482 1.00 0.14 O ATOM 190 CB LYS A 12 -1.315 -3.827 3.212 1.00 0.27 C ATOM 191 CG LYS A 12 -2.291 -3.337 4.274 1.00 0.46 C ATOM 192 CD LYS A 12 -3.720 -3.801 4.011 1.00 0.97 C ATOM 193 CE LYS A 12 -3.923 -5.263 4.364 1.00 1.65 C ATOM 194 NZ LYS A 12 -5.338 -5.684 4.175 1.00 2.26 N ATOM 195 H LYS A 12 0.256 -4.066 1.272 1.00 0.16 H ATOM 196 HA LYS A 12 -2.425 -4.217 1.417 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.226 -4.897 3.299 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.351 -3.384 3.415 1.00 0.33 H ATOM 199 HG2 LYS A 12 -1.977 -3.719 5.234 1.00 0.85 H ATOM 200 HG3 LYS A 12 -2.264 -2.256 4.292 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.400 -3.198 4.597 1.00 1.47 H ATOM 202 HD3 LYS A 12 -3.933 -3.664 2.959 1.00 1.42 H ATOM 203 HE2 LYS A 12 -3.291 -5.865 3.729 1.00 2.23 H ATOM 204 HE3 LYS A 12 -3.645 -5.415 5.396 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -5.941 -5.137 4.758 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -5.450 -6.646 4.415 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -5.610 -5.556 3.220 1.00 2.67 H ATOM 208 N LEU A 13 -1.523 -1.043 1.817 1.00 0.15 N ATOM 209 CA LEU A 13 -1.975 0.340 1.716 1.00 0.15 C ATOM 210 C LEU A 13 -2.737 0.552 0.407 1.00 0.13 C ATOM 211 O LEU A 13 -3.749 1.243 0.375 1.00 0.15 O ATOM 212 CB LEU A 13 -0.751 1.268 1.791 1.00 0.20 C ATOM 213 CG LEU A 13 -0.997 2.732 2.205 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.787 3.493 1.159 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.705 2.796 3.550 1.00 0.38 C ATOM 216 H LEU A 13 -0.568 -1.207 1.990 1.00 0.19 H ATOM 217 HA LEU A 13 -2.631 0.546 2.545 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.055 0.840 2.496 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.282 1.270 0.821 1.00 0.21 H ATOM 220 HG LEU A 13 -0.043 3.225 2.311 1.00 0.30 H ATOM 221 HD11 LEU A 13 -1.975 4.496 1.510 1.00 1.08 H ATOM 222 HD12 LEU A 13 -2.727 2.990 0.985 1.00 1.08 H ATOM 223 HD13 LEU A 13 -1.223 3.532 0.240 1.00 1.09 H ATOM 224 HD21 LEU A 13 -2.676 2.333 3.468 1.00 1.09 H ATOM 225 HD22 LEU A 13 -1.823 3.828 3.844 1.00 1.09 H ATOM 226 HD23 LEU A 13 -1.118 2.275 4.290 1.00 1.10 H ATOM 227 N GLY A 14 -2.258 -0.075 -0.659 1.00 0.18 N ATOM 228 CA GLY A 14 -2.921 0.023 -1.945 1.00 0.23 C ATOM 229 C GLY A 14 -4.318 -0.560 -1.908 1.00 0.22 C ATOM 230 O GLY A 14 -5.245 -0.013 -2.506 1.00 0.29 O ATOM 231 H GLY A 14 -1.454 -0.629 -0.568 1.00 0.22 H ATOM 232 HA2 GLY A 14 -2.979 1.063 -2.230 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.339 -0.512 -2.681 1.00 0.29 H ATOM 234 N LEU A 15 -4.474 -1.661 -1.183 1.00 0.22 N ATOM 235 CA LEU A 15 -5.778 -2.281 -1.006 1.00 0.29 C ATOM 236 C LEU A 15 -6.645 -1.443 -0.077 1.00 0.28 C ATOM 237 O LEU A 15 -7.872 -1.494 -0.150 1.00 0.39 O ATOM 238 CB LEU A 15 -5.651 -3.704 -0.450 1.00 0.35 C ATOM 239 CG LEU A 15 -5.181 -4.778 -1.441 1.00 0.41 C ATOM 240 CD1 LEU A 15 -6.004 -4.725 -2.717 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.700 -4.634 -1.753 1.00 0.39 C ATOM 242 H LEU A 15 -3.690 -2.064 -0.751 1.00 0.22 H ATOM 243 HA LEU A 15 -6.255 -2.325 -1.974 1.00 0.36 H ATOM 244 HB2 LEU A 15 -4.952 -3.680 0.374 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.616 -3.999 -0.069 1.00 0.41 H ATOM 246 HG LEU A 15 -5.332 -5.750 -0.996 1.00 0.51 H ATOM 247 HD11 LEU A 15 -5.805 -3.800 -3.236 1.00 1.13 H ATOM 248 HD12 LEU A 15 -7.052 -4.779 -2.470 1.00 1.16 H ATOM 249 HD13 LEU A 15 -5.741 -5.557 -3.350 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.517 -3.662 -2.188 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.403 -5.402 -2.452 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.128 -4.735 -0.843 1.00 1.10 H ATOM 253 N LYS A 16 -5.999 -0.673 0.790 1.00 0.21 N ATOM 254 CA LYS A 16 -6.701 0.236 1.690 1.00 0.28 C ATOM 255 C LYS A 16 -7.153 1.478 0.925 1.00 0.34 C ATOM 256 O LYS A 16 -8.066 2.188 1.346 1.00 0.46 O ATOM 257 CB LYS A 16 -5.798 0.648 2.859 1.00 0.34 C ATOM 258 CG LYS A 16 -5.195 -0.528 3.617 1.00 0.39 C ATOM 259 CD LYS A 16 -4.293 -0.063 4.751 1.00 1.31 C ATOM 260 CE LYS A 16 -5.082 0.595 5.870 1.00 1.54 C ATOM 261 NZ LYS A 16 -6.012 -0.360 6.525 1.00 2.08 N ATOM 262 H LYS A 16 -5.019 -0.725 0.834 1.00 0.18 H ATOM 263 HA LYS A 16 -7.570 -0.276 2.073 1.00 0.35 H ATOM 264 HB2 LYS A 16 -4.988 1.252 2.477 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.376 1.237 3.554 1.00 0.43 H ATOM 266 HG2 LYS A 16 -5.991 -1.130 4.029 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.613 -1.123 2.929 1.00 0.78 H ATOM 268 HD2 LYS A 16 -3.769 -0.918 5.153 1.00 2.01 H ATOM 269 HD3 LYS A 16 -3.579 0.646 4.362 1.00 1.98 H ATOM 270 HE2 LYS A 16 -4.390 0.972 6.607 1.00 2.03 H ATOM 271 HE3 LYS A 16 -5.650 1.415 5.459 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -6.666 -0.715 5.858 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -6.517 0.096 7.257 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -5.501 -1.126 6.916 1.00 2.48 H ATOM 275 N MET A 17 -6.493 1.740 -0.196 1.00 0.37 N ATOM 276 CA MET A 17 -6.867 2.847 -1.065 1.00 0.49 C ATOM 277 C MET A 17 -7.986 2.422 -2.003 1.00 0.55 C ATOM 278 O MET A 17 -8.885 3.205 -2.320 1.00 0.66 O ATOM 279 CB MET A 17 -5.668 3.334 -1.885 1.00 0.60 C ATOM 280 CG MET A 17 -4.509 3.860 -1.052 1.00 0.69 C ATOM 281 SD MET A 17 -5.016 5.107 0.151 1.00 1.70 S ATOM 282 CE MET A 17 -5.708 6.355 -0.931 1.00 2.33 C ATOM 283 H MET A 17 -5.725 1.179 -0.439 1.00 0.37 H ATOM 284 HA MET A 17 -7.220 3.655 -0.441 1.00 0.54 H ATOM 285 HB2 MET A 17 -5.303 2.512 -2.482 1.00 1.19 H ATOM 286 HB3 MET A 17 -5.997 4.124 -2.544 1.00 1.22 H ATOM 287 HG2 MET A 17 -4.052 3.034 -0.526 1.00 1.19 H ATOM 288 HG3 MET A 17 -3.782 4.301 -1.718 1.00 1.28 H ATOM 289 HE1 MET A 17 -6.061 7.186 -0.342 1.00 2.74 H ATOM 290 HE2 MET A 17 -6.531 5.932 -1.488 1.00 2.78 H ATOM 291 HE3 MET A 17 -4.947 6.696 -1.616 1.00 2.74 H ATOM 292 N ALA A 18 -7.920 1.177 -2.452 1.00 0.57 N ATOM 293 CA ALA A 18 -8.931 0.629 -3.342 1.00 0.70 C ATOM 294 C ALA A 18 -10.190 0.251 -2.572 1.00 0.79 C ATOM 295 O ALA A 18 -11.287 0.695 -2.911 1.00 1.34 O ATOM 296 CB ALA A 18 -8.380 -0.579 -4.084 1.00 0.81 C ATOM 297 H ALA A 18 -7.160 0.615 -2.188 1.00 0.58 H ATOM 298 HA ALA A 18 -9.179 1.386 -4.070 1.00 0.78 H ATOM 299 HB1 ALA A 18 -7.481 -0.299 -4.612 1.00 1.33 H ATOM 300 HB2 ALA A 18 -9.116 -0.935 -4.790 1.00 1.31 H ATOM 301 HB3 ALA A 18 -8.152 -1.364 -3.376 1.00 1.33 H ATOM 302 N LEU A 19 -10.008 -0.548 -1.522 1.00 0.75 N ATOM 303 CA LEU A 19 -11.111 -1.072 -0.719 1.00 0.82 C ATOM 304 C LEU A 19 -12.008 -1.981 -1.555 1.00 1.31 C ATOM 305 O LEU A 19 -11.729 -3.198 -1.606 1.00 1.89 O ATOM 306 CB LEU A 19 -11.929 0.064 -0.089 1.00 1.07 C ATOM 307 CG LEU A 19 -11.168 0.943 0.906 1.00 1.32 C ATOM 308 CD1 LEU A 19 -12.048 2.086 1.383 1.00 2.07 C ATOM 309 CD2 LEU A 19 -10.681 0.117 2.087 1.00 1.78 C ATOM 310 OXT LEU A 19 -12.977 -1.482 -2.162 1.00 1.90 O ATOM 311 H LEU A 19 -9.091 -0.794 -1.272 1.00 1.05 H ATOM 312 HA LEU A 19 -10.676 -1.665 0.073 1.00 0.82 H ATOM 313 HB2 LEU A 19 -12.298 0.695 -0.885 1.00 1.70 H ATOM 314 HB3 LEU A 19 -12.773 -0.371 0.423 1.00 1.39 H ATOM 315 HG LEU A 19 -10.303 1.369 0.414 1.00 1.78 H ATOM 316 HD11 LEU A 19 -12.935 1.686 1.850 1.00 2.52 H ATOM 317 HD12 LEU A 19 -12.330 2.700 0.540 1.00 2.57 H ATOM 318 HD13 LEU A 19 -11.505 2.685 2.099 1.00 2.47 H ATOM 319 HD21 LEU A 19 -10.190 0.762 2.801 1.00 2.23 H ATOM 320 HD22 LEU A 19 -9.984 -0.633 1.740 1.00 2.18 H ATOM 321 HD23 LEU A 19 -11.523 -0.367 2.559 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 6 ATOM 1 N GLY A 1 8.857 6.429 2.174 1.00 1.26 N ATOM 2 CA GLY A 1 7.476 6.889 2.467 1.00 0.47 C ATOM 3 C GLY A 1 6.512 5.728 2.583 1.00 0.35 C ATOM 4 O GLY A 1 6.924 4.569 2.538 1.00 0.42 O ATOM 5 H1 GLY A 1 9.476 7.210 2.109 1.00 1.79 H ATOM 6 H2 GLY A 1 8.878 5.928 1.309 1.00 1.72 H ATOM 7 H3 GLY A 1 9.177 5.820 2.901 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.478 7.438 3.395 1.00 0.89 H ATOM 9 HA3 GLY A 1 7.148 7.542 1.671 1.00 0.90 H ATOM 10 N ILE A 2 5.227 6.020 2.728 1.00 0.27 N ATOM 11 CA ILE A 2 4.232 4.964 2.830 1.00 0.21 C ATOM 12 C ILE A 2 3.847 4.457 1.449 1.00 0.14 C ATOM 13 O ILE A 2 3.457 3.304 1.282 1.00 0.22 O ATOM 14 CB ILE A 2 2.963 5.417 3.581 1.00 0.27 C ATOM 15 CG1 ILE A 2 2.054 4.216 3.817 1.00 0.31 C ATOM 16 CG2 ILE A 2 2.215 6.485 2.797 1.00 0.33 C ATOM 17 CD1 ILE A 2 1.179 4.353 5.038 1.00 0.77 C ATOM 18 H ILE A 2 4.943 6.962 2.767 1.00 0.31 H ATOM 19 HA ILE A 2 4.674 4.149 3.386 1.00 0.27 H ATOM 20 HB ILE A 2 3.257 5.833 4.530 1.00 0.34 H ATOM 21 HG12 ILE A 2 1.408 4.091 2.960 1.00 0.63 H ATOM 22 HG13 ILE A 2 2.660 3.333 3.926 1.00 0.74 H ATOM 23 HG21 ILE A 2 2.869 7.321 2.609 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.360 6.815 3.368 1.00 1.10 H ATOM 25 HG23 ILE A 2 1.881 6.067 1.856 1.00 1.08 H ATOM 26 HD11 ILE A 2 1.803 4.481 5.910 1.00 1.38 H ATOM 27 HD12 ILE A 2 0.578 3.463 5.152 1.00 1.38 H ATOM 28 HD13 ILE A 2 0.536 5.212 4.926 1.00 1.42 H ATOM 29 N VAL A 3 3.977 5.313 0.453 1.00 0.14 N ATOM 30 CA VAL A 3 3.589 4.941 -0.891 1.00 0.20 C ATOM 31 C VAL A 3 4.582 3.939 -1.476 1.00 0.16 C ATOM 32 O VAL A 3 4.238 3.134 -2.337 1.00 0.19 O ATOM 33 CB VAL A 3 3.471 6.169 -1.824 1.00 0.33 C ATOM 34 CG1 VAL A 3 4.831 6.806 -2.070 1.00 0.92 C ATOM 35 CG2 VAL A 3 2.815 5.780 -3.139 1.00 0.94 C ATOM 36 H VAL A 3 4.328 6.212 0.630 1.00 0.20 H ATOM 37 HA VAL A 3 2.618 4.471 -0.816 1.00 0.25 H ATOM 38 HB VAL A 3 2.843 6.902 -1.339 1.00 0.65 H ATOM 39 HG11 VAL A 3 5.280 7.072 -1.128 1.00 1.51 H ATOM 40 HG12 VAL A 3 4.710 7.693 -2.676 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.467 6.102 -2.586 1.00 1.49 H ATOM 42 HG21 VAL A 3 3.404 5.012 -3.621 1.00 1.54 H ATOM 43 HG22 VAL A 3 2.756 6.646 -3.782 1.00 1.49 H ATOM 44 HG23 VAL A 3 1.821 5.405 -2.949 1.00 1.53 H ATOM 45 N THR A 4 5.815 3.980 -0.990 1.00 0.17 N ATOM 46 CA THR A 4 6.833 3.055 -1.442 1.00 0.21 C ATOM 47 C THR A 4 6.624 1.682 -0.813 1.00 0.18 C ATOM 48 O THR A 4 6.856 0.648 -1.454 1.00 0.21 O ATOM 49 CB THR A 4 8.244 3.586 -1.135 1.00 0.32 C ATOM 50 OG1 THR A 4 8.295 4.101 0.201 1.00 0.63 O ATOM 51 CG2 THR A 4 8.626 4.680 -2.118 1.00 0.66 C ATOM 52 H THR A 4 6.043 4.648 -0.312 1.00 0.21 H ATOM 53 HA THR A 4 6.733 2.957 -2.516 1.00 0.24 H ATOM 54 HB THR A 4 8.950 2.774 -1.229 1.00 0.54 H ATOM 55 HG1 THR A 4 8.629 3.415 0.796 1.00 1.24 H ATOM 56 HG21 THR A 4 7.910 5.485 -2.057 1.00 1.24 H ATOM 57 HG22 THR A 4 8.629 4.278 -3.121 1.00 1.30 H ATOM 58 HG23 THR A 4 9.610 5.053 -1.878 1.00 1.28 H ATOM 59 N LYS A 5 6.164 1.662 0.437 1.00 0.18 N ATOM 60 CA LYS A 5 5.755 0.424 1.038 1.00 0.27 C ATOM 61 C LYS A 5 4.547 -0.105 0.272 1.00 0.21 C ATOM 62 O LYS A 5 4.500 -1.278 -0.085 1.00 0.22 O ATOM 63 CB LYS A 5 5.464 0.608 2.538 1.00 0.46 C ATOM 64 CG LYS A 5 4.015 0.916 2.901 1.00 0.94 C ATOM 65 CD LYS A 5 3.665 0.392 4.290 1.00 0.90 C ATOM 66 CE LYS A 5 2.165 0.438 4.559 1.00 0.81 C ATOM 67 NZ LYS A 5 1.828 -0.112 5.899 1.00 1.23 N ATOM 68 H LYS A 5 6.124 2.483 0.963 1.00 0.19 H ATOM 69 HA LYS A 5 6.567 -0.277 0.921 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.753 -0.283 3.045 1.00 1.25 H ATOM 71 HB3 LYS A 5 6.076 1.421 2.902 1.00 1.15 H ATOM 72 HG2 LYS A 5 3.878 1.987 2.888 1.00 1.72 H ATOM 73 HG3 LYS A 5 3.361 0.464 2.172 1.00 1.75 H ATOM 74 HD2 LYS A 5 4.001 -0.630 4.371 1.00 1.31 H ATOM 75 HD3 LYS A 5 4.171 0.998 5.028 1.00 1.33 H ATOM 76 HE2 LYS A 5 1.831 1.463 4.507 1.00 1.09 H ATOM 77 HE3 LYS A 5 1.653 -0.145 3.803 1.00 0.97 H ATOM 78 HZ1 LYS A 5 0.856 0.028 6.096 1.00 1.66 H ATOM 79 HZ2 LYS A 5 2.368 0.341 6.608 1.00 1.71 H ATOM 80 HZ3 LYS A 5 2.023 -1.094 5.927 1.00 1.67 H ATOM 81 N LEU A 6 3.619 0.805 -0.047 1.00 0.21 N ATOM 82 CA LEU A 6 2.423 0.500 -0.837 1.00 0.25 C ATOM 83 C LEU A 6 2.776 -0.197 -2.151 1.00 0.21 C ATOM 84 O LEU A 6 1.929 -0.832 -2.778 1.00 0.26 O ATOM 85 CB LEU A 6 1.641 1.802 -1.084 1.00 0.36 C ATOM 86 CG LEU A 6 0.630 1.803 -2.234 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.511 2.749 -1.914 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.297 2.230 -3.535 1.00 1.21 C ATOM 89 H LEU A 6 3.742 1.727 0.272 1.00 0.22 H ATOM 90 HA LEU A 6 1.804 -0.165 -0.252 1.00 0.32 H ATOM 91 HB2 LEU A 6 1.104 2.043 -0.178 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.358 2.586 -1.268 1.00 0.85 H ATOM 93 HG LEU A 6 0.227 0.809 -2.365 1.00 1.34 H ATOM 94 HD11 LEU A 6 -0.121 3.740 -1.741 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.023 2.402 -1.030 1.00 1.71 H ATOM 96 HD13 LEU A 6 -1.202 2.772 -2.744 1.00 1.70 H ATOM 97 HD21 LEU A 6 2.105 1.550 -3.764 1.00 1.76 H ATOM 98 HD22 LEU A 6 1.690 3.229 -3.425 1.00 1.73 H ATOM 99 HD23 LEU A 6 0.573 2.212 -4.334 1.00 1.81 H ATOM 100 N ILE A 7 4.021 -0.077 -2.567 1.00 0.16 N ATOM 101 CA ILE A 7 4.476 -0.744 -3.765 1.00 0.18 C ATOM 102 C ILE A 7 4.613 -2.253 -3.541 1.00 0.16 C ATOM 103 O ILE A 7 3.840 -3.034 -4.098 1.00 0.19 O ATOM 104 CB ILE A 7 5.817 -0.167 -4.263 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.700 1.342 -4.474 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.246 -0.851 -5.551 1.00 0.27 C ATOM 107 CD1 ILE A 7 6.992 1.994 -4.922 1.00 1.07 C ATOM 108 H ILE A 7 4.648 0.476 -2.056 1.00 0.16 H ATOM 109 HA ILE A 7 3.735 -0.576 -4.532 1.00 0.23 H ATOM 110 HB ILE A 7 6.568 -0.361 -3.513 1.00 0.20 H ATOM 111 HG12 ILE A 7 4.950 1.541 -5.225 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.401 1.802 -3.544 1.00 0.79 H ATOM 113 HG21 ILE A 7 5.484 -0.713 -6.303 1.00 1.06 H ATOM 114 HG22 ILE A 7 6.387 -1.905 -5.369 1.00 1.06 H ATOM 115 HG23 ILE A 7 7.173 -0.417 -5.895 1.00 1.06 H ATOM 116 HD11 ILE A 7 6.842 3.058 -5.022 1.00 1.67 H ATOM 117 HD12 ILE A 7 7.293 1.581 -5.872 1.00 1.67 H ATOM 118 HD13 ILE A 7 7.762 1.807 -4.188 1.00 1.64 H ATOM 119 N LYS A 8 5.583 -2.673 -2.726 1.00 0.13 N ATOM 120 CA LYS A 8 5.898 -4.105 -2.643 1.00 0.12 C ATOM 121 C LYS A 8 5.164 -4.829 -1.515 1.00 0.11 C ATOM 122 O LYS A 8 4.202 -5.555 -1.754 1.00 0.13 O ATOM 123 CB LYS A 8 7.399 -4.338 -2.453 1.00 0.17 C ATOM 124 CG LYS A 8 8.297 -3.456 -3.314 1.00 0.49 C ATOM 125 CD LYS A 8 8.612 -2.131 -2.633 1.00 0.78 C ATOM 126 CE LYS A 8 9.417 -1.211 -3.537 1.00 0.98 C ATOM 127 NZ LYS A 8 10.706 -1.823 -3.954 1.00 1.70 N ATOM 128 H LYS A 8 6.073 -2.021 -2.170 1.00 0.13 H ATOM 129 HA LYS A 8 5.598 -4.551 -3.578 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.640 -4.168 -1.415 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.615 -5.370 -2.691 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.221 -3.978 -3.503 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.796 -3.259 -4.251 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.688 -1.642 -2.371 1.00 1.28 H ATOM 135 HD3 LYS A 8 9.183 -2.326 -1.738 1.00 1.16 H ATOM 136 HE2 LYS A 8 8.833 -0.995 -4.419 1.00 1.43 H ATOM 137 HE3 LYS A 8 9.619 -0.293 -3.007 1.00 1.50 H ATOM 138 HZ1 LYS A 8 11.252 -2.059 -3.151 1.00 2.17 H ATOM 139 HZ2 LYS A 8 11.226 -1.179 -4.516 1.00 2.16 H ATOM 140 HZ3 LYS A 8 10.539 -2.651 -4.490 1.00 2.17 H ATOM 141 N LYS A 9 5.625 -4.630 -0.286 1.00 0.12 N ATOM 142 CA LYS A 9 5.109 -5.384 0.854 1.00 0.14 C ATOM 143 C LYS A 9 3.989 -4.623 1.535 1.00 0.13 C ATOM 144 O LYS A 9 2.958 -5.181 1.910 1.00 0.17 O ATOM 145 CB LYS A 9 6.223 -5.693 1.860 1.00 0.21 C ATOM 146 CG LYS A 9 7.322 -6.592 1.307 1.00 0.84 C ATOM 147 CD LYS A 9 6.770 -7.914 0.785 1.00 1.34 C ATOM 148 CE LYS A 9 5.998 -8.679 1.853 1.00 2.00 C ATOM 149 NZ LYS A 9 6.854 -9.079 3.000 1.00 2.66 N ATOM 150 H LYS A 9 6.318 -3.952 -0.140 1.00 0.13 H ATOM 151 HA LYS A 9 4.720 -6.309 0.471 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.675 -4.764 2.175 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.789 -6.180 2.720 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.818 -6.079 0.496 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.034 -6.796 2.092 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.109 -7.713 -0.044 1.00 1.78 H ATOM 157 HD3 LYS A 9 7.594 -8.524 0.446 1.00 1.82 H ATOM 158 HE2 LYS A 9 5.199 -8.052 2.216 1.00 2.46 H ATOM 159 HE3 LYS A 9 5.577 -9.565 1.404 1.00 2.44 H ATOM 160 HZ1 LYS A 9 7.252 -8.272 3.433 1.00 3.04 H ATOM 161 HZ2 LYS A 9 7.594 -9.674 2.689 1.00 3.03 H ATOM 162 HZ3 LYS A 9 6.310 -9.574 3.677 1.00 3.05 H ATOM 163 N GLY A 10 4.229 -3.336 1.679 1.00 0.14 N ATOM 164 CA GLY A 10 3.263 -2.402 2.216 1.00 0.17 C ATOM 165 C GLY A 10 1.999 -2.330 1.390 1.00 0.16 C ATOM 166 O GLY A 10 1.027 -1.715 1.817 1.00 0.20 O ATOM 167 H GLY A 10 5.103 -2.991 1.392 1.00 0.15 H ATOM 168 HA2 GLY A 10 3.007 -2.701 3.221 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.713 -1.424 2.245 1.00 0.21 H ATOM 170 N VAL A 11 2.088 -2.863 0.162 1.00 0.14 N ATOM 171 CA VAL A 11 1.040 -2.807 -0.869 1.00 0.16 C ATOM 172 C VAL A 11 -0.386 -2.916 -0.311 1.00 0.16 C ATOM 173 O VAL A 11 -1.333 -2.432 -0.931 1.00 0.18 O ATOM 174 CB VAL A 11 1.276 -3.917 -1.922 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.091 -5.298 -1.316 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.372 -3.729 -3.128 1.00 0.23 C ATOM 177 H VAL A 11 2.916 -3.327 -0.065 1.00 0.14 H ATOM 178 HA VAL A 11 1.135 -1.857 -1.372 1.00 0.19 H ATOM 179 HB VAL A 11 2.301 -3.839 -2.260 1.00 0.19 H ATOM 180 HG11 VAL A 11 1.807 -5.439 -0.520 1.00 1.03 H ATOM 181 HG12 VAL A 11 1.247 -6.047 -2.078 1.00 1.04 H ATOM 182 HG13 VAL A 11 0.091 -5.386 -0.921 1.00 1.04 H ATOM 183 HG21 VAL A 11 -0.659 -3.785 -2.814 1.00 1.06 H ATOM 184 HG22 VAL A 11 0.574 -4.505 -3.852 1.00 1.04 H ATOM 185 HG23 VAL A 11 0.564 -2.763 -3.571 1.00 1.04 H ATOM 186 N LYS A 12 -0.525 -3.542 0.850 1.00 0.16 N ATOM 187 CA LYS A 12 -1.770 -3.520 1.610 1.00 0.19 C ATOM 188 C LYS A 12 -2.393 -2.117 1.628 1.00 0.15 C ATOM 189 O LYS A 12 -3.606 -1.978 1.495 1.00 0.14 O ATOM 190 CB LYS A 12 -1.495 -3.984 3.042 1.00 0.27 C ATOM 191 CG LYS A 12 -2.657 -3.762 4.000 1.00 0.46 C ATOM 192 CD LYS A 12 -3.887 -4.566 3.601 1.00 0.97 C ATOM 193 CE LYS A 12 -3.666 -6.054 3.816 1.00 1.65 C ATOM 194 NZ LYS A 12 -4.854 -6.860 3.441 1.00 2.26 N ATOM 195 H LYS A 12 0.237 -4.040 1.206 1.00 0.16 H ATOM 196 HA LYS A 12 -2.459 -4.206 1.144 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.260 -5.036 3.027 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.640 -3.444 3.420 1.00 0.33 H ATOM 199 HG2 LYS A 12 -2.354 -4.061 4.992 1.00 0.85 H ATOM 200 HG3 LYS A 12 -2.907 -2.709 4.001 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.729 -4.240 4.196 1.00 1.47 H ATOM 202 HD3 LYS A 12 -4.096 -4.389 2.555 1.00 1.42 H ATOM 203 HE2 LYS A 12 -2.826 -6.371 3.217 1.00 2.23 H ATOM 204 HE3 LYS A 12 -3.444 -6.221 4.859 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -5.094 -6.699 2.484 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -5.633 -6.614 4.012 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -4.660 -7.834 3.567 1.00 2.67 H ATOM 208 N LEU A 13 -1.555 -1.086 1.774 1.00 0.15 N ATOM 209 CA LEU A 13 -2.018 0.296 1.797 1.00 0.15 C ATOM 210 C LEU A 13 -2.822 0.587 0.532 1.00 0.13 C ATOM 211 O LEU A 13 -3.904 1.162 0.596 1.00 0.15 O ATOM 212 CB LEU A 13 -0.808 1.244 1.921 1.00 0.20 C ATOM 213 CG LEU A 13 -1.085 2.664 2.446 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.904 3.480 1.462 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.781 2.609 3.799 1.00 0.38 C ATOM 216 H LEU A 13 -0.591 -1.262 1.868 1.00 0.19 H ATOM 217 HA LEU A 13 -2.658 0.422 2.655 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.092 0.781 2.583 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.352 1.334 0.948 1.00 0.21 H ATOM 220 HG LEU A 13 -0.141 3.170 2.579 1.00 0.30 H ATOM 221 HD11 LEU A 13 -1.342 3.613 0.549 1.00 1.08 H ATOM 222 HD12 LEU A 13 -2.127 4.445 1.892 1.00 1.08 H ATOM 223 HD13 LEU A 13 -2.826 2.960 1.245 1.00 1.09 H ATOM 224 HD21 LEU A 13 -2.744 2.134 3.691 1.00 1.09 H ATOM 225 HD22 LEU A 13 -1.915 3.613 4.175 1.00 1.09 H ATOM 226 HD23 LEU A 13 -1.176 2.044 4.491 1.00 1.10 H ATOM 227 N GLY A 14 -2.305 0.135 -0.606 1.00 0.18 N ATOM 228 CA GLY A 14 -2.987 0.335 -1.870 1.00 0.23 C ATOM 229 C GLY A 14 -4.315 -0.389 -1.915 1.00 0.22 C ATOM 230 O GLY A 14 -5.296 0.128 -2.446 1.00 0.29 O ATOM 231 H GLY A 14 -1.457 -0.357 -0.585 1.00 0.22 H ATOM 232 HA2 GLY A 14 -3.156 1.392 -2.016 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.360 -0.034 -2.669 1.00 0.29 H ATOM 234 N LEU A 15 -4.355 -1.580 -1.334 1.00 0.22 N ATOM 235 CA LEU A 15 -5.583 -2.359 -1.287 1.00 0.29 C ATOM 236 C LEU A 15 -6.583 -1.743 -0.318 1.00 0.28 C ATOM 237 O LEU A 15 -7.788 -1.892 -0.488 1.00 0.39 O ATOM 238 CB LEU A 15 -5.310 -3.820 -0.908 1.00 0.35 C ATOM 239 CG LEU A 15 -4.780 -4.713 -2.040 1.00 0.41 C ATOM 240 CD1 LEU A 15 -5.661 -4.596 -3.276 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.337 -4.372 -2.377 1.00 0.39 C ATOM 242 H LEU A 15 -3.537 -1.945 -0.930 1.00 0.22 H ATOM 243 HA LEU A 15 -6.016 -2.334 -2.275 1.00 0.36 H ATOM 244 HB2 LEU A 15 -4.589 -3.830 -0.105 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.230 -4.250 -0.544 1.00 0.41 H ATOM 246 HG LEU A 15 -4.809 -5.742 -1.713 1.00 0.51 H ATOM 247 HD11 LEU A 15 -5.336 -5.311 -4.018 1.00 1.13 H ATOM 248 HD12 LEU A 15 -5.581 -3.598 -3.683 1.00 1.16 H ATOM 249 HD13 LEU A 15 -6.687 -4.795 -3.009 1.00 1.18 H ATOM 250 HD21 LEU A 15 -2.992 -5.012 -3.175 1.00 1.08 H ATOM 251 HD22 LEU A 15 -2.718 -4.522 -1.503 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.274 -3.341 -2.690 1.00 1.10 H ATOM 253 N LYS A 16 -6.088 -1.045 0.695 1.00 0.21 N ATOM 254 CA LYS A 16 -6.967 -0.348 1.626 1.00 0.28 C ATOM 255 C LYS A 16 -7.415 0.980 1.025 1.00 0.34 C ATOM 256 O LYS A 16 -8.318 1.638 1.539 1.00 0.46 O ATOM 257 CB LYS A 16 -6.279 -0.095 2.971 1.00 0.34 C ATOM 258 CG LYS A 16 -5.697 -1.339 3.628 1.00 0.39 C ATOM 259 CD LYS A 16 -5.378 -1.124 5.107 1.00 1.31 C ATOM 260 CE LYS A 16 -4.396 0.021 5.344 1.00 1.54 C ATOM 261 NZ LYS A 16 -5.060 1.355 5.341 1.00 2.08 N ATOM 262 H LYS A 16 -5.114 -1.002 0.824 1.00 0.18 H ATOM 263 HA LYS A 16 -7.836 -0.968 1.785 1.00 0.35 H ATOM 264 HB2 LYS A 16 -5.475 0.608 2.819 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.999 0.339 3.650 1.00 0.43 H ATOM 266 HG2 LYS A 16 -6.403 -2.151 3.541 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.784 -1.606 3.113 1.00 0.78 H ATOM 268 HD2 LYS A 16 -6.296 -0.903 5.630 1.00 2.01 H ATOM 269 HD3 LYS A 16 -4.952 -2.034 5.504 1.00 1.98 H ATOM 270 HE2 LYS A 16 -3.917 -0.126 6.300 1.00 2.03 H ATOM 271 HE3 LYS A 16 -3.649 0.000 4.565 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -4.404 2.068 5.588 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -5.814 1.370 5.997 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -5.426 1.557 4.432 1.00 2.48 H ATOM 275 N MET A 17 -6.758 1.376 -0.058 1.00 0.37 N ATOM 276 CA MET A 17 -7.114 2.593 -0.777 1.00 0.49 C ATOM 277 C MET A 17 -8.141 2.288 -1.862 1.00 0.55 C ATOM 278 O MET A 17 -9.056 3.074 -2.105 1.00 0.66 O ATOM 279 CB MET A 17 -5.869 3.232 -1.408 1.00 0.60 C ATOM 280 CG MET A 17 -4.877 3.799 -0.400 1.00 0.69 C ATOM 281 SD MET A 17 -4.985 5.594 -0.223 1.00 1.70 S ATOM 282 CE MET A 17 -6.685 5.803 0.305 1.00 2.33 C ATOM 283 H MET A 17 -6.006 0.836 -0.381 1.00 0.37 H ATOM 284 HA MET A 17 -7.547 3.284 -0.070 1.00 0.54 H ATOM 285 HB2 MET A 17 -5.357 2.485 -1.997 1.00 1.19 H ATOM 286 HB3 MET A 17 -6.183 4.034 -2.060 1.00 1.22 H ATOM 287 HG2 MET A 17 -5.072 3.348 0.561 1.00 1.19 H ATOM 288 HG3 MET A 17 -3.870 3.541 -0.716 1.00 1.28 H ATOM 289 HE1 MET A 17 -7.348 5.416 -0.454 1.00 2.74 H ATOM 290 HE2 MET A 17 -6.888 6.852 0.460 1.00 2.78 H ATOM 291 HE3 MET A 17 -6.843 5.266 1.229 1.00 2.74 H ATOM 292 N ALA A 18 -7.987 1.140 -2.508 1.00 0.57 N ATOM 293 CA ALA A 18 -8.859 0.759 -3.611 1.00 0.70 C ATOM 294 C ALA A 18 -10.013 -0.126 -3.148 1.00 0.79 C ATOM 295 O ALA A 18 -11.144 0.030 -3.614 1.00 1.34 O ATOM 296 CB ALA A 18 -8.054 0.050 -4.688 1.00 0.81 C ATOM 297 H ALA A 18 -7.257 0.539 -2.245 1.00 0.58 H ATOM 298 HA ALA A 18 -9.265 1.662 -4.040 1.00 0.78 H ATOM 299 HB1 ALA A 18 -7.248 0.690 -5.013 1.00 1.33 H ATOM 300 HB2 ALA A 18 -8.695 -0.177 -5.526 1.00 1.31 H ATOM 301 HB3 ALA A 18 -7.645 -0.867 -4.287 1.00 1.33 H ATOM 302 N LEU A 19 -9.717 -1.033 -2.218 1.00 0.75 N ATOM 303 CA LEU A 19 -10.680 -2.026 -1.736 1.00 0.82 C ATOM 304 C LEU A 19 -11.079 -2.977 -2.859 1.00 1.31 C ATOM 305 O LEU A 19 -10.319 -3.933 -3.120 1.00 1.89 O ATOM 306 CB LEU A 19 -11.930 -1.372 -1.128 1.00 1.07 C ATOM 307 CG LEU A 19 -11.744 -0.691 0.231 1.00 1.32 C ATOM 308 CD1 LEU A 19 -10.994 0.624 0.093 1.00 2.07 C ATOM 309 CD2 LEU A 19 -13.092 -0.463 0.888 1.00 1.78 C ATOM 310 OXT LEU A 19 -12.145 -2.768 -3.477 1.00 1.90 O ATOM 311 H LEU A 19 -8.813 -1.041 -1.840 1.00 1.05 H ATOM 312 HA LEU A 19 -10.185 -2.601 -0.967 1.00 0.82 H ATOM 313 HB2 LEU A 19 -12.291 -0.633 -1.826 1.00 1.70 H ATOM 314 HB3 LEU A 19 -12.687 -2.135 -1.020 1.00 1.39 H ATOM 315 HG LEU A 19 -11.164 -1.337 0.873 1.00 1.78 H ATOM 316 HD11 LEU A 19 -10.874 1.074 1.068 1.00 2.52 H ATOM 317 HD12 LEU A 19 -11.551 1.291 -0.546 1.00 2.57 H ATOM 318 HD13 LEU A 19 -10.021 0.439 -0.340 1.00 2.47 H ATOM 319 HD21 LEU A 19 -12.950 0.016 1.844 1.00 2.23 H ATOM 320 HD22 LEU A 19 -13.587 -1.412 1.031 1.00 2.18 H ATOM 321 HD23 LEU A 19 -13.696 0.168 0.257 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 7 ATOM 1 N GLY A 1 8.724 6.965 2.687 1.00 1.26 N ATOM 2 CA GLY A 1 7.300 7.221 2.366 1.00 0.47 C ATOM 3 C GLY A 1 6.470 5.961 2.441 1.00 0.35 C ATOM 4 O GLY A 1 6.975 4.859 2.220 1.00 0.42 O ATOM 5 H1 GLY A 1 9.256 7.803 2.581 1.00 1.79 H ATOM 6 H2 GLY A 1 9.095 6.267 2.078 1.00 1.72 H ATOM 7 H3 GLY A 1 8.810 6.644 3.631 1.00 1.76 H ATOM 8 HA2 GLY A 1 6.908 7.943 3.066 1.00 0.89 H ATOM 9 HA3 GLY A 1 7.233 7.627 1.367 1.00 0.90 H ATOM 10 N ILE A 2 5.193 6.108 2.745 1.00 0.27 N ATOM 11 CA ILE A 2 4.315 4.958 2.853 1.00 0.21 C ATOM 12 C ILE A 2 3.897 4.466 1.478 1.00 0.14 C ATOM 13 O ILE A 2 3.546 3.305 1.297 1.00 0.22 O ATOM 14 CB ILE A 2 3.065 5.262 3.698 1.00 0.27 C ATOM 15 CG1 ILE A 2 2.279 3.977 3.932 1.00 0.31 C ATOM 16 CG2 ILE A 2 2.183 6.304 3.019 1.00 0.33 C ATOM 17 CD1 ILE A 2 1.506 3.976 5.230 1.00 0.77 C ATOM 18 H ILE A 2 4.832 7.011 2.901 1.00 0.31 H ATOM 19 HA ILE A 2 4.866 4.171 3.347 1.00 0.27 H ATOM 20 HB ILE A 2 3.385 5.661 4.644 1.00 0.34 H ATOM 21 HG12 ILE A 2 1.573 3.846 3.126 1.00 0.63 H ATOM 22 HG13 ILE A 2 2.967 3.138 3.937 1.00 0.74 H ATOM 23 HG21 ILE A 2 1.848 5.922 2.063 1.00 1.04 H ATOM 24 HG22 ILE A 2 2.747 7.211 2.868 1.00 1.10 H ATOM 25 HG23 ILE A 2 1.325 6.510 3.642 1.00 1.08 H ATOM 26 HD11 ILE A 2 2.195 4.077 6.056 1.00 1.38 H ATOM 27 HD12 ILE A 2 0.963 3.048 5.325 1.00 1.38 H ATOM 28 HD13 ILE A 2 0.812 4.802 5.236 1.00 1.42 H ATOM 29 N VAL A 3 3.954 5.344 0.499 1.00 0.14 N ATOM 30 CA VAL A 3 3.538 4.978 -0.837 1.00 0.20 C ATOM 31 C VAL A 3 4.515 3.971 -1.456 1.00 0.16 C ATOM 32 O VAL A 3 4.128 3.138 -2.270 1.00 0.19 O ATOM 33 CB VAL A 3 3.393 6.212 -1.756 1.00 0.33 C ATOM 34 CG1 VAL A 3 4.740 6.877 -1.996 1.00 0.92 C ATOM 35 CG2 VAL A 3 2.740 5.828 -3.075 1.00 0.94 C ATOM 36 H VAL A 3 4.263 6.257 0.686 1.00 0.20 H ATOM 37 HA VAL A 3 2.568 4.505 -0.737 1.00 0.25 H ATOM 38 HB VAL A 3 2.752 6.926 -1.261 1.00 0.65 H ATOM 39 HG11 VAL A 3 4.606 7.747 -2.620 1.00 1.51 H ATOM 40 HG12 VAL A 3 5.401 6.177 -2.489 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.169 7.171 -1.051 1.00 1.49 H ATOM 42 HG21 VAL A 3 1.754 5.428 -2.887 1.00 1.54 H ATOM 43 HG22 VAL A 3 3.342 5.080 -3.571 1.00 1.49 H ATOM 44 HG23 VAL A 3 2.659 6.702 -3.704 1.00 1.53 H ATOM 45 N THR A 4 5.777 4.035 -1.047 1.00 0.17 N ATOM 46 CA THR A 4 6.771 3.097 -1.538 1.00 0.21 C ATOM 47 C THR A 4 6.604 1.736 -0.872 1.00 0.18 C ATOM 48 O THR A 4 6.835 0.692 -1.496 1.00 0.21 O ATOM 49 CB THR A 4 8.201 3.628 -1.334 1.00 0.32 C ATOM 50 OG1 THR A 4 8.290 4.329 -0.087 1.00 0.63 O ATOM 51 CG2 THR A 4 8.602 4.552 -2.474 1.00 0.66 C ATOM 52 H THR A 4 6.044 4.724 -0.404 1.00 0.21 H ATOM 53 HA THR A 4 6.607 2.977 -2.601 1.00 0.24 H ATOM 54 HB THR A 4 8.881 2.789 -1.315 1.00 0.54 H ATOM 55 HG1 THR A 4 8.518 3.709 0.616 1.00 1.24 H ATOM 56 HG21 THR A 4 9.603 4.920 -2.305 1.00 1.24 H ATOM 57 HG22 THR A 4 7.916 5.385 -2.519 1.00 1.30 H ATOM 58 HG23 THR A 4 8.570 4.009 -3.407 1.00 1.28 H ATOM 59 N LYS A 5 6.178 1.735 0.391 1.00 0.18 N ATOM 60 CA LYS A 5 5.820 0.482 1.032 1.00 0.27 C ATOM 61 C LYS A 5 4.608 -0.086 0.300 1.00 0.21 C ATOM 62 O LYS A 5 4.569 -1.265 -0.039 1.00 0.22 O ATOM 63 CB LYS A 5 5.536 0.653 2.544 1.00 0.46 C ATOM 64 CG LYS A 5 4.094 0.970 2.903 1.00 0.94 C ATOM 65 CD LYS A 5 3.760 0.511 4.316 1.00 0.90 C ATOM 66 CE LYS A 5 2.259 0.501 4.573 1.00 0.81 C ATOM 67 NZ LYS A 5 1.947 0.177 5.988 1.00 1.23 N ATOM 68 H LYS A 5 6.114 2.581 0.891 1.00 0.19 H ATOM 69 HA LYS A 5 6.650 -0.197 0.898 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.801 -0.253 3.052 1.00 1.25 H ATOM 71 HB3 LYS A 5 6.158 1.452 2.920 1.00 1.15 H ATOM 72 HG2 LYS A 5 3.953 2.037 2.838 1.00 1.72 H ATOM 73 HG3 LYS A 5 3.438 0.480 2.203 1.00 1.75 H ATOM 74 HD2 LYS A 5 4.143 -0.488 4.458 1.00 1.31 H ATOM 75 HD3 LYS A 5 4.232 1.180 5.019 1.00 1.33 H ATOM 76 HE2 LYS A 5 1.856 1.474 4.339 1.00 1.09 H ATOM 77 HE3 LYS A 5 1.798 -0.242 3.934 1.00 0.97 H ATOM 78 HZ1 LYS A 5 2.385 0.836 6.600 1.00 1.66 H ATOM 79 HZ2 LYS A 5 2.279 -0.737 6.215 1.00 1.71 H ATOM 80 HZ3 LYS A 5 0.958 0.202 6.138 1.00 1.67 H ATOM 81 N LEU A 6 3.665 0.806 -0.005 1.00 0.21 N ATOM 82 CA LEU A 6 2.445 0.486 -0.744 1.00 0.25 C ATOM 83 C LEU A 6 2.754 -0.209 -2.067 1.00 0.21 C ATOM 84 O LEU A 6 1.887 -0.844 -2.668 1.00 0.26 O ATOM 85 CB LEU A 6 1.658 1.784 -0.963 1.00 0.36 C ATOM 86 CG LEU A 6 0.582 1.771 -2.051 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.557 2.689 -1.660 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.168 2.219 -3.382 1.00 1.21 C ATOM 89 H LEU A 6 3.796 1.736 0.286 1.00 0.22 H ATOM 90 HA LEU A 6 1.851 -0.179 -0.134 1.00 0.32 H ATOM 91 HB2 LEU A 6 1.183 2.043 -0.032 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.366 2.562 -1.207 1.00 0.85 H ATOM 93 HG LEU A 6 0.194 0.770 -2.167 1.00 1.34 H ATOM 94 HD11 LEU A 6 -1.271 2.745 -2.468 1.00 1.71 H ATOM 95 HD12 LEU A 6 -0.170 3.674 -1.450 1.00 1.71 H ATOM 96 HD13 LEU A 6 -1.042 2.298 -0.778 1.00 1.70 H ATOM 97 HD21 LEU A 6 0.408 2.167 -4.146 1.00 1.76 H ATOM 98 HD22 LEU A 6 1.992 1.573 -3.647 1.00 1.73 H ATOM 99 HD23 LEU A 6 1.522 3.234 -3.292 1.00 1.81 H ATOM 100 N ILE A 7 3.982 -0.076 -2.525 1.00 0.16 N ATOM 101 CA ILE A 7 4.400 -0.719 -3.748 1.00 0.18 C ATOM 102 C ILE A 7 4.592 -2.228 -3.554 1.00 0.16 C ATOM 103 O ILE A 7 3.867 -3.023 -4.150 1.00 0.19 O ATOM 104 CB ILE A 7 5.693 -0.086 -4.294 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.487 1.412 -4.513 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.115 -0.764 -5.588 1.00 0.27 C ATOM 107 CD1 ILE A 7 6.714 2.129 -5.033 1.00 1.07 C ATOM 108 H ILE A 7 4.623 0.473 -2.026 1.00 0.16 H ATOM 109 HA ILE A 7 3.621 -0.566 -4.479 1.00 0.23 H ATOM 110 HB ILE A 7 6.474 -0.230 -3.564 1.00 0.20 H ATOM 111 HG12 ILE A 7 4.689 1.561 -5.225 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.210 1.865 -3.571 1.00 0.79 H ATOM 113 HG21 ILE A 7 5.354 -0.615 -6.337 1.00 1.06 H ATOM 114 HG22 ILE A 7 6.246 -1.822 -5.412 1.00 1.06 H ATOM 115 HG23 ILE A 7 7.046 -0.338 -5.928 1.00 1.06 H ATOM 116 HD11 ILE A 7 6.497 3.180 -5.147 1.00 1.67 H ATOM 117 HD12 ILE A 7 6.994 1.714 -5.990 1.00 1.67 H ATOM 118 HD13 ILE A 7 7.529 2.003 -4.335 1.00 1.64 H ATOM 119 N LYS A 8 5.557 -2.631 -2.724 1.00 0.13 N ATOM 120 CA LYS A 8 5.895 -4.060 -2.636 1.00 0.12 C ATOM 121 C LYS A 8 5.144 -4.802 -1.536 1.00 0.11 C ATOM 122 O LYS A 8 4.196 -5.538 -1.796 1.00 0.13 O ATOM 123 CB LYS A 8 7.389 -4.269 -2.365 1.00 0.17 C ATOM 124 CG LYS A 8 8.340 -3.748 -3.434 1.00 0.49 C ATOM 125 CD LYS A 8 8.456 -2.232 -3.397 1.00 0.78 C ATOM 126 CE LYS A 8 9.666 -1.738 -4.170 1.00 0.98 C ATOM 127 NZ LYS A 8 9.683 -2.230 -5.574 1.00 1.70 N ATOM 128 H LYS A 8 6.036 -1.969 -2.170 1.00 0.13 H ATOM 129 HA LYS A 8 5.645 -4.511 -3.582 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.633 -3.775 -1.438 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.562 -5.330 -2.242 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.318 -4.175 -3.269 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.975 -4.048 -4.405 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.567 -1.806 -3.834 1.00 1.28 H ATOM 135 HD3 LYS A 8 8.541 -1.913 -2.369 1.00 1.16 H ATOM 136 HE2 LYS A 8 9.650 -0.659 -4.178 1.00 1.43 H ATOM 137 HE3 LYS A 8 10.557 -2.077 -3.666 1.00 1.50 H ATOM 138 HZ1 LYS A 8 9.617 -3.228 -5.591 1.00 2.17 H ATOM 139 HZ2 LYS A 8 10.536 -1.961 -6.020 1.00 2.16 H ATOM 140 HZ3 LYS A 8 8.918 -1.843 -6.089 1.00 2.17 H ATOM 141 N LYS A 9 5.591 -4.608 -0.304 1.00 0.12 N ATOM 142 CA LYS A 9 5.090 -5.380 0.833 1.00 0.14 C ATOM 143 C LYS A 9 3.971 -4.631 1.528 1.00 0.13 C ATOM 144 O LYS A 9 2.950 -5.200 1.913 1.00 0.17 O ATOM 145 CB LYS A 9 6.221 -5.676 1.818 1.00 0.21 C ATOM 146 CG LYS A 9 7.414 -6.383 1.185 1.00 0.84 C ATOM 147 CD LYS A 9 7.056 -7.777 0.690 1.00 1.34 C ATOM 148 CE LYS A 9 6.717 -8.714 1.838 1.00 2.00 C ATOM 149 NZ LYS A 9 7.870 -8.920 2.755 1.00 2.66 N ATOM 150 H LYS A 9 6.272 -3.917 -0.149 1.00 0.13 H ATOM 151 HA LYS A 9 4.707 -6.310 0.446 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.565 -4.746 2.242 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.838 -6.301 2.610 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.762 -5.798 0.348 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.201 -6.464 1.919 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.203 -7.707 0.033 1.00 1.78 H ATOM 157 HD3 LYS A 9 7.898 -8.180 0.147 1.00 1.82 H ATOM 158 HE2 LYS A 9 5.896 -8.294 2.397 1.00 2.46 H ATOM 159 HE3 LYS A 9 6.419 -9.667 1.428 1.00 2.44 H ATOM 160 HZ1 LYS A 9 7.603 -9.517 3.514 1.00 3.04 H ATOM 161 HZ2 LYS A 9 8.181 -8.048 3.129 1.00 3.03 H ATOM 162 HZ3 LYS A 9 8.632 -9.347 2.263 1.00 3.05 H ATOM 163 N GLY A 10 4.197 -3.337 1.667 1.00 0.14 N ATOM 164 CA GLY A 10 3.228 -2.413 2.216 1.00 0.17 C ATOM 165 C GLY A 10 1.959 -2.366 1.400 1.00 0.16 C ATOM 166 O GLY A 10 0.981 -1.767 1.828 1.00 0.20 O ATOM 167 H GLY A 10 5.060 -2.979 1.360 1.00 0.15 H ATOM 168 HA2 GLY A 10 2.986 -2.715 3.224 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.662 -1.429 2.239 1.00 0.21 H ATOM 170 N VAL A 11 2.054 -2.905 0.177 1.00 0.14 N ATOM 171 CA VAL A 11 0.997 -2.902 -0.847 1.00 0.16 C ATOM 172 C VAL A 11 -0.425 -3.064 -0.284 1.00 0.16 C ATOM 173 O VAL A 11 -1.395 -2.676 -0.933 1.00 0.18 O ATOM 174 CB VAL A 11 1.280 -4.015 -1.883 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.157 -5.390 -1.246 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.366 -3.892 -3.088 1.00 0.23 C ATOM 177 H VAL A 11 2.898 -3.339 -0.053 1.00 0.14 H ATOM 178 HA VAL A 11 1.053 -1.957 -1.363 1.00 0.19 H ATOM 179 HB VAL A 11 2.302 -3.901 -2.225 1.00 0.19 H ATOM 180 HG11 VAL A 11 0.170 -5.505 -0.826 1.00 1.03 H ATOM 181 HG12 VAL A 11 1.897 -5.489 -0.464 1.00 1.04 H ATOM 182 HG13 VAL A 11 1.322 -6.150 -1.995 1.00 1.04 H ATOM 183 HG21 VAL A 11 -0.661 -3.991 -2.771 1.00 1.06 H ATOM 184 HG22 VAL A 11 0.605 -4.669 -3.800 1.00 1.04 H ATOM 185 HG23 VAL A 11 0.511 -2.926 -3.549 1.00 1.04 H ATOM 186 N LYS A 12 -0.541 -3.641 0.906 1.00 0.16 N ATOM 187 CA LYS A 12 -1.781 -3.603 1.676 1.00 0.19 C ATOM 188 C LYS A 12 -2.408 -2.203 1.639 1.00 0.15 C ATOM 189 O LYS A 12 -3.616 -2.059 1.465 1.00 0.14 O ATOM 190 CB LYS A 12 -1.483 -4.000 3.124 1.00 0.27 C ATOM 191 CG LYS A 12 -2.631 -3.747 4.094 1.00 0.46 C ATOM 192 CD LYS A 12 -3.883 -4.542 3.737 1.00 0.97 C ATOM 193 CE LYS A 12 -3.822 -5.984 4.235 1.00 1.65 C ATOM 194 NZ LYS A 12 -2.716 -6.767 3.619 1.00 2.26 N ATOM 195 H LYS A 12 0.231 -4.113 1.276 1.00 0.16 H ATOM 196 HA LYS A 12 -2.470 -4.311 1.245 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.242 -5.049 3.149 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.625 -3.440 3.464 1.00 0.33 H ATOM 199 HG2 LYS A 12 -2.315 -4.028 5.088 1.00 0.85 H ATOM 200 HG3 LYS A 12 -2.868 -2.688 4.080 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.738 -4.056 4.182 1.00 1.47 H ATOM 202 HD3 LYS A 12 -3.994 -4.547 2.662 1.00 1.42 H ATOM 203 HE2 LYS A 12 -3.685 -5.973 5.306 1.00 2.23 H ATOM 204 HE3 LYS A 12 -4.761 -6.466 4.003 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -2.733 -6.666 2.625 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -2.818 -7.735 3.841 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -1.832 -6.451 3.965 1.00 2.67 H ATOM 208 N LEU A 13 -1.565 -1.180 1.781 1.00 0.15 N ATOM 209 CA LEU A 13 -1.998 0.206 1.758 1.00 0.15 C ATOM 210 C LEU A 13 -2.696 0.511 0.431 1.00 0.13 C ATOM 211 O LEU A 13 -3.676 1.245 0.390 1.00 0.15 O ATOM 212 CB LEU A 13 -0.772 1.111 1.963 1.00 0.20 C ATOM 213 CG LEU A 13 -1.015 2.483 2.615 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.892 3.373 1.753 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.629 2.314 3.998 1.00 0.38 C ATOM 216 H LEU A 13 -0.605 -1.368 1.902 1.00 0.19 H ATOM 217 HA LEU A 13 -2.694 0.357 2.569 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.067 0.574 2.581 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.315 1.272 1.002 1.00 0.21 H ATOM 220 HG LEU A 13 -0.065 2.983 2.730 1.00 0.30 H ATOM 221 HD11 LEU A 13 -2.837 2.884 1.580 1.00 1.08 H ATOM 222 HD12 LEU A 13 -1.401 3.559 0.809 1.00 1.08 H ATOM 223 HD13 LEU A 13 -2.060 4.312 2.261 1.00 1.09 H ATOM 224 HD21 LEU A 13 -2.598 1.845 3.908 1.00 1.09 H ATOM 225 HD22 LEU A 13 -1.740 3.283 4.462 1.00 1.09 H ATOM 226 HD23 LEU A 13 -0.986 1.696 4.604 1.00 1.10 H ATOM 227 N GLY A 14 -2.207 -0.097 -0.646 1.00 0.18 N ATOM 228 CA GLY A 14 -2.808 0.094 -1.955 1.00 0.23 C ATOM 229 C GLY A 14 -4.214 -0.466 -2.021 1.00 0.22 C ATOM 230 O GLY A 14 -5.088 0.095 -2.682 1.00 0.29 O ATOM 231 H GLY A 14 -1.440 -0.700 -0.548 1.00 0.22 H ATOM 232 HA2 GLY A 14 -2.841 1.151 -2.175 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.199 -0.400 -2.695 1.00 0.29 H ATOM 234 N LEU A 15 -4.433 -1.573 -1.325 1.00 0.22 N ATOM 235 CA LEU A 15 -5.760 -2.167 -1.233 1.00 0.29 C ATOM 236 C LEU A 15 -6.628 -1.360 -0.278 1.00 0.28 C ATOM 237 O LEU A 15 -7.852 -1.358 -0.383 1.00 0.39 O ATOM 238 CB LEU A 15 -5.685 -3.626 -0.765 1.00 0.35 C ATOM 239 CG LEU A 15 -5.285 -4.662 -1.827 1.00 0.41 C ATOM 240 CD1 LEU A 15 -6.239 -4.613 -3.009 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.848 -4.457 -2.287 1.00 0.39 C ATOM 242 H LEU A 15 -3.681 -2.005 -0.863 1.00 0.22 H ATOM 243 HA LEU A 15 -6.205 -2.134 -2.216 1.00 0.36 H ATOM 244 HB2 LEU A 15 -4.969 -3.682 0.043 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.655 -3.902 -0.378 1.00 0.41 H ATOM 246 HG LEU A 15 -5.355 -5.648 -1.391 1.00 0.51 H ATOM 247 HD11 LEU A 15 -6.191 -3.638 -3.473 1.00 1.13 H ATOM 248 HD12 LEU A 15 -7.246 -4.798 -2.668 1.00 1.16 H ATOM 249 HD13 LEU A 15 -5.958 -5.367 -3.729 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.181 -4.557 -1.443 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.743 -3.470 -2.713 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.599 -5.199 -3.031 1.00 1.10 H ATOM 253 N LYS A 16 -5.981 -0.673 0.653 1.00 0.21 N ATOM 254 CA LYS A 16 -6.680 0.175 1.609 1.00 0.28 C ATOM 255 C LYS A 16 -7.050 1.513 0.969 1.00 0.34 C ATOM 256 O LYS A 16 -7.984 2.182 1.401 1.00 0.46 O ATOM 257 CB LYS A 16 -5.813 0.393 2.852 1.00 0.34 C ATOM 258 CG LYS A 16 -5.511 -0.892 3.619 1.00 0.39 C ATOM 259 CD LYS A 16 -6.760 -1.479 4.265 1.00 1.31 C ATOM 260 CE LYS A 16 -7.321 -0.567 5.348 1.00 1.54 C ATOM 261 NZ LYS A 16 -6.390 -0.421 6.497 1.00 2.08 N ATOM 262 H LYS A 16 -5.003 -0.748 0.706 1.00 0.18 H ATOM 263 HA LYS A 16 -7.589 -0.332 1.898 1.00 0.35 H ATOM 264 HB2 LYS A 16 -4.874 0.834 2.548 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.320 1.075 3.517 1.00 0.43 H ATOM 266 HG2 LYS A 16 -5.103 -1.618 2.932 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.782 -0.682 4.389 1.00 0.78 H ATOM 268 HD2 LYS A 16 -7.512 -1.622 3.504 1.00 2.01 H ATOM 269 HD3 LYS A 16 -6.508 -2.433 4.706 1.00 1.98 H ATOM 270 HE2 LYS A 16 -7.503 0.407 4.922 1.00 2.03 H ATOM 271 HE3 LYS A 16 -8.253 -0.983 5.702 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -6.233 -1.310 6.931 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -6.773 0.203 7.173 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -5.511 -0.055 6.185 1.00 2.48 H ATOM 275 N MET A 17 -6.306 1.897 -0.063 1.00 0.37 N ATOM 276 CA MET A 17 -6.602 3.111 -0.818 1.00 0.49 C ATOM 277 C MET A 17 -7.768 2.873 -1.769 1.00 0.55 C ATOM 278 O MET A 17 -8.579 3.767 -2.015 1.00 0.66 O ATOM 279 CB MET A 17 -5.373 3.568 -1.614 1.00 0.60 C ATOM 280 CG MET A 17 -4.203 4.000 -0.746 1.00 0.69 C ATOM 281 SD MET A 17 -4.497 5.554 0.122 1.00 1.70 S ATOM 282 CE MET A 17 -4.477 6.711 -1.245 1.00 2.33 C ATOM 283 H MET A 17 -5.526 1.357 -0.311 1.00 0.37 H ATOM 284 HA MET A 17 -6.875 3.884 -0.115 1.00 0.54 H ATOM 285 HB2 MET A 17 -5.045 2.754 -2.243 1.00 1.19 H ATOM 286 HB3 MET A 17 -5.655 4.402 -2.241 1.00 1.22 H ATOM 287 HG2 MET A 17 -4.019 3.229 -0.014 1.00 1.19 H ATOM 288 HG3 MET A 17 -3.328 4.112 -1.372 1.00 1.28 H ATOM 289 HE1 MET A 17 -3.545 6.619 -1.782 1.00 2.74 H ATOM 290 HE2 MET A 17 -4.576 7.717 -0.866 1.00 2.78 H ATOM 291 HE3 MET A 17 -5.299 6.496 -1.911 1.00 2.74 H ATOM 292 N ALA A 18 -7.842 1.662 -2.303 1.00 0.57 N ATOM 293 CA ALA A 18 -8.903 1.295 -3.228 1.00 0.70 C ATOM 294 C ALA A 18 -10.152 0.848 -2.476 1.00 0.79 C ATOM 295 O ALA A 18 -11.247 1.358 -2.719 1.00 1.34 O ATOM 296 CB ALA A 18 -8.426 0.195 -4.165 1.00 0.81 C ATOM 297 H ALA A 18 -7.159 0.997 -2.074 1.00 0.58 H ATOM 298 HA ALA A 18 -9.144 2.164 -3.824 1.00 0.78 H ATOM 299 HB1 ALA A 18 -7.556 0.535 -4.707 1.00 1.33 H ATOM 300 HB2 ALA A 18 -9.211 -0.050 -4.863 1.00 1.31 H ATOM 301 HB3 ALA A 18 -8.169 -0.685 -3.590 1.00 1.33 H ATOM 302 N LEU A 19 -9.960 -0.093 -1.552 1.00 0.75 N ATOM 303 CA LEU A 19 -11.043 -0.679 -0.765 1.00 0.82 C ATOM 304 C LEU A 19 -12.028 -1.426 -1.656 1.00 1.31 C ATOM 305 O LEU A 19 -13.096 -0.872 -1.983 1.00 1.89 O ATOM 306 CB LEU A 19 -11.762 0.385 0.071 1.00 1.07 C ATOM 307 CG LEU A 19 -10.918 1.016 1.181 1.00 1.32 C ATOM 308 CD1 LEU A 19 -11.694 2.113 1.884 1.00 2.07 C ATOM 309 CD2 LEU A 19 -10.470 -0.042 2.181 1.00 1.78 C ATOM 310 OXT LEU A 19 -11.722 -2.578 -2.025 1.00 1.90 O ATOM 311 H LEU A 19 -9.045 -0.412 -1.392 1.00 1.05 H ATOM 312 HA LEU A 19 -10.591 -1.395 -0.093 1.00 0.82 H ATOM 313 HB2 LEU A 19 -12.093 1.170 -0.592 1.00 1.70 H ATOM 314 HB3 LEU A 19 -12.630 -0.070 0.526 1.00 1.39 H ATOM 315 HG LEU A 19 -10.035 1.460 0.744 1.00 1.78 H ATOM 316 HD11 LEU A 19 -11.948 2.886 1.176 1.00 2.52 H ATOM 317 HD12 LEU A 19 -11.090 2.532 2.674 1.00 2.57 H ATOM 318 HD13 LEU A 19 -12.600 1.699 2.304 1.00 2.47 H ATOM 319 HD21 LEU A 19 -9.917 0.429 2.980 1.00 2.23 H ATOM 320 HD22 LEU A 19 -9.838 -0.762 1.683 1.00 2.18 H ATOM 321 HD23 LEU A 19 -11.336 -0.542 2.588 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 8 ATOM 1 N GLY A 1 8.452 6.237 2.469 1.00 1.26 N ATOM 2 CA GLY A 1 7.107 6.663 2.918 1.00 0.47 C ATOM 3 C GLY A 1 6.121 5.526 2.845 1.00 0.35 C ATOM 4 O GLY A 1 6.520 4.364 2.754 1.00 0.42 O ATOM 5 H1 GLY A 1 9.095 6.997 2.536 1.00 1.79 H ATOM 6 H2 GLY A 1 8.414 5.928 1.519 1.00 1.72 H ATOM 7 H3 GLY A 1 8.779 5.480 3.037 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.169 7.009 3.939 1.00 0.89 H ATOM 9 HA3 GLY A 1 6.765 7.471 2.290 1.00 0.90 H ATOM 10 N ILE A 2 4.837 5.836 2.863 1.00 0.27 N ATOM 11 CA ILE A 2 3.833 4.795 2.830 1.00 0.21 C ATOM 12 C ILE A 2 3.553 4.363 1.394 1.00 0.14 C ATOM 13 O ILE A 2 3.067 3.261 1.157 1.00 0.22 O ATOM 14 CB ILE A 2 2.513 5.222 3.514 1.00 0.27 C ATOM 15 CG1 ILE A 2 1.811 3.985 4.071 1.00 0.31 C ATOM 16 CG2 ILE A 2 1.599 5.978 2.557 1.00 0.33 C ATOM 17 CD1 ILE A 2 2.305 3.592 5.444 1.00 0.77 C ATOM 18 H ILE A 2 4.562 6.781 2.899 1.00 0.31 H ATOM 19 HA ILE A 2 4.230 3.948 3.371 1.00 0.27 H ATOM 20 HB ILE A 2 2.759 5.882 4.332 1.00 0.34 H ATOM 21 HG12 ILE A 2 0.746 4.158 4.130 1.00 0.63 H ATOM 22 HG13 ILE A 2 1.998 3.152 3.408 1.00 0.74 H ATOM 23 HG21 ILE A 2 0.695 6.265 3.073 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.350 5.343 1.720 1.00 1.10 H ATOM 25 HG23 ILE A 2 2.106 6.862 2.197 1.00 1.08 H ATOM 26 HD11 ILE A 2 3.345 3.308 5.384 1.00 1.38 H ATOM 27 HD12 ILE A 2 1.724 2.760 5.814 1.00 1.38 H ATOM 28 HD13 ILE A 2 2.201 4.430 6.116 1.00 1.42 H ATOM 29 N VAL A 3 3.873 5.226 0.438 1.00 0.14 N ATOM 30 CA VAL A 3 3.617 4.918 -0.961 1.00 0.20 C ATOM 31 C VAL A 3 4.622 3.889 -1.478 1.00 0.16 C ATOM 32 O VAL A 3 4.285 3.031 -2.288 1.00 0.19 O ATOM 33 CB VAL A 3 3.657 6.180 -1.854 1.00 0.33 C ATOM 34 CG1 VAL A 3 5.067 6.736 -1.962 1.00 0.92 C ATOM 35 CG2 VAL A 3 3.092 5.881 -3.232 1.00 0.94 C ATOM 36 H VAL A 3 4.278 6.088 0.678 1.00 0.20 H ATOM 37 HA VAL A 3 2.625 4.493 -1.022 1.00 0.25 H ATOM 38 HB VAL A 3 3.035 6.936 -1.394 1.00 0.65 H ATOM 39 HG11 VAL A 3 5.442 6.959 -0.975 1.00 1.51 H ATOM 40 HG12 VAL A 3 5.056 7.636 -2.557 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.707 6.000 -2.429 1.00 1.49 H ATOM 42 HG21 VAL A 3 2.064 5.566 -3.139 1.00 1.54 H ATOM 43 HG22 VAL A 3 3.670 5.093 -3.695 1.00 1.49 H ATOM 44 HG23 VAL A 3 3.142 6.770 -3.842 1.00 1.53 H ATOM 45 N THR A 4 5.850 3.965 -0.983 1.00 0.17 N ATOM 46 CA THR A 4 6.893 3.041 -1.390 1.00 0.21 C ATOM 47 C THR A 4 6.621 1.660 -0.817 1.00 0.18 C ATOM 48 O THR A 4 6.834 0.635 -1.483 1.00 0.21 O ATOM 49 CB THR A 4 8.277 3.545 -0.940 1.00 0.32 C ATOM 50 OG1 THR A 4 8.219 3.976 0.428 1.00 0.63 O ATOM 51 CG2 THR A 4 8.740 4.697 -1.815 1.00 0.66 C ATOM 52 H THR A 4 6.062 4.660 -0.326 1.00 0.21 H ATOM 53 HA THR A 4 6.882 2.979 -2.471 1.00 0.24 H ATOM 54 HB THR A 4 8.987 2.735 -1.026 1.00 0.54 H ATOM 55 HG1 THR A 4 8.678 3.334 0.986 1.00 1.24 H ATOM 56 HG21 THR A 4 8.802 4.367 -2.841 1.00 1.24 H ATOM 57 HG22 THR A 4 9.712 5.033 -1.485 1.00 1.30 H ATOM 58 HG23 THR A 4 8.033 5.509 -1.742 1.00 1.28 H ATOM 59 N LYS A 5 6.136 1.631 0.419 1.00 0.18 N ATOM 60 CA LYS A 5 5.693 0.404 1.010 1.00 0.27 C ATOM 61 C LYS A 5 4.504 -0.123 0.213 1.00 0.21 C ATOM 62 O LYS A 5 4.478 -1.288 -0.174 1.00 0.22 O ATOM 63 CB LYS A 5 5.364 0.615 2.498 1.00 0.46 C ATOM 64 CG LYS A 5 3.903 0.896 2.831 1.00 0.94 C ATOM 65 CD LYS A 5 3.551 0.384 4.221 1.00 0.90 C ATOM 66 CE LYS A 5 2.047 0.319 4.443 1.00 0.81 C ATOM 67 NZ LYS A 5 1.711 -0.173 5.805 1.00 1.23 N ATOM 68 H LYS A 5 6.100 2.451 0.948 1.00 0.19 H ATOM 69 HA LYS A 5 6.500 -0.305 0.927 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.666 -0.256 3.037 1.00 1.25 H ATOM 71 HB3 LYS A 5 5.945 1.455 2.853 1.00 1.15 H ATOM 72 HG2 LYS A 5 3.742 1.963 2.800 1.00 1.72 H ATOM 73 HG3 LYS A 5 3.268 0.418 2.101 1.00 1.75 H ATOM 74 HD2 LYS A 5 3.962 -0.606 4.341 1.00 1.31 H ATOM 75 HD3 LYS A 5 3.985 1.047 4.956 1.00 1.33 H ATOM 76 HE2 LYS A 5 1.632 1.307 4.315 1.00 1.09 H ATOM 77 HE3 LYS A 5 1.613 -0.350 3.712 1.00 0.97 H ATOM 78 HZ1 LYS A 5 0.720 -0.147 5.946 1.00 1.66 H ATOM 79 HZ2 LYS A 5 2.149 0.395 6.501 1.00 1.71 H ATOM 80 HZ3 LYS A 5 2.027 -1.117 5.919 1.00 1.67 H ATOM 81 N LEU A 6 3.573 0.781 -0.099 1.00 0.21 N ATOM 82 CA LEU A 6 2.378 0.472 -0.887 1.00 0.25 C ATOM 83 C LEU A 6 2.730 -0.219 -2.200 1.00 0.21 C ATOM 84 O LEU A 6 1.894 -0.890 -2.804 1.00 0.26 O ATOM 85 CB LEU A 6 1.604 1.777 -1.126 1.00 0.36 C ATOM 86 CG LEU A 6 0.638 1.815 -2.318 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.498 2.783 -2.038 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.369 2.244 -3.583 1.00 1.21 C ATOM 89 H LEU A 6 3.692 1.703 0.218 1.00 0.22 H ATOM 90 HA LEU A 6 1.759 -0.192 -0.303 1.00 0.32 H ATOM 91 HB2 LEU A 6 1.038 1.983 -0.233 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.325 2.568 -1.256 1.00 0.85 H ATOM 93 HG LEU A 6 0.221 0.832 -2.479 1.00 1.34 H ATOM 94 HD11 LEU A 6 -1.066 2.430 -1.191 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.141 2.843 -2.904 1.00 1.71 H ATOM 96 HD13 LEU A 6 -0.094 3.760 -1.821 1.00 1.70 H ATOM 97 HD21 LEU A 6 2.163 1.543 -3.794 1.00 1.76 H ATOM 98 HD22 LEU A 6 1.791 3.228 -3.436 1.00 1.73 H ATOM 99 HD23 LEU A 6 0.677 2.267 -4.410 1.00 1.81 H ATOM 100 N ILE A 7 3.964 -0.054 -2.634 1.00 0.16 N ATOM 101 CA ILE A 7 4.429 -0.702 -3.836 1.00 0.18 C ATOM 102 C ILE A 7 4.576 -2.214 -3.626 1.00 0.16 C ATOM 103 O ILE A 7 3.796 -2.994 -4.176 1.00 0.19 O ATOM 104 CB ILE A 7 5.765 -0.094 -4.318 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.594 1.404 -4.582 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.260 -0.800 -5.571 1.00 0.27 C ATOM 107 CD1 ILE A 7 6.868 2.101 -5.013 1.00 1.07 C ATOM 108 H ILE A 7 4.575 0.525 -2.132 1.00 0.16 H ATOM 109 HA ILE A 7 3.690 -0.534 -4.605 1.00 0.23 H ATOM 110 HB ILE A 7 6.500 -0.230 -3.539 1.00 0.20 H ATOM 111 HG12 ILE A 7 4.862 1.544 -5.364 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.244 1.882 -3.678 1.00 0.79 H ATOM 113 HG21 ILE A 7 7.193 -0.354 -5.886 1.00 1.06 H ATOM 114 HG22 ILE A 7 5.528 -0.695 -6.357 1.00 1.06 H ATOM 115 HG23 ILE A 7 6.415 -1.846 -5.358 1.00 1.06 H ATOM 116 HD11 ILE A 7 7.222 1.664 -5.935 1.00 1.67 H ATOM 117 HD12 ILE A 7 7.618 1.982 -4.247 1.00 1.67 H ATOM 118 HD13 ILE A 7 6.669 3.151 -5.165 1.00 1.64 H ATOM 119 N LYS A 8 5.562 -2.639 -2.838 1.00 0.13 N ATOM 120 CA LYS A 8 5.848 -4.075 -2.741 1.00 0.12 C ATOM 121 C LYS A 8 5.163 -4.795 -1.569 1.00 0.11 C ATOM 122 O LYS A 8 4.176 -5.503 -1.766 1.00 0.13 O ATOM 123 CB LYS A 8 7.358 -4.333 -2.700 1.00 0.17 C ATOM 124 CG LYS A 8 8.162 -3.230 -2.041 1.00 0.49 C ATOM 125 CD LYS A 8 8.688 -2.234 -3.064 1.00 0.78 C ATOM 126 CE LYS A 8 9.571 -1.179 -2.418 1.00 0.98 C ATOM 127 NZ LYS A 8 10.227 -0.309 -3.429 1.00 1.70 N ATOM 128 H LYS A 8 6.085 -1.989 -2.312 1.00 0.13 H ATOM 129 HA LYS A 8 5.468 -4.513 -3.645 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.534 -5.248 -2.153 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.714 -4.455 -3.710 1.00 0.49 H ATOM 132 HG2 LYS A 8 7.523 -2.712 -1.346 1.00 0.70 H ATOM 133 HG3 LYS A 8 8.995 -3.668 -1.515 1.00 0.87 H ATOM 134 HD2 LYS A 8 9.265 -2.766 -3.806 1.00 1.28 H ATOM 135 HD3 LYS A 8 7.849 -1.747 -3.539 1.00 1.16 H ATOM 136 HE2 LYS A 8 8.963 -0.566 -1.770 1.00 1.43 H ATOM 137 HE3 LYS A 8 10.332 -1.674 -1.834 1.00 1.50 H ATOM 138 HZ1 LYS A 8 10.844 0.338 -2.980 1.00 2.17 H ATOM 139 HZ2 LYS A 8 9.544 0.206 -3.942 1.00 2.16 H ATOM 140 HZ3 LYS A 8 10.756 -0.865 -4.074 1.00 2.17 H ATOM 141 N LYS A 9 5.679 -4.620 -0.355 1.00 0.12 N ATOM 142 CA LYS A 9 5.193 -5.389 0.802 1.00 0.14 C ATOM 143 C LYS A 9 4.124 -4.620 1.558 1.00 0.13 C ATOM 144 O LYS A 9 3.169 -5.188 2.079 1.00 0.17 O ATOM 145 CB LYS A 9 6.350 -5.756 1.737 1.00 0.21 C ATOM 146 CG LYS A 9 7.406 -6.639 1.088 1.00 0.84 C ATOM 147 CD LYS A 9 6.848 -8.005 0.724 1.00 1.34 C ATOM 148 CE LYS A 9 7.892 -8.883 0.051 1.00 2.00 C ATOM 149 NZ LYS A 9 8.289 -8.362 -1.283 1.00 2.66 N ATOM 150 H LYS A 9 6.384 -3.951 -0.225 1.00 0.13 H ATOM 151 HA LYS A 9 4.753 -6.298 0.421 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.826 -4.851 2.075 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.950 -6.282 2.592 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.761 -6.157 0.190 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.227 -6.767 1.778 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.508 -8.497 1.624 1.00 1.78 H ATOM 157 HD3 LYS A 9 6.014 -7.873 0.050 1.00 1.82 H ATOM 158 HE2 LYS A 9 8.767 -8.926 0.682 1.00 2.46 H ATOM 159 HE3 LYS A 9 7.487 -9.878 -0.066 1.00 2.44 H ATOM 160 HZ1 LYS A 9 8.681 -7.448 -1.194 1.00 3.04 H ATOM 161 HZ2 LYS A 9 7.494 -8.314 -1.885 1.00 3.03 H ATOM 162 HZ3 LYS A 9 8.970 -8.968 -1.700 1.00 3.05 H ATOM 163 N GLY A 10 4.319 -3.319 1.609 1.00 0.14 N ATOM 164 CA GLY A 10 3.373 -2.399 2.205 1.00 0.17 C ATOM 165 C GLY A 10 2.054 -2.375 1.477 1.00 0.16 C ATOM 166 O GLY A 10 1.091 -1.792 1.969 1.00 0.20 O ATOM 167 H GLY A 10 5.138 -2.954 1.210 1.00 0.15 H ATOM 168 HA2 GLY A 10 3.203 -2.681 3.233 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.793 -1.406 2.175 1.00 0.21 H ATOM 170 N VAL A 11 2.085 -2.918 0.254 1.00 0.14 N ATOM 171 CA VAL A 11 1.001 -2.866 -0.733 1.00 0.16 C ATOM 172 C VAL A 11 -0.414 -2.967 -0.141 1.00 0.16 C ATOM 173 O VAL A 11 -1.375 -2.545 -0.780 1.00 0.18 O ATOM 174 CB VAL A 11 1.199 -3.973 -1.793 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.041 -5.353 -1.176 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.246 -3.784 -2.957 1.00 0.23 C ATOM 177 H VAL A 11 2.901 -3.389 -0.003 1.00 0.14 H ATOM 178 HA VAL A 11 1.086 -1.920 -1.243 1.00 0.19 H ATOM 179 HB VAL A 11 2.209 -3.894 -2.172 1.00 0.19 H ATOM 180 HG11 VAL A 11 1.162 -6.105 -1.941 1.00 1.03 H ATOM 181 HG12 VAL A 11 0.058 -5.439 -0.737 1.00 1.04 H ATOM 182 HG13 VAL A 11 1.791 -5.492 -0.410 1.00 1.04 H ATOM 183 HG21 VAL A 11 0.413 -2.815 -3.400 1.00 1.06 H ATOM 184 HG22 VAL A 11 -0.770 -3.849 -2.600 1.00 1.04 H ATOM 185 HG23 VAL A 11 0.422 -4.552 -3.693 1.00 1.04 H ATOM 186 N LYS A 12 -0.543 -3.535 1.053 1.00 0.16 N ATOM 187 CA LYS A 12 -1.782 -3.452 1.824 1.00 0.19 C ATOM 188 C LYS A 12 -2.383 -2.045 1.744 1.00 0.15 C ATOM 189 O LYS A 12 -3.579 -1.889 1.497 1.00 0.14 O ATOM 190 CB LYS A 12 -1.507 -3.806 3.288 1.00 0.27 C ATOM 191 CG LYS A 12 -2.719 -3.663 4.195 1.00 0.46 C ATOM 192 CD LYS A 12 -3.830 -4.630 3.814 1.00 0.97 C ATOM 193 CE LYS A 12 -3.417 -6.076 4.038 1.00 1.65 C ATOM 194 NZ LYS A 12 -4.496 -7.025 3.670 1.00 2.26 N ATOM 195 H LYS A 12 0.214 -4.034 1.422 1.00 0.16 H ATOM 196 HA LYS A 12 -2.484 -4.161 1.413 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.163 -4.826 3.338 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.727 -3.157 3.660 1.00 0.33 H ATOM 199 HG2 LYS A 12 -2.418 -3.864 5.212 1.00 0.85 H ATOM 200 HG3 LYS A 12 -3.092 -2.650 4.122 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.700 -4.418 4.416 1.00 1.47 H ATOM 202 HD3 LYS A 12 -4.072 -4.492 2.771 1.00 1.42 H ATOM 203 HE2 LYS A 12 -2.546 -6.288 3.436 1.00 2.23 H ATOM 204 HE3 LYS A 12 -3.173 -6.210 5.082 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -4.719 -6.932 2.701 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -5.320 -6.839 4.206 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -4.203 -7.966 3.845 1.00 2.67 H ATOM 208 N LEU A 13 -1.535 -1.029 1.932 1.00 0.15 N ATOM 209 CA LEU A 13 -1.939 0.369 1.840 1.00 0.15 C ATOM 210 C LEU A 13 -2.644 0.629 0.506 1.00 0.13 C ATOM 211 O LEU A 13 -3.649 1.333 0.449 1.00 0.15 O ATOM 212 CB LEU A 13 -0.684 1.246 1.977 1.00 0.20 C ATOM 213 CG LEU A 13 -0.889 2.711 2.396 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.600 3.514 1.323 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.649 2.793 3.714 1.00 0.38 C ATOM 216 H LEU A 13 -0.592 -1.228 2.142 1.00 0.19 H ATOM 217 HA LEU A 13 -2.616 0.584 2.651 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.036 0.783 2.707 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.174 1.239 1.027 1.00 0.21 H ATOM 220 HG LEU A 13 0.081 3.165 2.545 1.00 0.30 H ATOM 221 HD11 LEU A 13 -2.527 3.024 1.067 1.00 1.08 H ATOM 222 HD12 LEU A 13 -0.972 3.580 0.448 1.00 1.08 H ATOM 223 HD13 LEU A 13 -1.807 4.505 1.694 1.00 1.09 H ATOM 224 HD21 LEU A 13 -1.741 3.827 4.011 1.00 1.09 H ATOM 225 HD22 LEU A 13 -1.111 2.246 4.475 1.00 1.09 H ATOM 226 HD23 LEU A 13 -2.631 2.365 3.589 1.00 1.10 H ATOM 227 N GLY A 14 -2.128 0.018 -0.555 1.00 0.18 N ATOM 228 CA GLY A 14 -2.690 0.197 -1.879 1.00 0.23 C ATOM 229 C GLY A 14 -4.093 -0.357 -1.987 1.00 0.22 C ATOM 230 O GLY A 14 -4.961 0.258 -2.603 1.00 0.29 O ATOM 231 H GLY A 14 -1.364 -0.586 -0.432 1.00 0.22 H ATOM 232 HA2 GLY A 14 -2.713 1.252 -2.109 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.059 -0.305 -2.597 1.00 0.29 H ATOM 234 N LEU A 15 -4.323 -1.515 -1.384 1.00 0.22 N ATOM 235 CA LEU A 15 -5.645 -2.126 -1.388 1.00 0.29 C ATOM 236 C LEU A 15 -6.581 -1.363 -0.460 1.00 0.28 C ATOM 237 O LEU A 15 -7.781 -1.282 -0.703 1.00 0.39 O ATOM 238 CB LEU A 15 -5.584 -3.601 -0.975 1.00 0.35 C ATOM 239 CG LEU A 15 -4.994 -4.574 -2.008 1.00 0.41 C ATOM 240 CD1 LEU A 15 -5.682 -4.420 -3.358 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.491 -4.381 -2.145 1.00 0.39 C ATOM 242 H LEU A 15 -3.586 -1.972 -0.922 1.00 0.22 H ATOM 243 HA LEU A 15 -6.033 -2.059 -2.393 1.00 0.36 H ATOM 244 HB2 LEU A 15 -4.994 -3.671 -0.072 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.587 -3.922 -0.748 1.00 0.41 H ATOM 246 HG LEU A 15 -5.166 -5.585 -1.666 1.00 0.51 H ATOM 247 HD11 LEU A 15 -5.297 -5.160 -4.044 1.00 1.13 H ATOM 248 HD12 LEU A 15 -5.490 -3.433 -3.750 1.00 1.16 H ATOM 249 HD13 LEU A 15 -6.746 -4.561 -3.238 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.023 -4.504 -1.180 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.286 -3.390 -2.522 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.097 -5.116 -2.830 1.00 1.10 H ATOM 253 N LYS A 16 -6.021 -0.802 0.601 1.00 0.21 N ATOM 254 CA LYS A 16 -6.783 0.042 1.513 1.00 0.28 C ATOM 255 C LYS A 16 -7.218 1.320 0.798 1.00 0.34 C ATOM 256 O LYS A 16 -8.277 1.880 1.081 1.00 0.46 O ATOM 257 CB LYS A 16 -5.937 0.384 2.745 1.00 0.34 C ATOM 258 CG LYS A 16 -5.549 -0.830 3.582 1.00 0.39 C ATOM 259 CD LYS A 16 -6.695 -1.320 4.457 1.00 1.31 C ATOM 260 CE LYS A 16 -6.760 -0.574 5.788 1.00 1.54 C ATOM 261 NZ LYS A 16 -7.064 0.871 5.624 1.00 2.08 N ATOM 262 H LYS A 16 -5.067 -0.966 0.781 1.00 0.18 H ATOM 263 HA LYS A 16 -7.661 -0.505 1.822 1.00 0.35 H ATOM 264 HB2 LYS A 16 -5.031 0.874 2.419 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.497 1.061 3.370 1.00 0.43 H ATOM 266 HG2 LYS A 16 -5.255 -1.629 2.917 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.712 -0.565 4.213 1.00 0.78 H ATOM 268 HD2 LYS A 16 -7.624 -1.170 3.930 1.00 2.01 H ATOM 269 HD3 LYS A 16 -6.557 -2.374 4.652 1.00 1.98 H ATOM 270 HE2 LYS A 16 -7.529 -1.023 6.396 1.00 2.03 H ATOM 271 HE3 LYS A 16 -5.808 -0.677 6.287 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -7.939 0.990 5.156 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -6.351 1.318 5.088 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -7.115 1.316 6.519 1.00 2.48 H ATOM 275 N MET A 17 -6.388 1.765 -0.137 1.00 0.37 N ATOM 276 CA MET A 17 -6.682 2.944 -0.945 1.00 0.49 C ATOM 277 C MET A 17 -7.603 2.596 -2.111 1.00 0.55 C ATOM 278 O MET A 17 -8.246 3.472 -2.691 1.00 0.66 O ATOM 279 CB MET A 17 -5.382 3.552 -1.476 1.00 0.60 C ATOM 280 CG MET A 17 -4.530 4.204 -0.402 1.00 0.69 C ATOM 281 SD MET A 17 -5.231 5.760 0.186 1.00 1.70 S ATOM 282 CE MET A 17 -3.964 6.289 1.336 1.00 2.33 C ATOM 283 H MET A 17 -5.537 1.294 -0.279 1.00 0.37 H ATOM 284 HA MET A 17 -7.175 3.666 -0.311 1.00 0.54 H ATOM 285 HB2 MET A 17 -4.799 2.771 -1.943 1.00 1.19 H ATOM 286 HB3 MET A 17 -5.625 4.299 -2.216 1.00 1.22 H ATOM 287 HG2 MET A 17 -4.453 3.523 0.433 1.00 1.19 H ATOM 288 HG3 MET A 17 -3.540 4.390 -0.803 1.00 1.28 H ATOM 289 HE1 MET A 17 -3.866 5.557 2.125 1.00 2.74 H ATOM 290 HE2 MET A 17 -4.240 7.242 1.761 1.00 2.78 H ATOM 291 HE3 MET A 17 -3.024 6.386 0.815 1.00 2.74 H ATOM 292 N ALA A 18 -7.660 1.316 -2.453 1.00 0.57 N ATOM 293 CA ALA A 18 -8.485 0.849 -3.558 1.00 0.70 C ATOM 294 C ALA A 18 -9.512 -0.164 -3.070 1.00 0.79 C ATOM 295 O ALA A 18 -9.869 -1.107 -3.783 1.00 1.34 O ATOM 296 CB ALA A 18 -7.613 0.248 -4.650 1.00 0.81 C ATOM 297 H ALA A 18 -7.130 0.665 -1.946 1.00 0.58 H ATOM 298 HA ALA A 18 -9.003 1.702 -3.972 1.00 0.78 H ATOM 299 HB1 ALA A 18 -7.089 -0.613 -4.259 1.00 1.33 H ATOM 300 HB2 ALA A 18 -6.896 0.983 -4.984 1.00 1.31 H ATOM 301 HB3 ALA A 18 -8.231 -0.054 -5.482 1.00 1.33 H ATOM 302 N LEU A 19 -9.960 0.022 -1.838 1.00 0.75 N ATOM 303 CA LEU A 19 -10.978 -0.834 -1.255 1.00 0.82 C ATOM 304 C LEU A 19 -12.328 -0.501 -1.881 1.00 1.31 C ATOM 305 O LEU A 19 -12.889 -1.361 -2.590 1.00 1.89 O ATOM 306 CB LEU A 19 -11.018 -0.641 0.268 1.00 1.07 C ATOM 307 CG LEU A 19 -11.560 -1.825 1.084 1.00 1.32 C ATOM 308 CD1 LEU A 19 -11.318 -1.597 2.567 1.00 2.07 C ATOM 309 CD2 LEU A 19 -13.044 -2.042 0.829 1.00 1.78 C ATOM 310 OXT LEU A 19 -12.805 0.639 -1.695 1.00 1.90 O ATOM 311 H LEU A 19 -9.586 0.749 -1.301 1.00 1.05 H ATOM 312 HA LEU A 19 -10.725 -1.860 -1.481 1.00 0.82 H ATOM 313 HB2 LEU A 19 -10.013 -0.434 0.606 1.00 1.70 H ATOM 314 HB3 LEU A 19 -11.631 0.221 0.482 1.00 1.39 H ATOM 315 HG LEU A 19 -11.034 -2.722 0.796 1.00 1.78 H ATOM 316 HD11 LEU A 19 -10.259 -1.485 2.746 1.00 2.52 H ATOM 317 HD12 LEU A 19 -11.690 -2.442 3.126 1.00 2.57 H ATOM 318 HD13 LEU A 19 -11.834 -0.703 2.882 1.00 2.47 H ATOM 319 HD21 LEU A 19 -13.204 -2.241 -0.220 1.00 2.23 H ATOM 320 HD22 LEU A 19 -13.593 -1.156 1.115 1.00 2.18 H ATOM 321 HD23 LEU A 19 -13.390 -2.882 1.413 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 9 ATOM 1 N GLY A 1 8.585 6.122 2.556 1.00 1.26 N ATOM 2 CA GLY A 1 7.196 6.547 2.838 1.00 0.47 C ATOM 3 C GLY A 1 6.230 5.394 2.738 1.00 0.35 C ATOM 4 O GLY A 1 6.632 4.268 2.437 1.00 0.42 O ATOM 5 H1 GLY A 1 8.868 5.421 3.210 1.00 1.79 H ATOM 6 H2 GLY A 1 9.207 6.897 2.625 1.00 1.72 H ATOM 7 H3 GLY A 1 8.647 5.743 1.632 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.147 6.960 3.833 1.00 0.89 H ATOM 9 HA3 GLY A 1 6.910 7.309 2.126 1.00 0.90 H ATOM 10 N ILE A 2 4.955 5.659 2.978 1.00 0.27 N ATOM 11 CA ILE A 2 3.945 4.622 2.882 1.00 0.21 C ATOM 12 C ILE A 2 3.673 4.290 1.417 1.00 0.14 C ATOM 13 O ILE A 2 3.154 3.226 1.098 1.00 0.22 O ATOM 14 CB ILE A 2 2.629 5.022 3.587 1.00 0.27 C ATOM 15 CG1 ILE A 2 1.675 3.830 3.667 1.00 0.31 C ATOM 16 CG2 ILE A 2 1.958 6.193 2.885 1.00 0.33 C ATOM 17 CD1 ILE A 2 2.079 2.800 4.694 1.00 0.77 C ATOM 18 H ILE A 2 4.690 6.575 3.226 1.00 0.31 H ATOM 19 HA ILE A 2 4.334 3.740 3.369 1.00 0.27 H ATOM 20 HB ILE A 2 2.877 5.332 4.585 1.00 0.34 H ATOM 21 HG12 ILE A 2 0.685 4.179 3.919 1.00 0.63 H ATOM 22 HG13 ILE A 2 1.645 3.342 2.704 1.00 0.74 H ATOM 23 HG21 ILE A 2 1.021 6.416 3.373 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.774 5.938 1.852 1.00 1.10 H ATOM 25 HG23 ILE A 2 2.602 7.058 2.933 1.00 1.08 H ATOM 26 HD11 ILE A 2 3.055 2.410 4.447 1.00 1.38 H ATOM 27 HD12 ILE A 2 1.360 1.994 4.697 1.00 1.38 H ATOM 28 HD13 ILE A 2 2.111 3.258 5.671 1.00 1.42 H ATOM 29 N VAL A 3 4.042 5.204 0.529 1.00 0.14 N ATOM 30 CA VAL A 3 3.878 4.977 -0.902 1.00 0.20 C ATOM 31 C VAL A 3 4.820 3.879 -1.402 1.00 0.16 C ATOM 32 O VAL A 3 4.395 2.970 -2.110 1.00 0.19 O ATOM 33 CB VAL A 3 4.087 6.270 -1.728 1.00 0.33 C ATOM 34 CG1 VAL A 3 5.434 6.907 -1.429 1.00 0.92 C ATOM 35 CG2 VAL A 3 3.957 5.980 -3.218 1.00 0.94 C ATOM 36 H VAL A 3 4.411 6.057 0.846 1.00 0.20 H ATOM 37 HA VAL A 3 2.858 4.647 -1.054 1.00 0.25 H ATOM 38 HB VAL A 3 3.315 6.974 -1.455 1.00 0.65 H ATOM 39 HG11 VAL A 3 6.223 6.244 -1.749 1.00 1.51 H ATOM 40 HG12 VAL A 3 5.521 7.082 -0.369 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.514 7.844 -1.958 1.00 1.49 H ATOM 42 HG21 VAL A 3 2.967 5.603 -3.426 1.00 1.54 H ATOM 43 HG22 VAL A 3 4.692 5.240 -3.507 1.00 1.49 H ATOM 44 HG23 VAL A 3 4.122 6.889 -3.777 1.00 1.53 H ATOM 45 N THR A 4 6.092 3.950 -1.019 1.00 0.17 N ATOM 46 CA THR A 4 7.064 2.937 -1.411 1.00 0.21 C ATOM 47 C THR A 4 6.727 1.611 -0.739 1.00 0.18 C ATOM 48 O THR A 4 6.970 0.526 -1.291 1.00 0.21 O ATOM 49 CB THR A 4 8.492 3.379 -1.051 1.00 0.32 C ATOM 50 OG1 THR A 4 8.510 3.940 0.268 1.00 0.63 O ATOM 51 CG2 THR A 4 9.010 4.403 -2.050 1.00 0.66 C ATOM 52 H THR A 4 6.383 4.697 -0.456 1.00 0.21 H ATOM 53 HA THR A 4 7.000 2.812 -2.485 1.00 0.24 H ATOM 54 HB THR A 4 9.139 2.514 -1.076 1.00 0.54 H ATOM 55 HG1 THR A 4 9.383 3.811 0.659 1.00 1.24 H ATOM 56 HG21 THR A 4 10.015 4.691 -1.781 1.00 1.24 H ATOM 57 HG22 THR A 4 8.371 5.274 -2.034 1.00 1.30 H ATOM 58 HG23 THR A 4 9.010 3.973 -3.039 1.00 1.28 H ATOM 59 N LYS A 5 6.165 1.718 0.458 1.00 0.18 N ATOM 60 CA LYS A 5 5.540 0.589 1.121 1.00 0.27 C ATOM 61 C LYS A 5 4.466 0.011 0.208 1.00 0.21 C ATOM 62 O LYS A 5 4.553 -1.143 -0.210 1.00 0.22 O ATOM 63 CB LYS A 5 4.922 1.046 2.447 1.00 0.46 C ATOM 64 CG LYS A 5 5.727 0.666 3.681 1.00 0.94 C ATOM 65 CD LYS A 5 5.145 -0.559 4.373 1.00 0.90 C ATOM 66 CE LYS A 5 3.802 -0.250 5.031 1.00 0.81 C ATOM 67 NZ LYS A 5 3.963 0.597 6.239 1.00 1.23 N ATOM 68 H LYS A 5 6.176 2.589 0.911 1.00 0.19 H ATOM 69 HA LYS A 5 6.294 -0.158 1.310 1.00 0.37 H ATOM 70 HB2 LYS A 5 4.827 2.120 2.428 1.00 1.25 H ATOM 71 HB3 LYS A 5 3.938 0.613 2.539 1.00 1.15 H ATOM 72 HG2 LYS A 5 6.741 0.451 3.383 1.00 1.72 H ATOM 73 HG3 LYS A 5 5.723 1.496 4.372 1.00 1.75 H ATOM 74 HD2 LYS A 5 5.006 -1.341 3.643 1.00 1.31 H ATOM 75 HD3 LYS A 5 5.838 -0.894 5.132 1.00 1.33 H ATOM 76 HE2 LYS A 5 3.176 0.277 4.321 1.00 1.09 H ATOM 77 HE3 LYS A 5 3.323 -1.178 5.310 1.00 0.97 H ATOM 78 HZ1 LYS A 5 3.069 0.786 6.648 1.00 1.66 H ATOM 79 HZ2 LYS A 5 4.395 1.464 6.000 1.00 1.71 H ATOM 80 HZ3 LYS A 5 4.534 0.132 6.914 1.00 1.67 H ATOM 81 N LEU A 6 3.487 0.855 -0.126 1.00 0.21 N ATOM 82 CA LEU A 6 2.353 0.505 -0.992 1.00 0.25 C ATOM 83 C LEU A 6 2.788 -0.209 -2.274 1.00 0.21 C ATOM 84 O LEU A 6 1.990 -0.897 -2.914 1.00 0.26 O ATOM 85 CB LEU A 6 1.567 1.788 -1.321 1.00 0.36 C ATOM 86 CG LEU A 6 0.660 1.746 -2.553 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.566 2.603 -2.319 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.401 2.242 -3.786 1.00 1.21 C ATOM 89 H LEU A 6 3.525 1.771 0.233 1.00 0.22 H ATOM 90 HA LEU A 6 1.708 -0.156 -0.434 1.00 0.32 H ATOM 91 HB2 LEU A 6 0.952 2.033 -0.469 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.281 2.587 -1.461 1.00 0.85 H ATOM 93 HG LEU A 6 0.338 0.731 -2.732 1.00 1.34 H ATOM 94 HD11 LEU A 6 -1.144 2.188 -1.508 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.166 2.625 -3.216 1.00 1.71 H ATOM 96 HD13 LEU A 6 -0.260 3.608 -2.065 1.00 1.70 H ATOM 97 HD21 LEU A 6 2.263 1.615 -3.961 1.00 1.76 H ATOM 98 HD22 LEU A 6 1.724 3.259 -3.626 1.00 1.73 H ATOM 99 HD23 LEU A 6 0.746 2.200 -4.642 1.00 1.81 H ATOM 100 N ILE A 7 4.041 -0.041 -2.648 1.00 0.16 N ATOM 101 CA ILE A 7 4.567 -0.682 -3.831 1.00 0.18 C ATOM 102 C ILE A 7 4.663 -2.203 -3.648 1.00 0.16 C ATOM 103 O ILE A 7 3.898 -2.950 -4.266 1.00 0.19 O ATOM 104 CB ILE A 7 5.944 -0.098 -4.205 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.837 1.422 -4.365 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.475 -0.731 -5.483 1.00 0.27 C ATOM 107 CD1 ILE A 7 4.909 1.868 -5.476 1.00 1.07 C ATOM 108 H ILE A 7 4.625 0.536 -2.113 1.00 0.16 H ATOM 109 HA ILE A 7 3.891 -0.473 -4.643 1.00 0.23 H ATOM 110 HB ILE A 7 6.635 -0.320 -3.406 1.00 0.20 H ATOM 111 HG12 ILE A 7 5.467 1.846 -3.444 1.00 0.88 H ATOM 112 HG13 ILE A 7 6.812 1.825 -4.568 1.00 0.79 H ATOM 113 HG21 ILE A 7 5.785 -0.541 -6.293 1.00 1.06 H ATOM 114 HG22 ILE A 7 6.579 -1.795 -5.341 1.00 1.06 H ATOM 115 HG23 ILE A 7 7.438 -0.303 -5.723 1.00 1.06 H ATOM 116 HD11 ILE A 7 3.908 1.520 -5.271 1.00 1.67 H ATOM 117 HD12 ILE A 7 5.248 1.456 -6.414 1.00 1.67 H ATOM 118 HD13 ILE A 7 4.912 2.946 -5.533 1.00 1.64 H ATOM 119 N LYS A 8 5.592 -2.668 -2.809 1.00 0.13 N ATOM 120 CA LYS A 8 5.835 -4.117 -2.703 1.00 0.12 C ATOM 121 C LYS A 8 5.076 -4.781 -1.549 1.00 0.11 C ATOM 122 O LYS A 8 4.097 -5.490 -1.764 1.00 0.13 O ATOM 123 CB LYS A 8 7.330 -4.436 -2.545 1.00 0.17 C ATOM 124 CG LYS A 8 8.272 -3.438 -3.199 1.00 0.49 C ATOM 125 CD LYS A 8 8.608 -2.299 -2.251 1.00 0.78 C ATOM 126 CE LYS A 8 9.471 -1.246 -2.917 1.00 0.98 C ATOM 127 NZ LYS A 8 9.747 -0.112 -2.001 1.00 1.70 N ATOM 128 H LYS A 8 6.098 -2.037 -2.248 1.00 0.13 H ATOM 129 HA LYS A 8 5.487 -4.561 -3.622 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.562 -4.475 -1.492 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.518 -5.408 -2.976 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.185 -3.944 -3.476 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.800 -3.034 -4.082 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.692 -1.837 -1.917 1.00 1.28 H ATOM 135 HD3 LYS A 8 9.140 -2.701 -1.400 1.00 1.16 H ATOM 136 HE2 LYS A 8 10.408 -1.697 -3.210 1.00 1.43 H ATOM 137 HE3 LYS A 8 8.959 -0.877 -3.793 1.00 1.50 H ATOM 138 HZ1 LYS A 8 10.257 0.603 -2.484 1.00 2.17 H ATOM 139 HZ2 LYS A 8 10.289 -0.421 -1.222 1.00 2.16 H ATOM 140 HZ3 LYS A 8 8.888 0.273 -1.664 1.00 2.17 H ATOM 141 N LYS A 9 5.547 -4.552 -0.325 1.00 0.12 N ATOM 142 CA LYS A 9 5.025 -5.255 0.852 1.00 0.14 C ATOM 143 C LYS A 9 3.908 -4.447 1.485 1.00 0.13 C ATOM 144 O LYS A 9 2.834 -4.959 1.810 1.00 0.17 O ATOM 145 CB LYS A 9 6.131 -5.480 1.882 1.00 0.21 C ATOM 146 CG LYS A 9 7.380 -6.148 1.329 1.00 0.84 C ATOM 147 CD LYS A 9 7.113 -7.571 0.867 1.00 1.34 C ATOM 148 CE LYS A 9 8.409 -8.296 0.536 1.00 2.00 C ATOM 149 NZ LYS A 9 9.293 -8.426 1.727 1.00 2.66 N ATOM 150 H LYS A 9 6.254 -3.881 -0.206 1.00 0.13 H ATOM 151 HA LYS A 9 4.638 -6.209 0.530 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.419 -4.525 2.296 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.743 -6.098 2.677 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.740 -5.574 0.489 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.134 -6.167 2.100 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.604 -8.105 1.654 1.00 1.78 H ATOM 157 HD3 LYS A 9 6.490 -7.544 -0.014 1.00 1.82 H ATOM 158 HE2 LYS A 9 8.172 -9.283 0.166 1.00 2.46 H ATOM 159 HE3 LYS A 9 8.930 -7.743 -0.230 1.00 2.44 H ATOM 160 HZ1 LYS A 9 8.824 -8.934 2.451 1.00 3.04 H ATOM 161 HZ2 LYS A 9 9.539 -7.523 2.077 1.00 3.03 H ATOM 162 HZ3 LYS A 9 10.132 -8.913 1.482 1.00 3.05 H ATOM 163 N GLY A 10 4.203 -3.170 1.645 1.00 0.14 N ATOM 164 CA GLY A 10 3.253 -2.184 2.117 1.00 0.17 C ATOM 165 C GLY A 10 1.983 -2.145 1.302 1.00 0.16 C ATOM 166 O GLY A 10 1.033 -1.487 1.698 1.00 0.20 O ATOM 167 H GLY A 10 5.112 -2.873 1.422 1.00 0.15 H ATOM 168 HA2 GLY A 10 3.000 -2.406 3.142 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.719 -1.212 2.075 1.00 0.21 H ATOM 170 N VAL A 11 2.039 -2.751 0.106 1.00 0.14 N ATOM 171 CA VAL A 11 0.936 -2.804 -0.867 1.00 0.16 C ATOM 172 C VAL A 11 -0.446 -2.956 -0.211 1.00 0.16 C ATOM 173 O VAL A 11 -1.466 -2.619 -0.812 1.00 0.18 O ATOM 174 CB VAL A 11 1.167 -3.963 -1.863 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.012 -5.309 -1.178 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.236 -3.852 -3.056 1.00 0.23 C ATOM 177 H VAL A 11 2.874 -3.197 -0.133 1.00 0.14 H ATOM 178 HA VAL A 11 0.952 -1.882 -1.427 1.00 0.19 H ATOM 179 HB VAL A 11 2.185 -3.892 -2.227 1.00 0.19 H ATOM 180 HG11 VAL A 11 0.018 -5.390 -0.762 1.00 1.03 H ATOM 181 HG12 VAL A 11 1.741 -5.396 -0.386 1.00 1.04 H ATOM 182 HG13 VAL A 11 1.166 -6.099 -1.896 1.00 1.04 H ATOM 183 HG21 VAL A 11 -0.787 -3.904 -2.714 1.00 1.06 H ATOM 184 HG22 VAL A 11 0.432 -4.663 -3.740 1.00 1.04 H ATOM 185 HG23 VAL A 11 0.402 -2.910 -3.554 1.00 1.04 H ATOM 186 N LYS A 12 -0.462 -3.483 1.005 1.00 0.16 N ATOM 187 CA LYS A 12 -1.618 -3.409 1.895 1.00 0.19 C ATOM 188 C LYS A 12 -2.308 -2.036 1.797 1.00 0.15 C ATOM 189 O LYS A 12 -3.529 -1.959 1.674 1.00 0.14 O ATOM 190 CB LYS A 12 -1.132 -3.677 3.327 1.00 0.27 C ATOM 191 CG LYS A 12 -2.054 -3.180 4.437 1.00 0.46 C ATOM 192 CD LYS A 12 -3.461 -3.768 4.357 1.00 0.97 C ATOM 193 CE LYS A 12 -3.553 -5.159 4.981 1.00 1.65 C ATOM 194 NZ LYS A 12 -2.809 -6.188 4.207 1.00 2.26 N ATOM 195 H LYS A 12 0.341 -3.941 1.319 1.00 0.16 H ATOM 196 HA LYS A 12 -2.318 -4.179 1.606 1.00 0.24 H ATOM 197 HB2 LYS A 12 -0.998 -4.738 3.449 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.172 -3.196 3.454 1.00 0.33 H ATOM 199 HG2 LYS A 12 -1.622 -3.455 5.387 1.00 0.85 H ATOM 200 HG3 LYS A 12 -2.113 -2.101 4.374 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.141 -3.108 4.875 1.00 1.47 H ATOM 202 HD3 LYS A 12 -3.748 -3.833 3.318 1.00 1.42 H ATOM 203 HE2 LYS A 12 -3.147 -5.115 5.980 1.00 2.23 H ATOM 204 HE3 LYS A 12 -4.594 -5.444 5.033 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -3.130 -6.205 3.258 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -2.956 -7.090 4.609 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -1.830 -5.989 4.218 1.00 2.67 H ATOM 208 N LEU A 13 -1.509 -0.970 1.822 1.00 0.15 N ATOM 209 CA LEU A 13 -2.004 0.396 1.690 1.00 0.15 C ATOM 210 C LEU A 13 -2.796 0.540 0.392 1.00 0.13 C ATOM 211 O LEU A 13 -3.861 1.153 0.368 1.00 0.15 O ATOM 212 CB LEU A 13 -0.811 1.366 1.710 1.00 0.20 C ATOM 213 CG LEU A 13 -1.111 2.840 2.040 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.912 3.515 0.943 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.843 2.952 3.369 1.00 0.38 C ATOM 216 H LEU A 13 -0.540 -1.109 1.931 1.00 0.19 H ATOM 217 HA LEU A 13 -2.652 0.607 2.526 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.102 1.003 2.440 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.342 1.330 0.741 1.00 0.21 H ATOM 220 HG LEU A 13 -0.173 3.372 2.132 1.00 0.30 H ATOM 221 HD11 LEU A 13 -2.140 4.529 1.235 1.00 1.08 H ATOM 222 HD12 LEU A 13 -2.832 2.969 0.785 1.00 1.08 H ATOM 223 HD13 LEU A 13 -1.336 3.523 0.031 1.00 1.09 H ATOM 224 HD21 LEU A 13 -1.975 3.994 3.619 1.00 1.09 H ATOM 225 HD22 LEU A 13 -1.264 2.466 4.140 1.00 1.09 H ATOM 226 HD23 LEU A 13 -2.809 2.476 3.290 1.00 1.10 H ATOM 227 N GLY A 14 -2.280 -0.053 -0.677 1.00 0.18 N ATOM 228 CA GLY A 14 -2.950 -0.006 -1.962 1.00 0.23 C ATOM 229 C GLY A 14 -4.313 -0.664 -1.915 1.00 0.22 C ATOM 230 O GLY A 14 -5.283 -0.148 -2.473 1.00 0.29 O ATOM 231 H GLY A 14 -1.438 -0.547 -0.587 1.00 0.22 H ATOM 232 HA2 GLY A 14 -3.069 1.025 -2.257 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.341 -0.513 -2.695 1.00 0.29 H ATOM 234 N LEU A 15 -4.394 -1.798 -1.231 1.00 0.22 N ATOM 235 CA LEU A 15 -5.662 -2.493 -1.060 1.00 0.29 C ATOM 236 C LEU A 15 -6.584 -1.698 -0.143 1.00 0.28 C ATOM 237 O LEU A 15 -7.805 -1.833 -0.205 1.00 0.39 O ATOM 238 CB LEU A 15 -5.455 -3.904 -0.493 1.00 0.35 C ATOM 239 CG LEU A 15 -4.963 -4.971 -1.485 1.00 0.41 C ATOM 240 CD1 LEU A 15 -5.849 -5.010 -2.720 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.513 -4.738 -1.876 1.00 0.39 C ATOM 242 H LEU A 15 -3.579 -2.179 -0.832 1.00 0.22 H ATOM 243 HA LEU A 15 -6.128 -2.570 -2.030 1.00 0.36 H ATOM 244 HB2 LEU A 15 -4.736 -3.840 0.312 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.394 -4.238 -0.082 1.00 0.41 H ATOM 246 HG LEU A 15 -5.024 -5.939 -1.009 1.00 0.51 H ATOM 247 HD11 LEU A 15 -5.752 -4.083 -3.264 1.00 1.13 H ATOM 248 HD12 LEU A 15 -6.877 -5.145 -2.420 1.00 1.16 H ATOM 249 HD13 LEU A 15 -5.548 -5.832 -3.352 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.200 -5.503 -2.570 1.00 1.08 H ATOM 251 HD22 LEU A 15 -2.891 -4.776 -0.993 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.417 -3.768 -2.342 1.00 1.10 H ATOM 253 N LYS A 16 -5.991 -0.863 0.701 1.00 0.21 N ATOM 254 CA LYS A 16 -6.752 0.002 1.595 1.00 0.28 C ATOM 255 C LYS A 16 -7.249 1.241 0.857 1.00 0.34 C ATOM 256 O LYS A 16 -8.169 1.917 1.313 1.00 0.46 O ATOM 257 CB LYS A 16 -5.899 0.407 2.802 1.00 0.34 C ATOM 258 CG LYS A 16 -5.543 -0.757 3.719 1.00 0.39 C ATOM 259 CD LYS A 16 -6.762 -1.309 4.445 1.00 1.31 C ATOM 260 CE LYS A 16 -7.374 -0.283 5.388 1.00 1.54 C ATOM 261 NZ LYS A 16 -8.541 -0.831 6.125 1.00 2.08 N ATOM 262 H LYS A 16 -5.009 -0.833 0.731 1.00 0.18 H ATOM 263 HA LYS A 16 -7.607 -0.558 1.942 1.00 0.35 H ATOM 264 HB2 LYS A 16 -4.981 0.849 2.445 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.439 1.142 3.379 1.00 0.43 H ATOM 266 HG2 LYS A 16 -5.108 -1.546 3.124 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.822 -0.422 4.450 1.00 0.78 H ATOM 268 HD2 LYS A 16 -7.503 -1.597 3.714 1.00 2.01 H ATOM 269 HD3 LYS A 16 -6.465 -2.177 5.017 1.00 1.98 H ATOM 270 HE2 LYS A 16 -6.623 0.025 6.100 1.00 2.03 H ATOM 271 HE3 LYS A 16 -7.692 0.572 4.811 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -8.938 -0.126 6.712 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -8.258 -1.600 6.694 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -9.238 -1.147 5.481 1.00 2.48 H ATOM 275 N MET A 17 -6.630 1.542 -0.281 1.00 0.37 N ATOM 276 CA MET A 17 -7.078 2.651 -1.115 1.00 0.49 C ATOM 277 C MET A 17 -8.221 2.199 -2.010 1.00 0.55 C ATOM 278 O MET A 17 -9.169 2.946 -2.259 1.00 0.66 O ATOM 279 CB MET A 17 -5.946 3.190 -1.995 1.00 0.60 C ATOM 280 CG MET A 17 -4.719 3.663 -1.239 1.00 0.69 C ATOM 281 SD MET A 17 -3.620 4.647 -2.276 1.00 1.70 S ATOM 282 CE MET A 17 -3.535 3.620 -3.745 1.00 2.33 C ATOM 283 H MET A 17 -5.853 1.013 -0.557 1.00 0.37 H ATOM 284 HA MET A 17 -7.431 3.438 -0.466 1.00 0.54 H ATOM 285 HB2 MET A 17 -5.638 2.411 -2.676 1.00 1.19 H ATOM 286 HB3 MET A 17 -6.325 4.022 -2.571 1.00 1.22 H ATOM 287 HG2 MET A 17 -5.036 4.264 -0.400 1.00 1.19 H ATOM 288 HG3 MET A 17 -4.172 2.799 -0.879 1.00 1.28 H ATOM 289 HE1 MET A 17 -3.200 2.631 -3.475 1.00 2.74 H ATOM 290 HE2 MET A 17 -2.840 4.053 -4.447 1.00 2.78 H ATOM 291 HE3 MET A 17 -4.512 3.558 -4.198 1.00 2.74 H ATOM 292 N ALA A 18 -8.114 0.973 -2.505 1.00 0.57 N ATOM 293 CA ALA A 18 -9.127 0.410 -3.384 1.00 0.70 C ATOM 294 C ALA A 18 -10.320 -0.097 -2.585 1.00 0.79 C ATOM 295 O ALA A 18 -11.464 0.235 -2.893 1.00 1.34 O ATOM 296 CB ALA A 18 -8.532 -0.714 -4.219 1.00 0.81 C ATOM 297 H ALA A 18 -7.323 0.435 -2.281 1.00 0.58 H ATOM 298 HA ALA A 18 -9.459 1.188 -4.055 1.00 0.78 H ATOM 299 HB1 ALA A 18 -8.199 -1.508 -3.568 1.00 1.33 H ATOM 300 HB2 ALA A 18 -7.693 -0.336 -4.784 1.00 1.31 H ATOM 301 HB3 ALA A 18 -9.281 -1.095 -4.896 1.00 1.33 H ATOM 302 N LEU A 19 -10.032 -0.885 -1.551 1.00 0.75 N ATOM 303 CA LEU A 19 -11.057 -1.480 -0.697 1.00 0.82 C ATOM 304 C LEU A 19 -12.012 -2.347 -1.511 1.00 1.31 C ATOM 305 O LEU A 19 -13.098 -1.862 -1.892 1.00 1.89 O ATOM 306 CB LEU A 19 -11.823 -0.399 0.073 1.00 1.07 C ATOM 307 CG LEU A 19 -10.981 0.397 1.073 1.00 1.32 C ATOM 308 CD1 LEU A 19 -11.812 1.488 1.727 1.00 2.07 C ATOM 309 CD2 LEU A 19 -10.394 -0.530 2.130 1.00 1.78 C ATOM 310 OXT LEU A 19 -11.660 -3.515 -1.780 1.00 1.90 O ATOM 311 H LEU A 19 -9.090 -1.075 -1.352 1.00 1.05 H ATOM 312 HA LEU A 19 -10.551 -2.115 0.014 1.00 0.82 H ATOM 313 HB2 LEU A 19 -12.247 0.292 -0.642 1.00 1.70 H ATOM 314 HB3 LEU A 19 -12.629 -0.873 0.612 1.00 1.39 H ATOM 315 HG LEU A 19 -10.164 0.870 0.549 1.00 1.78 H ATOM 316 HD11 LEU A 19 -11.196 2.048 2.414 1.00 2.52 H ATOM 317 HD12 LEU A 19 -12.635 1.041 2.265 1.00 2.57 H ATOM 318 HD13 LEU A 19 -12.198 2.151 0.965 1.00 2.47 H ATOM 319 HD21 LEU A 19 -9.831 0.052 2.845 1.00 2.23 H ATOM 320 HD22 LEU A 19 -9.741 -1.248 1.657 1.00 2.18 H ATOM 321 HD23 LEU A 19 -11.193 -1.048 2.637 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 10 ATOM 1 N GLY A 1 8.727 6.718 2.828 1.00 1.26 N ATOM 2 CA GLY A 1 7.278 7.029 2.850 1.00 0.47 C ATOM 3 C GLY A 1 6.444 5.780 2.702 1.00 0.35 C ATOM 4 O GLY A 1 6.973 4.714 2.389 1.00 0.42 O ATOM 5 H1 GLY A 1 8.972 6.295 1.955 1.00 1.79 H ATOM 6 H2 GLY A 1 8.952 6.080 3.564 1.00 1.72 H ATOM 7 H3 GLY A 1 9.263 7.553 2.948 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.033 7.507 3.787 1.00 0.89 H ATOM 9 HA3 GLY A 1 7.049 7.704 2.039 1.00 0.90 H ATOM 10 N ILE A 2 5.143 5.896 2.909 1.00 0.27 N ATOM 11 CA ILE A 2 4.273 4.735 2.855 1.00 0.21 C ATOM 12 C ILE A 2 3.884 4.411 1.419 1.00 0.14 C ATOM 13 O ILE A 2 3.432 3.313 1.127 1.00 0.22 O ATOM 14 CB ILE A 2 3.008 4.916 3.717 1.00 0.27 C ATOM 15 CG1 ILE A 2 2.241 3.597 3.790 1.00 0.31 C ATOM 16 CG2 ILE A 2 2.119 6.017 3.160 1.00 0.33 C ATOM 17 CD1 ILE A 2 1.443 3.422 5.057 1.00 0.77 C ATOM 18 H ILE A 2 4.757 6.782 3.092 1.00 0.31 H ATOM 19 HA ILE A 2 4.827 3.899 3.256 1.00 0.27 H ATOM 20 HB ILE A 2 3.318 5.203 4.704 1.00 0.34 H ATOM 21 HG12 ILE A 2 1.556 3.547 2.961 1.00 0.63 H ATOM 22 HG13 ILE A 2 2.938 2.777 3.719 1.00 0.74 H ATOM 23 HG21 ILE A 2 1.246 6.125 3.785 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.815 5.759 2.157 1.00 1.10 H ATOM 25 HG23 ILE A 2 2.667 6.948 3.142 1.00 1.08 H ATOM 26 HD11 ILE A 2 2.096 3.545 5.907 1.00 1.38 H ATOM 27 HD12 ILE A 2 1.016 2.430 5.073 1.00 1.38 H ATOM 28 HD13 ILE A 2 0.655 4.159 5.093 1.00 1.42 H ATOM 29 N VAL A 3 4.074 5.365 0.524 1.00 0.14 N ATOM 30 CA VAL A 3 3.766 5.150 -0.885 1.00 0.20 C ATOM 31 C VAL A 3 4.705 4.105 -1.506 1.00 0.16 C ATOM 32 O VAL A 3 4.286 3.287 -2.326 1.00 0.19 O ATOM 33 CB VAL A 3 3.831 6.466 -1.696 1.00 0.33 C ATOM 34 CG1 VAL A 3 5.200 7.120 -1.577 1.00 0.92 C ATOM 35 CG2 VAL A 3 3.481 6.211 -3.155 1.00 0.94 C ATOM 36 H VAL A 3 4.404 6.238 0.823 1.00 0.20 H ATOM 37 HA VAL A 3 2.752 4.774 -0.938 1.00 0.25 H ATOM 38 HB VAL A 3 3.099 7.148 -1.289 1.00 0.65 H ATOM 39 HG11 VAL A 3 5.200 8.055 -2.116 1.00 1.51 H ATOM 40 HG12 VAL A 3 5.947 6.463 -1.994 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.422 7.303 -0.536 1.00 1.49 H ATOM 42 HG21 VAL A 3 2.459 5.870 -3.227 1.00 1.54 H ATOM 43 HG22 VAL A 3 4.141 5.454 -3.557 1.00 1.49 H ATOM 44 HG23 VAL A 3 3.596 7.125 -3.718 1.00 1.53 H ATOM 45 N THR A 4 5.968 4.123 -1.103 1.00 0.17 N ATOM 46 CA THR A 4 6.938 3.155 -1.593 1.00 0.21 C ATOM 47 C THR A 4 6.731 1.812 -0.903 1.00 0.18 C ATOM 48 O THR A 4 6.948 0.734 -1.487 1.00 0.21 O ATOM 49 CB THR A 4 8.369 3.663 -1.370 1.00 0.32 C ATOM 50 OG1 THR A 4 8.491 4.207 -0.049 1.00 0.63 O ATOM 51 CG2 THR A 4 8.723 4.725 -2.396 1.00 0.66 C ATOM 52 H THR A 4 6.258 4.804 -0.460 1.00 0.21 H ATOM 53 HA THR A 4 6.779 3.032 -2.656 1.00 0.24 H ATOM 54 HB THR A 4 9.054 2.834 -1.479 1.00 0.54 H ATOM 55 HG1 THR A 4 9.069 3.643 0.478 1.00 1.24 H ATOM 56 HG21 THR A 4 8.012 5.535 -2.335 1.00 1.24 H ATOM 57 HG22 THR A 4 8.694 4.293 -3.386 1.00 1.30 H ATOM 58 HG23 THR A 4 9.714 5.102 -2.196 1.00 1.28 H ATOM 59 N LYS A 5 6.290 1.890 0.343 1.00 0.18 N ATOM 60 CA LYS A 5 5.876 0.728 1.079 1.00 0.27 C ATOM 61 C LYS A 5 4.686 0.100 0.354 1.00 0.21 C ATOM 62 O LYS A 5 4.716 -1.080 0.015 1.00 0.22 O ATOM 63 CB LYS A 5 5.557 1.156 2.522 1.00 0.46 C ATOM 64 CG LYS A 5 4.503 0.328 3.220 1.00 0.94 C ATOM 65 CD LYS A 5 4.327 0.738 4.674 1.00 0.90 C ATOM 66 CE LYS A 5 3.145 0.026 5.319 1.00 0.81 C ATOM 67 NZ LYS A 5 3.004 0.390 6.752 1.00 1.23 N ATOM 68 H LYS A 5 6.231 2.763 0.776 1.00 0.19 H ATOM 69 HA LYS A 5 6.697 0.025 1.085 1.00 0.37 H ATOM 70 HB2 LYS A 5 6.464 1.099 3.106 1.00 1.25 H ATOM 71 HB3 LYS A 5 5.222 2.182 2.507 1.00 1.15 H ATOM 72 HG2 LYS A 5 3.571 0.464 2.702 1.00 1.72 H ATOM 73 HG3 LYS A 5 4.793 -0.707 3.187 1.00 1.75 H ATOM 74 HD2 LYS A 5 5.224 0.486 5.218 1.00 1.31 H ATOM 75 HD3 LYS A 5 4.164 1.802 4.721 1.00 1.33 H ATOM 76 HE2 LYS A 5 2.238 0.302 4.795 1.00 1.09 H ATOM 77 HE3 LYS A 5 3.293 -1.041 5.239 1.00 0.97 H ATOM 78 HZ1 LYS A 5 2.200 -0.059 7.145 1.00 1.66 H ATOM 79 HZ2 LYS A 5 2.896 1.378 6.849 1.00 1.71 H ATOM 80 HZ3 LYS A 5 3.817 0.105 7.260 1.00 1.67 H ATOM 81 N LEU A 6 3.691 0.937 0.043 1.00 0.21 N ATOM 82 CA LEU A 6 2.493 0.548 -0.718 1.00 0.25 C ATOM 83 C LEU A 6 2.836 -0.226 -1.988 1.00 0.21 C ATOM 84 O LEU A 6 2.011 -0.979 -2.506 1.00 0.26 O ATOM 85 CB LEU A 6 1.679 1.807 -1.074 1.00 0.36 C ATOM 86 CG LEU A 6 0.792 1.709 -2.318 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.498 2.461 -2.092 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.507 2.270 -3.538 1.00 1.21 C ATOM 89 H LEU A 6 3.761 1.869 0.344 1.00 0.22 H ATOM 90 HA LEU A 6 1.886 -0.080 -0.086 1.00 0.32 H ATOM 91 HB2 LEU A 6 1.041 2.047 -0.235 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.371 2.623 -1.219 1.00 0.85 H ATOM 93 HG LEU A 6 0.554 0.673 -2.507 1.00 1.34 H ATOM 94 HD11 LEU A 6 -1.034 2.006 -1.271 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.102 2.417 -2.986 1.00 1.71 H ATOM 96 HD13 LEU A 6 -0.280 3.491 -1.853 1.00 1.70 H ATOM 97 HD21 LEU A 6 0.869 2.175 -4.405 1.00 1.76 H ATOM 98 HD22 LEU A 6 2.422 1.720 -3.702 1.00 1.73 H ATOM 99 HD23 LEU A 6 1.737 3.311 -3.372 1.00 1.81 H ATOM 100 N ILE A 7 4.039 -0.026 -2.498 1.00 0.16 N ATOM 101 CA ILE A 7 4.460 -0.703 -3.705 1.00 0.18 C ATOM 102 C ILE A 7 4.578 -2.212 -3.487 1.00 0.16 C ATOM 103 O ILE A 7 3.795 -2.981 -4.044 1.00 0.19 O ATOM 104 CB ILE A 7 5.797 -0.149 -4.243 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.696 1.366 -4.463 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.183 -0.854 -5.536 1.00 0.27 C ATOM 107 CD1 ILE A 7 6.955 1.988 -5.031 1.00 1.07 C ATOM 108 H ILE A 7 4.653 0.593 -2.052 1.00 0.16 H ATOM 109 HA ILE A 7 3.704 -0.529 -4.454 1.00 0.23 H ATOM 110 HB ILE A 7 6.565 -0.348 -3.509 1.00 0.20 H ATOM 111 HG12 ILE A 7 4.885 1.576 -5.144 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.490 1.842 -3.517 1.00 0.79 H ATOM 113 HG21 ILE A 7 7.124 -0.462 -5.891 1.00 1.06 H ATOM 114 HG22 ILE A 7 5.418 -0.685 -6.279 1.00 1.06 H ATOM 115 HG23 ILE A 7 6.280 -1.914 -5.352 1.00 1.06 H ATOM 116 HD11 ILE A 7 7.780 1.811 -4.357 1.00 1.67 H ATOM 117 HD12 ILE A 7 6.809 3.051 -5.151 1.00 1.67 H ATOM 118 HD13 ILE A 7 7.173 1.544 -5.992 1.00 1.64 H ATOM 119 N LYS A 8 5.545 -2.648 -2.681 1.00 0.13 N ATOM 120 CA LYS A 8 5.830 -4.088 -2.604 1.00 0.12 C ATOM 121 C LYS A 8 5.087 -4.802 -1.473 1.00 0.11 C ATOM 122 O LYS A 8 4.114 -5.512 -1.712 1.00 0.13 O ATOM 123 CB LYS A 8 7.330 -4.356 -2.439 1.00 0.17 C ATOM 124 CG LYS A 8 8.241 -3.334 -3.106 1.00 0.49 C ATOM 125 CD LYS A 8 8.608 -2.211 -2.148 1.00 0.78 C ATOM 126 CE LYS A 8 9.510 -1.181 -2.803 1.00 0.98 C ATOM 127 NZ LYS A 8 9.966 -0.157 -1.830 1.00 1.70 N ATOM 128 H LYS A 8 6.057 -2.000 -2.132 1.00 0.13 H ATOM 129 HA LYS A 8 5.504 -4.523 -3.536 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.559 -4.375 -1.383 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.551 -5.326 -2.858 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.144 -3.827 -3.429 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.731 -2.915 -3.961 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.704 -1.721 -1.819 1.00 1.28 H ATOM 135 HD3 LYS A 8 9.119 -2.633 -1.295 1.00 1.16 H ATOM 136 HE2 LYS A 8 10.372 -1.683 -3.215 1.00 1.43 H ATOM 137 HE3 LYS A 8 8.964 -0.692 -3.597 1.00 1.50 H ATOM 138 HZ1 LYS A 8 10.526 0.532 -2.290 1.00 2.17 H ATOM 139 HZ2 LYS A 8 10.514 -0.584 -1.111 1.00 2.16 H ATOM 140 HZ3 LYS A 8 9.179 0.294 -1.406 1.00 2.17 H ATOM 141 N LYS A 9 5.551 -4.606 -0.243 1.00 0.12 N ATOM 142 CA LYS A 9 5.012 -5.341 0.907 1.00 0.14 C ATOM 143 C LYS A 9 3.893 -4.541 1.540 1.00 0.13 C ATOM 144 O LYS A 9 2.885 -5.074 2.001 1.00 0.17 O ATOM 145 CB LYS A 9 6.107 -5.614 1.943 1.00 0.21 C ATOM 146 CG LYS A 9 7.277 -6.431 1.417 1.00 0.84 C ATOM 147 CD LYS A 9 6.857 -7.845 1.052 1.00 1.34 C ATOM 148 CE LYS A 9 8.056 -8.709 0.694 1.00 2.00 C ATOM 149 NZ LYS A 9 8.972 -8.898 1.850 1.00 2.66 N ATOM 150 H LYS A 9 6.256 -3.940 -0.099 1.00 0.13 H ATOM 151 HA LYS A 9 4.621 -6.278 0.546 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.489 -4.671 2.299 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.670 -6.148 2.775 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.673 -5.946 0.537 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.041 -6.476 2.178 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.347 -8.287 1.894 1.00 1.78 H ATOM 157 HD3 LYS A 9 6.188 -7.803 0.204 1.00 1.82 H ATOM 158 HE2 LYS A 9 7.703 -9.675 0.365 1.00 2.46 H ATOM 159 HE3 LYS A 9 8.598 -8.232 -0.109 1.00 2.44 H ATOM 160 HZ1 LYS A 9 9.333 -8.015 2.156 1.00 3.04 H ATOM 161 HZ2 LYS A 9 9.739 -9.484 1.592 1.00 3.03 H ATOM 162 HZ3 LYS A 9 8.483 -9.328 2.611 1.00 3.05 H ATOM 163 N GLY A 10 4.112 -3.245 1.540 1.00 0.14 N ATOM 164 CA GLY A 10 3.132 -2.275 1.966 1.00 0.17 C ATOM 165 C GLY A 10 1.858 -2.345 1.176 1.00 0.16 C ATOM 166 O GLY A 10 0.891 -1.703 1.545 1.00 0.20 O ATOM 167 H GLY A 10 4.981 -2.921 1.225 1.00 0.15 H ATOM 168 HA2 GLY A 10 2.909 -2.435 3.009 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.552 -1.290 1.847 1.00 0.21 H ATOM 170 N VAL A 11 1.924 -3.030 0.031 1.00 0.14 N ATOM 171 CA VAL A 11 0.837 -3.136 -0.949 1.00 0.16 C ATOM 172 C VAL A 11 -0.560 -3.222 -0.306 1.00 0.16 C ATOM 173 O VAL A 11 -1.553 -2.842 -0.923 1.00 0.18 O ATOM 174 CB VAL A 11 1.078 -4.360 -1.863 1.00 0.18 C ATOM 175 CG1 VAL A 11 0.914 -5.662 -1.096 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.165 -4.322 -3.072 1.00 0.23 C ATOM 177 H VAL A 11 2.756 -3.502 -0.164 1.00 0.14 H ATOM 178 HA VAL A 11 0.876 -2.255 -1.568 1.00 0.19 H ATOM 179 HB VAL A 11 2.101 -4.313 -2.218 1.00 0.19 H ATOM 180 HG11 VAL A 11 -0.088 -5.720 -0.699 1.00 1.03 H ATOM 181 HG12 VAL A 11 1.626 -5.693 -0.283 1.00 1.04 H ATOM 182 HG13 VAL A 11 1.088 -6.496 -1.759 1.00 1.04 H ATOM 183 HG21 VAL A 11 0.346 -5.194 -3.683 1.00 1.06 H ATOM 184 HG22 VAL A 11 0.370 -3.432 -3.645 1.00 1.04 H ATOM 185 HG23 VAL A 11 -0.862 -4.315 -2.744 1.00 1.04 H ATOM 186 N LYS A 12 -0.619 -3.729 0.919 1.00 0.16 N ATOM 187 CA LYS A 12 -1.799 -3.614 1.777 1.00 0.19 C ATOM 188 C LYS A 12 -2.423 -2.209 1.692 1.00 0.15 C ATOM 189 O LYS A 12 -3.631 -2.074 1.513 1.00 0.14 O ATOM 190 CB LYS A 12 -1.375 -3.928 3.218 1.00 0.27 C ATOM 191 CG LYS A 12 -2.353 -3.477 4.297 1.00 0.46 C ATOM 192 CD LYS A 12 -3.719 -4.136 4.155 1.00 0.97 C ATOM 193 CE LYS A 12 -3.652 -5.635 4.412 1.00 1.65 C ATOM 194 NZ LYS A 12 -4.988 -6.277 4.304 1.00 2.26 N ATOM 195 H LYS A 12 0.164 -4.206 1.262 1.00 0.16 H ATOM 196 HA LYS A 12 -2.527 -4.345 1.450 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.240 -4.994 3.310 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.427 -3.445 3.404 1.00 0.33 H ATOM 199 HG2 LYS A 12 -1.943 -3.735 5.262 1.00 0.85 H ATOM 200 HG3 LYS A 12 -2.467 -2.402 4.233 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.396 -3.689 4.866 1.00 1.47 H ATOM 202 HD3 LYS A 12 -4.086 -3.968 3.153 1.00 1.42 H ATOM 203 HE2 LYS A 12 -2.988 -6.084 3.689 1.00 2.23 H ATOM 204 HE3 LYS A 12 -3.262 -5.799 5.407 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -4.914 -7.260 4.467 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -5.369 -6.131 3.393 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -5.615 -5.885 4.977 1.00 2.67 H ATOM 208 N LEU A 13 -1.582 -1.179 1.804 1.00 0.15 N ATOM 209 CA LEU A 13 -2.012 0.215 1.703 1.00 0.15 C ATOM 210 C LEU A 13 -2.735 0.432 0.378 1.00 0.13 C ATOM 211 O LEU A 13 -3.753 1.117 0.322 1.00 0.15 O ATOM 212 CB LEU A 13 -0.785 1.146 1.810 1.00 0.20 C ATOM 213 CG LEU A 13 -1.049 2.630 2.145 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.822 3.343 1.047 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.781 2.757 3.469 1.00 0.38 C ATOM 216 H LEU A 13 -0.626 -1.366 1.952 1.00 0.19 H ATOM 217 HA LEU A 13 -2.691 0.422 2.516 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.134 0.747 2.572 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.259 1.107 0.869 1.00 0.21 H ATOM 220 HG LEU A 13 -0.099 3.133 2.243 1.00 0.30 H ATOM 221 HD11 LEU A 13 -1.226 3.373 0.148 1.00 1.08 H ATOM 222 HD12 LEU A 13 -2.051 4.350 1.363 1.00 1.08 H ATOM 223 HD13 LEU A 13 -2.741 2.809 0.852 1.00 1.09 H ATOM 224 HD21 LEU A 13 -2.743 2.275 3.397 1.00 1.09 H ATOM 225 HD22 LEU A 13 -1.918 3.802 3.705 1.00 1.09 H ATOM 226 HD23 LEU A 13 -1.198 2.286 4.246 1.00 1.10 H ATOM 227 N GLY A 14 -2.210 -0.179 -0.678 1.00 0.18 N ATOM 228 CA GLY A 14 -2.833 -0.092 -1.984 1.00 0.23 C ATOM 229 C GLY A 14 -4.268 -0.568 -1.948 1.00 0.22 C ATOM 230 O GLY A 14 -5.159 0.073 -2.496 1.00 0.29 O ATOM 231 H GLY A 14 -1.395 -0.712 -0.564 1.00 0.22 H ATOM 232 HA2 GLY A 14 -2.808 0.934 -2.320 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.279 -0.704 -2.679 1.00 0.29 H ATOM 234 N LEU A 15 -4.493 -1.675 -1.261 1.00 0.22 N ATOM 235 CA LEU A 15 -5.827 -2.239 -1.130 1.00 0.29 C ATOM 236 C LEU A 15 -6.666 -1.431 -0.147 1.00 0.28 C ATOM 237 O LEU A 15 -7.892 -1.485 -0.174 1.00 0.39 O ATOM 238 CB LEU A 15 -5.756 -3.703 -0.678 1.00 0.35 C ATOM 239 CG LEU A 15 -5.317 -4.718 -1.741 1.00 0.41 C ATOM 240 CD1 LEU A 15 -6.199 -4.615 -2.976 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.854 -4.542 -2.115 1.00 0.39 C ATOM 242 H LEU A 15 -3.738 -2.128 -0.826 1.00 0.22 H ATOM 243 HA LEU A 15 -6.298 -2.196 -2.100 1.00 0.36 H ATOM 244 HB2 LEU A 15 -5.063 -3.762 0.150 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.733 -3.990 -0.321 1.00 0.41 H ATOM 246 HG LEU A 15 -5.434 -5.712 -1.333 1.00 0.51 H ATOM 247 HD11 LEU A 15 -7.229 -4.785 -2.700 1.00 1.13 H ATOM 248 HD12 LEU A 15 -5.893 -5.356 -3.699 1.00 1.16 H ATOM 249 HD13 LEU A 15 -6.102 -3.629 -3.409 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.240 -4.673 -1.236 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.702 -3.552 -2.516 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.582 -5.277 -2.857 1.00 1.10 H ATOM 253 N LYS A 16 -6.001 -0.681 0.718 1.00 0.21 N ATOM 254 CA LYS A 16 -6.689 0.154 1.694 1.00 0.28 C ATOM 255 C LYS A 16 -7.095 1.491 1.081 1.00 0.34 C ATOM 256 O LYS A 16 -8.075 2.104 1.499 1.00 0.46 O ATOM 257 CB LYS A 16 -5.799 0.385 2.919 1.00 0.34 C ATOM 258 CG LYS A 16 -5.517 -0.883 3.713 1.00 0.39 C ATOM 259 CD LYS A 16 -6.756 -1.392 4.435 1.00 1.31 C ATOM 260 CE LYS A 16 -7.239 -0.404 5.486 1.00 1.54 C ATOM 261 NZ LYS A 16 -8.362 -0.949 6.293 1.00 2.08 N ATOM 262 H LYS A 16 -5.020 -0.697 0.709 1.00 0.18 H ATOM 263 HA LYS A 16 -7.583 -0.367 2.004 1.00 0.35 H ATOM 264 HB2 LYS A 16 -4.856 0.795 2.590 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.281 1.094 3.573 1.00 0.43 H ATOM 266 HG2 LYS A 16 -5.174 -1.647 3.033 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.745 -0.677 4.441 1.00 0.78 H ATOM 268 HD2 LYS A 16 -7.544 -1.548 3.714 1.00 2.01 H ATOM 269 HD3 LYS A 16 -6.520 -2.329 4.917 1.00 1.98 H ATOM 270 HE2 LYS A 16 -6.417 -0.168 6.143 1.00 2.03 H ATOM 271 HE3 LYS A 16 -7.570 0.495 4.988 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -8.060 -1.752 6.806 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -9.120 -1.212 5.700 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -8.688 -0.256 6.939 1.00 2.48 H ATOM 275 N MET A 17 -6.332 1.946 0.096 1.00 0.37 N ATOM 276 CA MET A 17 -6.647 3.191 -0.596 1.00 0.49 C ATOM 277 C MET A 17 -7.613 2.935 -1.742 1.00 0.55 C ATOM 278 O MET A 17 -8.585 3.665 -1.931 1.00 0.66 O ATOM 279 CB MET A 17 -5.376 3.874 -1.114 1.00 0.60 C ATOM 280 CG MET A 17 -4.561 3.053 -2.103 1.00 0.69 C ATOM 281 SD MET A 17 -3.390 4.047 -3.043 1.00 1.70 S ATOM 282 CE MET A 17 -4.505 5.088 -3.980 1.00 2.33 C ATOM 283 H MET A 17 -5.528 1.440 -0.160 1.00 0.37 H ATOM 284 HA MET A 17 -7.128 3.845 0.116 1.00 0.54 H ATOM 285 HB2 MET A 17 -5.645 4.803 -1.588 1.00 1.19 H ATOM 286 HB3 MET A 17 -4.749 4.080 -0.273 1.00 1.22 H ATOM 287 HG2 MET A 17 -4.005 2.307 -1.551 1.00 1.19 H ATOM 288 HG3 MET A 17 -5.236 2.567 -2.791 1.00 1.28 H ATOM 289 HE1 MET A 17 -3.932 5.726 -4.636 1.00 2.74 H ATOM 290 HE2 MET A 17 -5.084 5.698 -3.303 1.00 2.78 H ATOM 291 HE3 MET A 17 -5.168 4.470 -4.566 1.00 2.74 H ATOM 292 N ALA A 18 -7.330 1.895 -2.504 1.00 0.57 N ATOM 293 CA ALA A 18 -8.181 1.506 -3.623 1.00 0.70 C ATOM 294 C ALA A 18 -9.495 0.916 -3.128 1.00 0.79 C ATOM 295 O ALA A 18 -10.570 1.311 -3.581 1.00 1.34 O ATOM 296 CB ALA A 18 -7.460 0.510 -4.521 1.00 0.81 C ATOM 297 H ALA A 18 -6.510 1.384 -2.316 1.00 0.58 H ATOM 298 HA ALA A 18 -8.393 2.391 -4.205 1.00 0.78 H ATOM 299 HB1 ALA A 18 -8.071 0.298 -5.386 1.00 1.33 H ATOM 300 HB2 ALA A 18 -7.281 -0.405 -3.973 1.00 1.31 H ATOM 301 HB3 ALA A 18 -6.519 0.930 -4.838 1.00 1.33 H ATOM 302 N LEU A 19 -9.386 -0.014 -2.180 1.00 0.75 N ATOM 303 CA LEU A 19 -10.538 -0.721 -1.625 1.00 0.82 C ATOM 304 C LEU A 19 -11.319 -1.436 -2.724 1.00 1.31 C ATOM 305 O LEU A 19 -10.802 -2.443 -3.256 1.00 1.89 O ATOM 306 CB LEU A 19 -11.451 0.237 -0.851 1.00 1.07 C ATOM 307 CG LEU A 19 -10.843 0.836 0.419 1.00 1.32 C ATOM 308 CD1 LEU A 19 -11.784 1.861 1.028 1.00 2.07 C ATOM 309 CD2 LEU A 19 -10.532 -0.257 1.432 1.00 1.78 C ATOM 310 OXT LEU A 19 -12.445 -1.003 -3.041 1.00 1.90 O ATOM 311 H LEU A 19 -8.496 -0.235 -1.839 1.00 1.05 H ATOM 312 HA LEU A 19 -10.159 -1.465 -0.941 1.00 0.82 H ATOM 313 HB2 LEU A 19 -11.727 1.048 -1.511 1.00 1.70 H ATOM 314 HB3 LEU A 19 -12.346 -0.299 -0.576 1.00 1.39 H ATOM 315 HG LEU A 19 -9.919 1.337 0.170 1.00 1.78 H ATOM 316 HD11 LEU A 19 -12.715 1.384 1.291 1.00 2.52 H ATOM 317 HD12 LEU A 19 -11.971 2.648 0.313 1.00 2.57 H ATOM 318 HD13 LEU A 19 -11.332 2.282 1.914 1.00 2.47 H ATOM 319 HD21 LEU A 19 -10.153 0.190 2.339 1.00 2.23 H ATOM 320 HD22 LEU A 19 -9.790 -0.926 1.024 1.00 2.18 H ATOM 321 HD23 LEU A 19 -11.433 -0.809 1.653 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 11 ATOM 1 N GLY A 1 8.375 6.524 2.300 1.00 1.26 N ATOM 2 CA GLY A 1 7.022 6.890 2.777 1.00 0.47 C ATOM 3 C GLY A 1 6.088 5.704 2.760 1.00 0.35 C ATOM 4 O GLY A 1 6.531 4.560 2.638 1.00 0.42 O ATOM 5 H1 GLY A 1 8.983 7.317 2.342 1.00 1.79 H ATOM 6 H2 GLY A 1 8.331 6.203 1.355 1.00 1.72 H ATOM 7 H3 GLY A 1 8.751 5.794 2.868 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.094 7.266 3.787 1.00 0.89 H ATOM 9 HA3 GLY A 1 6.621 7.665 2.139 1.00 0.90 H ATOM 10 N ILE A 2 4.794 5.957 2.870 1.00 0.27 N ATOM 11 CA ILE A 2 3.825 4.876 2.863 1.00 0.21 C ATOM 12 C ILE A 2 3.556 4.422 1.431 1.00 0.14 C ATOM 13 O ILE A 2 3.138 3.294 1.198 1.00 0.22 O ATOM 14 CB ILE A 2 2.492 5.268 3.552 1.00 0.27 C ATOM 15 CG1 ILE A 2 1.812 4.018 4.115 1.00 0.31 C ATOM 16 CG2 ILE A 2 1.557 6.001 2.596 1.00 0.33 C ATOM 17 CD1 ILE A 2 2.315 3.637 5.489 1.00 0.77 C ATOM 18 H ILE A 2 4.485 6.888 2.957 1.00 0.31 H ATOM 19 HA ILE A 2 4.256 4.049 3.411 1.00 0.27 H ATOM 20 HB ILE A 2 2.722 5.936 4.367 1.00 0.34 H ATOM 21 HG12 ILE A 2 0.745 4.177 4.176 1.00 0.63 H ATOM 22 HG13 ILE A 2 2.006 3.187 3.452 1.00 0.74 H ATOM 23 HG21 ILE A 2 0.639 6.246 3.108 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.339 5.366 1.749 1.00 1.10 H ATOM 25 HG23 ILE A 2 2.032 6.907 2.252 1.00 1.08 H ATOM 26 HD11 ILE A 2 1.773 2.774 5.845 1.00 1.38 H ATOM 27 HD12 ILE A 2 2.166 4.463 6.169 1.00 1.38 H ATOM 28 HD13 ILE A 2 3.367 3.403 5.433 1.00 1.42 H ATOM 29 N VAL A 3 3.823 5.304 0.473 1.00 0.14 N ATOM 30 CA VAL A 3 3.563 5.009 -0.930 1.00 0.20 C ATOM 31 C VAL A 3 4.567 3.988 -1.475 1.00 0.16 C ATOM 32 O VAL A 3 4.226 3.159 -2.311 1.00 0.19 O ATOM 33 CB VAL A 3 3.588 6.290 -1.796 1.00 0.33 C ATOM 34 CG1 VAL A 3 4.975 6.913 -1.816 1.00 0.92 C ATOM 35 CG2 VAL A 3 3.104 5.996 -3.209 1.00 0.94 C ATOM 36 H VAL A 3 4.193 6.180 0.718 1.00 0.20 H ATOM 37 HA VAL A 3 2.572 4.584 -0.990 1.00 0.25 H ATOM 38 HB VAL A 3 2.910 7.005 -1.353 1.00 0.65 H ATOM 39 HG11 VAL A 3 4.964 7.800 -2.430 1.00 1.51 H ATOM 40 HG12 VAL A 3 5.681 6.202 -2.221 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.267 7.174 -0.811 1.00 1.49 H ATOM 42 HG21 VAL A 3 3.736 5.243 -3.658 1.00 1.54 H ATOM 43 HG22 VAL A 3 3.146 6.898 -3.800 1.00 1.49 H ATOM 44 HG23 VAL A 3 2.086 5.636 -3.173 1.00 1.53 H ATOM 45 N THR A 4 5.799 4.039 -0.988 1.00 0.17 N ATOM 46 CA THR A 4 6.817 3.097 -1.420 1.00 0.21 C ATOM 47 C THR A 4 6.544 1.715 -0.836 1.00 0.18 C ATOM 48 O THR A 4 6.755 0.683 -1.493 1.00 0.21 O ATOM 49 CB THR A 4 8.224 3.577 -1.020 1.00 0.32 C ATOM 50 OG1 THR A 4 8.209 4.066 0.329 1.00 0.63 O ATOM 51 CG2 THR A 4 8.707 4.672 -1.957 1.00 0.66 C ATOM 52 H THR A 4 6.029 4.724 -0.327 1.00 0.21 H ATOM 53 HA THR A 4 6.768 3.031 -2.499 1.00 0.24 H ATOM 54 HB THR A 4 8.905 2.741 -1.085 1.00 0.54 H ATOM 55 HG1 THR A 4 8.938 3.666 0.822 1.00 1.24 H ATOM 56 HG21 THR A 4 9.693 4.993 -1.655 1.00 1.24 H ATOM 57 HG22 THR A 4 8.028 5.510 -1.912 1.00 1.30 H ATOM 58 HG23 THR A 4 8.746 4.292 -2.966 1.00 1.28 H ATOM 59 N LYS A 5 6.067 1.691 0.401 1.00 0.18 N ATOM 60 CA LYS A 5 5.639 0.458 0.997 1.00 0.27 C ATOM 61 C LYS A 5 4.414 -0.054 0.247 1.00 0.21 C ATOM 62 O LYS A 5 4.342 -1.230 -0.095 1.00 0.22 O ATOM 63 CB LYS A 5 5.378 0.654 2.498 1.00 0.46 C ATOM 64 CG LYS A 5 3.920 0.830 2.906 1.00 0.94 C ATOM 65 CD LYS A 5 3.710 0.409 4.353 1.00 0.90 C ATOM 66 CE LYS A 5 2.238 0.233 4.690 1.00 0.81 C ATOM 67 NZ LYS A 5 2.046 -0.182 6.104 1.00 1.23 N ATOM 68 H LYS A 5 6.023 2.514 0.925 1.00 0.19 H ATOM 69 HA LYS A 5 6.437 -0.256 0.871 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.772 -0.190 3.022 1.00 1.25 H ATOM 71 HB3 LYS A 5 5.918 1.534 2.819 1.00 1.15 H ATOM 72 HG2 LYS A 5 3.654 1.872 2.804 1.00 1.72 H ATOM 73 HG3 LYS A 5 3.291 0.234 2.264 1.00 1.75 H ATOM 74 HD2 LYS A 5 4.219 -0.528 4.521 1.00 1.31 H ATOM 75 HD3 LYS A 5 4.129 1.167 4.999 1.00 1.33 H ATOM 76 HE2 LYS A 5 1.728 1.170 4.525 1.00 1.09 H ATOM 77 HE3 LYS A 5 1.820 -0.523 4.041 1.00 0.97 H ATOM 78 HZ1 LYS A 5 1.073 -0.315 6.293 1.00 1.66 H ATOM 79 HZ2 LYS A 5 2.398 0.518 6.721 1.00 1.71 H ATOM 80 HZ3 LYS A 5 2.531 -1.039 6.280 1.00 1.67 H ATOM 81 N LEU A 6 3.503 0.868 -0.071 1.00 0.21 N ATOM 82 CA LEU A 6 2.301 0.584 -0.860 1.00 0.25 C ATOM 83 C LEU A 6 2.635 -0.175 -2.143 1.00 0.21 C ATOM 84 O LEU A 6 1.784 -0.858 -2.714 1.00 0.26 O ATOM 85 CB LEU A 6 1.593 1.912 -1.174 1.00 0.36 C ATOM 86 CG LEU A 6 0.644 1.929 -2.376 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.497 2.894 -2.122 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.390 2.339 -3.636 1.00 1.21 C ATOM 89 H LEU A 6 3.640 1.788 0.247 1.00 0.22 H ATOM 90 HA LEU A 6 1.644 -0.025 -0.260 1.00 0.32 H ATOM 91 HB2 LEU A 6 1.030 2.202 -0.303 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.356 2.657 -1.344 1.00 0.85 H ATOM 93 HG LEU A 6 0.232 0.942 -2.526 1.00 1.34 H ATOM 94 HD11 LEU A 6 -0.099 3.879 -1.925 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.066 2.558 -1.269 1.00 1.71 H ATOM 96 HD13 LEU A 6 -1.137 2.931 -2.991 1.00 1.70 H ATOM 97 HD21 LEU A 6 0.705 2.360 -4.469 1.00 1.76 H ATOM 98 HD22 LEU A 6 2.180 1.629 -3.834 1.00 1.73 H ATOM 99 HD23 LEU A 6 1.819 3.320 -3.495 1.00 1.81 H ATOM 100 N ILE A 7 3.873 -0.056 -2.585 1.00 0.16 N ATOM 101 CA ILE A 7 4.311 -0.729 -3.786 1.00 0.18 C ATOM 102 C ILE A 7 4.434 -2.237 -3.568 1.00 0.16 C ATOM 103 O ILE A 7 3.626 -3.005 -4.089 1.00 0.19 O ATOM 104 CB ILE A 7 5.660 -0.168 -4.286 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.567 1.350 -4.458 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.067 -0.830 -5.595 1.00 0.27 C ATOM 107 CD1 ILE A 7 6.861 1.998 -4.903 1.00 1.07 C ATOM 108 H ILE A 7 4.507 0.501 -2.089 1.00 0.16 H ATOM 109 HA ILE A 7 3.570 -0.550 -4.551 1.00 0.23 H ATOM 110 HB ILE A 7 6.414 -0.391 -3.547 1.00 0.20 H ATOM 111 HG12 ILE A 7 4.813 1.578 -5.197 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.283 1.791 -3.513 1.00 0.79 H ATOM 113 HG21 ILE A 7 7.007 -0.417 -5.927 1.00 1.06 H ATOM 114 HG22 ILE A 7 5.309 -0.647 -6.342 1.00 1.06 H ATOM 115 HG23 ILE A 7 6.173 -1.893 -5.441 1.00 1.06 H ATOM 116 HD11 ILE A 7 6.712 3.062 -5.009 1.00 1.67 H ATOM 117 HD12 ILE A 7 7.164 1.580 -5.852 1.00 1.67 H ATOM 118 HD13 ILE A 7 7.628 1.812 -4.167 1.00 1.64 H ATOM 119 N LYS A 8 5.431 -2.670 -2.795 1.00 0.13 N ATOM 120 CA LYS A 8 5.752 -4.101 -2.774 1.00 0.12 C ATOM 121 C LYS A 8 5.056 -4.883 -1.656 1.00 0.11 C ATOM 122 O LYS A 8 4.070 -5.575 -1.900 1.00 0.13 O ATOM 123 CB LYS A 8 7.263 -4.322 -2.653 1.00 0.17 C ATOM 124 CG LYS A 8 8.120 -3.170 -3.156 1.00 0.49 C ATOM 125 CD LYS A 8 8.470 -2.204 -2.033 1.00 0.78 C ATOM 126 CE LYS A 8 9.329 -1.057 -2.536 1.00 0.98 C ATOM 127 NZ LYS A 8 9.799 -0.187 -1.428 1.00 1.70 N ATOM 128 H LYS A 8 5.939 -2.028 -2.241 1.00 0.13 H ATOM 129 HA LYS A 8 5.425 -4.511 -3.716 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.501 -4.489 -1.613 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.526 -5.205 -3.214 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.033 -3.566 -3.574 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.574 -2.636 -3.920 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.557 -1.803 -1.613 1.00 1.28 H ATOM 135 HD3 LYS A 8 9.014 -2.741 -1.269 1.00 1.16 H ATOM 136 HE2 LYS A 8 10.187 -1.466 -3.048 1.00 1.43 H ATOM 137 HE3 LYS A 8 8.748 -0.465 -3.228 1.00 1.50 H ATOM 138 HZ1 LYS A 8 10.390 -0.708 -0.810 1.00 2.17 H ATOM 139 HZ2 LYS A 8 9.021 0.160 -0.908 1.00 2.16 H ATOM 140 HZ3 LYS A 8 10.315 0.587 -1.794 1.00 2.17 H ATOM 141 N LYS A 9 5.570 -4.770 -0.435 1.00 0.12 N ATOM 142 CA LYS A 9 5.077 -5.559 0.685 1.00 0.14 C ATOM 143 C LYS A 9 4.036 -4.779 1.469 1.00 0.13 C ATOM 144 O LYS A 9 3.011 -5.310 1.898 1.00 0.17 O ATOM 145 CB LYS A 9 6.238 -5.971 1.573 1.00 0.21 C ATOM 146 CG LYS A 9 5.801 -6.674 2.831 1.00 0.84 C ATOM 147 CD LYS A 9 6.946 -7.452 3.442 1.00 1.34 C ATOM 148 CE LYS A 9 6.533 -8.147 4.730 1.00 2.00 C ATOM 149 NZ LYS A 9 7.656 -8.915 5.329 1.00 2.66 N ATOM 150 H LYS A 9 6.295 -4.133 -0.274 1.00 0.13 H ATOM 151 HA LYS A 9 4.620 -6.450 0.286 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.885 -6.635 1.020 1.00 0.63 H ATOM 153 HB3 LYS A 9 6.794 -5.090 1.852 1.00 0.64 H ATOM 154 HG2 LYS A 9 5.458 -5.933 3.533 1.00 1.45 H ATOM 155 HG3 LYS A 9 4.998 -7.353 2.592 1.00 1.47 H ATOM 156 HD2 LYS A 9 7.270 -8.194 2.729 1.00 1.78 H ATOM 157 HD3 LYS A 9 7.755 -6.770 3.650 1.00 1.82 H ATOM 158 HE2 LYS A 9 6.203 -7.400 5.436 1.00 2.46 H ATOM 159 HE3 LYS A 9 5.720 -8.822 4.514 1.00 2.44 H ATOM 160 HZ1 LYS A 9 7.949 -9.639 4.706 1.00 3.04 H ATOM 161 HZ2 LYS A 9 7.367 -9.330 6.190 1.00 3.03 H ATOM 162 HZ3 LYS A 9 8.429 -8.307 5.510 1.00 3.05 H ATOM 163 N GLY A 10 4.334 -3.501 1.628 1.00 0.14 N ATOM 164 CA GLY A 10 3.439 -2.544 2.244 1.00 0.17 C ATOM 165 C GLY A 10 2.116 -2.441 1.515 1.00 0.16 C ATOM 166 O GLY A 10 1.187 -1.799 2.005 1.00 0.20 O ATOM 167 H GLY A 10 5.201 -3.181 1.293 1.00 0.15 H ATOM 168 HA2 GLY A 10 3.257 -2.837 3.267 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.919 -1.579 2.234 1.00 0.21 H ATOM 170 N VAL A 11 2.114 -2.986 0.292 1.00 0.14 N ATOM 171 CA VAL A 11 1.015 -2.933 -0.682 1.00 0.16 C ATOM 172 C VAL A 11 -0.392 -3.013 -0.066 1.00 0.16 C ATOM 173 O VAL A 11 -1.367 -2.633 -0.707 1.00 0.18 O ATOM 174 CB VAL A 11 1.187 -4.076 -1.709 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.030 -5.433 -1.039 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.214 -3.926 -2.864 1.00 0.23 C ATOM 177 H VAL A 11 2.921 -3.467 0.023 1.00 0.14 H ATOM 178 HA VAL A 11 1.102 -2.002 -1.216 1.00 0.19 H ATOM 179 HB VAL A 11 2.192 -4.018 -2.108 1.00 0.19 H ATOM 180 HG11 VAL A 11 1.807 -5.558 -0.298 1.00 1.03 H ATOM 181 HG12 VAL A 11 1.112 -6.213 -1.781 1.00 1.04 H ATOM 182 HG13 VAL A 11 0.063 -5.488 -0.559 1.00 1.04 H ATOM 183 HG21 VAL A 11 0.354 -4.739 -3.559 1.00 1.06 H ATOM 184 HG22 VAL A 11 0.395 -2.986 -3.364 1.00 1.04 H ATOM 185 HG23 VAL A 11 -0.797 -3.943 -2.484 1.00 1.04 H ATOM 186 N LYS A 12 -0.498 -3.515 1.155 1.00 0.16 N ATOM 187 CA LYS A 12 -1.729 -3.417 1.932 1.00 0.19 C ATOM 188 C LYS A 12 -2.333 -2.010 1.820 1.00 0.15 C ATOM 189 O LYS A 12 -3.539 -1.862 1.626 1.00 0.14 O ATOM 190 CB LYS A 12 -1.437 -3.735 3.400 1.00 0.27 C ATOM 191 CG LYS A 12 -2.631 -3.542 4.324 1.00 0.46 C ATOM 192 CD LYS A 12 -3.755 -4.518 4.010 1.00 0.97 C ATOM 193 CE LYS A 12 -4.883 -4.393 5.020 1.00 1.65 C ATOM 194 NZ LYS A 12 -5.968 -5.380 4.778 1.00 2.26 N ATOM 195 H LYS A 12 0.276 -3.968 1.546 1.00 0.16 H ATOM 196 HA LYS A 12 -2.432 -4.138 1.545 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.113 -4.761 3.473 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.638 -3.091 3.740 1.00 0.33 H ATOM 199 HG2 LYS A 12 -2.311 -3.695 5.344 1.00 0.85 H ATOM 200 HG3 LYS A 12 -3.001 -2.532 4.207 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.140 -4.302 3.024 1.00 1.47 H ATOM 202 HD3 LYS A 12 -3.364 -5.524 4.036 1.00 1.42 H ATOM 203 HE2 LYS A 12 -4.482 -4.553 6.007 1.00 2.23 H ATOM 204 HE3 LYS A 12 -5.295 -3.396 4.957 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -6.346 -5.261 3.859 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -6.701 -5.254 5.443 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -5.612 -6.312 4.864 1.00 2.67 H ATOM 208 N LEU A 13 -1.481 -0.986 1.925 1.00 0.15 N ATOM 209 CA LEU A 13 -1.900 0.402 1.780 1.00 0.15 C ATOM 210 C LEU A 13 -2.528 0.614 0.400 1.00 0.13 C ATOM 211 O LEU A 13 -3.538 1.302 0.261 1.00 0.15 O ATOM 212 CB LEU A 13 -0.674 1.311 1.965 1.00 0.20 C ATOM 213 CG LEU A 13 -0.933 2.772 2.376 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.663 3.552 1.295 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.708 2.823 3.681 1.00 0.38 C ATOM 216 H LEU A 13 -0.530 -1.172 2.107 1.00 0.19 H ATOM 217 HA LEU A 13 -2.635 0.619 2.545 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.043 0.864 2.719 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.128 1.317 1.035 1.00 0.21 H ATOM 220 HG LEU A 13 0.019 3.259 2.538 1.00 0.30 H ATOM 221 HD11 LEU A 13 -2.585 3.046 1.048 1.00 1.08 H ATOM 222 HD12 LEU A 13 -1.041 3.619 0.416 1.00 1.08 H ATOM 223 HD13 LEU A 13 -1.885 4.545 1.656 1.00 1.09 H ATOM 224 HD21 LEU A 13 -1.196 2.234 4.426 1.00 1.09 H ATOM 225 HD22 LEU A 13 -2.699 2.427 3.526 1.00 1.09 H ATOM 226 HD23 LEU A 13 -1.777 3.846 4.017 1.00 1.10 H ATOM 227 N GLY A 14 -1.929 -0.005 -0.610 1.00 0.18 N ATOM 228 CA GLY A 14 -2.450 0.078 -1.960 1.00 0.23 C ATOM 229 C GLY A 14 -3.848 -0.486 -2.057 1.00 0.22 C ATOM 230 O GLY A 14 -4.703 0.072 -2.741 1.00 0.29 O ATOM 231 H GLY A 14 -1.127 -0.541 -0.434 1.00 0.22 H ATOM 232 HA2 GLY A 14 -2.465 1.112 -2.269 1.00 0.26 H ATOM 233 HA3 GLY A 14 -1.801 -0.478 -2.622 1.00 0.29 H ATOM 234 N LEU A 15 -4.092 -1.585 -1.354 1.00 0.22 N ATOM 235 CA LEU A 15 -5.419 -2.181 -1.309 1.00 0.29 C ATOM 236 C LEU A 15 -6.377 -1.304 -0.512 1.00 0.28 C ATOM 237 O LEU A 15 -7.579 -1.298 -0.767 1.00 0.39 O ATOM 238 CB LEU A 15 -5.383 -3.593 -0.713 1.00 0.35 C ATOM 239 CG LEU A 15 -4.909 -4.712 -1.655 1.00 0.41 C ATOM 240 CD1 LEU A 15 -5.728 -4.721 -2.937 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.427 -4.583 -1.969 1.00 0.39 C ATOM 242 H LEU A 15 -3.357 -2.008 -0.857 1.00 0.22 H ATOM 243 HA LEU A 15 -5.781 -2.241 -2.324 1.00 0.36 H ATOM 244 HB2 LEU A 15 -4.728 -3.576 0.147 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.379 -3.837 -0.377 1.00 0.41 H ATOM 246 HG LEU A 15 -5.059 -5.662 -1.164 1.00 0.51 H ATOM 247 HD11 LEU A 15 -6.778 -4.786 -2.694 1.00 1.13 H ATOM 248 HD12 LEU A 15 -5.446 -5.574 -3.535 1.00 1.16 H ATOM 249 HD13 LEU A 15 -5.541 -3.815 -3.493 1.00 1.18 H ATOM 250 HD21 LEU A 15 -2.858 -4.637 -1.053 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.243 -3.635 -2.454 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.128 -5.386 -2.626 1.00 1.10 H ATOM 253 N LYS A 16 -5.841 -0.567 0.455 1.00 0.21 N ATOM 254 CA LYS A 16 -6.640 0.382 1.222 1.00 0.28 C ATOM 255 C LYS A 16 -7.092 1.529 0.323 1.00 0.34 C ATOM 256 O LYS A 16 -8.159 2.112 0.524 1.00 0.46 O ATOM 257 CB LYS A 16 -5.845 0.935 2.413 1.00 0.34 C ATOM 258 CG LYS A 16 -5.335 -0.132 3.374 1.00 0.39 C ATOM 259 CD LYS A 16 -4.820 0.473 4.672 1.00 1.31 C ATOM 260 CE LYS A 16 -5.935 1.138 5.466 1.00 1.54 C ATOM 261 NZ LYS A 16 -5.457 1.662 6.772 1.00 2.08 N ATOM 262 H LYS A 16 -4.887 -0.668 0.664 1.00 0.18 H ATOM 263 HA LYS A 16 -7.511 -0.139 1.588 1.00 0.35 H ATOM 264 HB2 LYS A 16 -4.993 1.481 2.035 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.477 1.613 2.965 1.00 0.43 H ATOM 266 HG2 LYS A 16 -6.137 -0.810 3.600 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.530 -0.677 2.900 1.00 0.78 H ATOM 268 HD2 LYS A 16 -4.383 -0.310 5.274 1.00 2.01 H ATOM 269 HD3 LYS A 16 -4.067 1.212 4.439 1.00 1.98 H ATOM 270 HE2 LYS A 16 -6.334 1.957 4.886 1.00 2.03 H ATOM 271 HE3 LYS A 16 -6.716 0.411 5.643 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -4.768 2.371 6.626 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -5.053 0.927 7.312 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -6.223 2.055 7.284 1.00 2.48 H ATOM 275 N MET A 17 -6.266 1.839 -0.669 1.00 0.37 N ATOM 276 CA MET A 17 -6.577 2.873 -1.648 1.00 0.49 C ATOM 277 C MET A 17 -7.508 2.328 -2.725 1.00 0.55 C ATOM 278 O MET A 17 -8.524 2.941 -3.057 1.00 0.66 O ATOM 279 CB MET A 17 -5.288 3.392 -2.296 1.00 0.60 C ATOM 280 CG MET A 17 -4.364 4.118 -1.332 1.00 0.69 C ATOM 281 SD MET A 17 -5.018 5.715 -0.806 1.00 1.70 S ATOM 282 CE MET A 17 -5.010 6.615 -2.354 1.00 2.33 C ATOM 283 H MET A 17 -5.414 1.358 -0.742 1.00 0.37 H ATOM 284 HA MET A 17 -7.067 3.686 -1.136 1.00 0.54 H ATOM 285 HB2 MET A 17 -4.749 2.555 -2.714 1.00 1.19 H ATOM 286 HB3 MET A 17 -5.551 4.073 -3.093 1.00 1.22 H ATOM 287 HG2 MET A 17 -4.222 3.499 -0.459 1.00 1.19 H ATOM 288 HG3 MET A 17 -3.411 4.276 -1.818 1.00 1.28 H ATOM 289 HE1 MET A 17 -4.005 6.641 -2.752 1.00 2.74 H ATOM 290 HE2 MET A 17 -5.354 7.625 -2.185 1.00 2.78 H ATOM 291 HE3 MET A 17 -5.664 6.127 -3.060 1.00 2.74 H ATOM 292 N ALA A 18 -7.149 1.167 -3.258 1.00 0.57 N ATOM 293 CA ALA A 18 -7.893 0.539 -4.343 1.00 0.70 C ATOM 294 C ALA A 18 -9.288 0.111 -3.900 1.00 0.79 C ATOM 295 O ALA A 18 -10.268 0.362 -4.603 1.00 1.34 O ATOM 296 CB ALA A 18 -7.123 -0.659 -4.872 1.00 0.81 C ATOM 297 H ALA A 18 -6.343 0.717 -2.913 1.00 0.58 H ATOM 298 HA ALA A 18 -7.985 1.258 -5.143 1.00 0.78 H ATOM 299 HB1 ALA A 18 -6.980 -1.375 -4.077 1.00 1.33 H ATOM 300 HB2 ALA A 18 -6.162 -0.335 -5.243 1.00 1.31 H ATOM 301 HB3 ALA A 18 -7.682 -1.120 -5.671 1.00 1.33 H ATOM 302 N LEU A 19 -9.360 -0.532 -2.736 1.00 0.75 N ATOM 303 CA LEU A 19 -10.616 -1.052 -2.196 1.00 0.82 C ATOM 304 C LEU A 19 -11.234 -2.073 -3.144 1.00 1.31 C ATOM 305 O LEU A 19 -12.174 -1.719 -3.885 1.00 1.89 O ATOM 306 CB LEU A 19 -11.612 0.081 -1.923 1.00 1.07 C ATOM 307 CG LEU A 19 -11.204 1.068 -0.832 1.00 1.32 C ATOM 308 CD1 LEU A 19 -12.212 2.201 -0.744 1.00 2.07 C ATOM 309 CD2 LEU A 19 -11.082 0.360 0.510 1.00 1.78 C ATOM 310 OXT LEU A 19 -10.774 -3.231 -3.151 1.00 1.90 O ATOM 311 H LEU A 19 -8.537 -0.664 -2.218 1.00 1.05 H ATOM 312 HA LEU A 19 -10.385 -1.548 -1.265 1.00 0.82 H ATOM 313 HB2 LEU A 19 -11.755 0.633 -2.841 1.00 1.70 H ATOM 314 HB3 LEU A 19 -12.555 -0.360 -1.641 1.00 1.39 H ATOM 315 HG LEU A 19 -10.240 1.493 -1.077 1.00 1.78 H ATOM 316 HD11 LEU A 19 -11.911 2.893 0.026 1.00 2.52 H ATOM 317 HD12 LEU A 19 -13.186 1.797 -0.505 1.00 2.57 H ATOM 318 HD13 LEU A 19 -12.259 2.715 -1.692 1.00 2.47 H ATOM 319 HD21 LEU A 19 -12.021 -0.115 0.752 1.00 2.23 H ATOM 320 HD22 LEU A 19 -10.836 1.081 1.275 1.00 2.18 H ATOM 321 HD23 LEU A 19 -10.304 -0.386 0.455 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 12 ATOM 1 N GLY A 1 8.724 6.884 2.366 1.00 1.26 N ATOM 2 CA GLY A 1 7.316 7.125 2.764 1.00 0.47 C ATOM 3 C GLY A 1 6.484 5.864 2.680 1.00 0.35 C ATOM 4 O GLY A 1 7.017 4.775 2.451 1.00 0.42 O ATOM 5 H1 GLY A 1 9.130 6.184 2.953 1.00 1.79 H ATOM 6 H2 GLY A 1 9.255 7.723 2.454 1.00 1.72 H ATOM 7 H3 GLY A 1 8.763 6.574 1.416 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.296 7.491 3.779 1.00 0.89 H ATOM 9 HA3 GLY A 1 6.890 7.872 2.112 1.00 0.90 H ATOM 10 N ILE A 2 5.178 6.000 2.852 1.00 0.27 N ATOM 11 CA ILE A 2 4.293 4.850 2.847 1.00 0.21 C ATOM 12 C ILE A 2 3.934 4.441 1.427 1.00 0.14 C ATOM 13 O ILE A 2 3.532 3.311 1.188 1.00 0.22 O ATOM 14 CB ILE A 2 3.002 5.108 3.653 1.00 0.27 C ATOM 15 CG1 ILE A 2 2.198 3.818 3.786 1.00 0.31 C ATOM 16 CG2 ILE A 2 2.150 6.182 2.988 1.00 0.33 C ATOM 17 CD1 ILE A 2 1.592 3.612 5.154 1.00 0.77 C ATOM 18 H ILE A 2 4.801 6.898 2.988 1.00 0.31 H ATOM 19 HA ILE A 2 4.822 4.032 3.316 1.00 0.27 H ATOM 20 HB ILE A 2 3.280 5.455 4.630 1.00 0.34 H ATOM 21 HG12 ILE A 2 1.392 3.838 3.072 1.00 0.63 H ATOM 22 HG13 ILE A 2 2.839 2.978 3.569 1.00 0.74 H ATOM 23 HG21 ILE A 2 1.836 5.836 2.012 1.00 1.04 H ATOM 24 HG22 ILE A 2 2.726 7.089 2.882 1.00 1.10 H ATOM 25 HG23 ILE A 2 1.278 6.377 3.595 1.00 1.08 H ATOM 26 HD11 ILE A 2 0.906 4.416 5.372 1.00 1.38 H ATOM 27 HD12 ILE A 2 2.378 3.596 5.895 1.00 1.38 H ATOM 28 HD13 ILE A 2 1.064 2.671 5.174 1.00 1.42 H ATOM 29 N VAL A 3 4.092 5.355 0.486 1.00 0.14 N ATOM 30 CA VAL A 3 3.752 5.059 -0.900 1.00 0.20 C ATOM 31 C VAL A 3 4.729 4.044 -1.508 1.00 0.16 C ATOM 32 O VAL A 3 4.338 3.204 -2.315 1.00 0.19 O ATOM 33 CB VAL A 3 3.691 6.335 -1.774 1.00 0.33 C ATOM 34 CG1 VAL A 3 5.031 7.050 -1.805 1.00 0.92 C ATOM 35 CG2 VAL A 3 3.230 6.000 -3.184 1.00 0.94 C ATOM 36 H VAL A 3 4.424 6.245 0.730 1.00 0.20 H ATOM 37 HA VAL A 3 2.763 4.616 -0.890 1.00 0.25 H ATOM 38 HB VAL A 3 2.966 7.006 -1.338 1.00 0.65 H ATOM 39 HG11 VAL A 3 5.310 7.335 -0.803 1.00 1.51 H ATOM 40 HG12 VAL A 3 4.954 7.932 -2.423 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.781 6.389 -2.214 1.00 1.49 H ATOM 42 HG21 VAL A 3 3.257 6.889 -3.795 1.00 1.54 H ATOM 43 HG22 VAL A 3 2.221 5.616 -3.150 1.00 1.49 H ATOM 44 HG23 VAL A 3 3.885 5.250 -3.608 1.00 1.53 H ATOM 45 N THR A 4 5.995 4.110 -1.111 1.00 0.17 N ATOM 46 CA THR A 4 6.980 3.132 -1.559 1.00 0.21 C ATOM 47 C THR A 4 6.760 1.802 -0.845 1.00 0.18 C ATOM 48 O THR A 4 7.013 0.716 -1.391 1.00 0.21 O ATOM 49 CB THR A 4 8.413 3.639 -1.314 1.00 0.32 C ATOM 50 OG1 THR A 4 8.488 4.269 -0.029 1.00 0.63 O ATOM 51 CG2 THR A 4 8.831 4.624 -2.395 1.00 0.66 C ATOM 52 H THR A 4 6.276 4.829 -0.508 1.00 0.21 H ATOM 53 HA THR A 4 6.844 2.986 -2.622 1.00 0.24 H ATOM 54 HB THR A 4 9.087 2.795 -1.335 1.00 0.54 H ATOM 55 HG1 THR A 4 9.387 4.590 0.114 1.00 1.24 H ATOM 56 HG21 THR A 4 9.836 4.971 -2.198 1.00 1.24 H ATOM 57 HG22 THR A 4 8.155 5.465 -2.398 1.00 1.30 H ATOM 58 HG23 THR A 4 8.802 4.136 -3.359 1.00 1.28 H ATOM 59 N LYS A 5 6.271 1.900 0.383 1.00 0.18 N ATOM 60 CA LYS A 5 5.831 0.748 1.125 1.00 0.27 C ATOM 61 C LYS A 5 4.654 0.115 0.380 1.00 0.21 C ATOM 62 O LYS A 5 4.676 -1.073 0.071 1.00 0.22 O ATOM 63 CB LYS A 5 5.469 1.195 2.554 1.00 0.46 C ATOM 64 CG LYS A 5 4.408 0.361 3.231 1.00 0.94 C ATOM 65 CD LYS A 5 4.133 0.829 4.650 1.00 0.90 C ATOM 66 CE LYS A 5 2.879 0.177 5.223 1.00 0.81 C ATOM 67 NZ LYS A 5 2.733 0.448 6.678 1.00 1.23 N ATOM 68 H LYS A 5 6.189 2.781 0.799 1.00 0.19 H ATOM 69 HA LYS A 5 6.647 0.041 1.164 1.00 0.37 H ATOM 70 HB2 LYS A 5 6.360 1.157 3.162 1.00 1.25 H ATOM 71 HB3 LYS A 5 5.121 2.216 2.515 1.00 1.15 H ATOM 72 HG2 LYS A 5 3.502 0.437 2.655 1.00 1.72 H ATOM 73 HG3 LYS A 5 4.741 -0.660 3.264 1.00 1.75 H ATOM 74 HD2 LYS A 5 4.975 0.569 5.271 1.00 1.31 H ATOM 75 HD3 LYS A 5 4.004 1.900 4.650 1.00 1.33 H ATOM 76 HE2 LYS A 5 2.013 0.570 4.706 1.00 1.09 H ATOM 77 HE3 LYS A 5 2.934 -0.891 5.067 1.00 0.97 H ATOM 78 HZ1 LYS A 5 3.484 0.021 7.183 1.00 1.66 H ATOM 79 HZ2 LYS A 5 1.868 0.076 7.015 1.00 1.71 H ATOM 80 HZ3 LYS A 5 2.748 1.433 6.849 1.00 1.67 H ATOM 81 N LEU A 6 3.679 0.953 0.021 1.00 0.21 N ATOM 82 CA LEU A 6 2.497 0.557 -0.757 1.00 0.25 C ATOM 83 C LEU A 6 2.867 -0.202 -2.033 1.00 0.21 C ATOM 84 O LEU A 6 2.040 -0.922 -2.598 1.00 0.26 O ATOM 85 CB LEU A 6 1.676 1.816 -1.096 1.00 0.36 C ATOM 86 CG LEU A 6 0.731 1.713 -2.297 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.540 2.492 -2.023 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.405 2.245 -3.553 1.00 1.21 C ATOM 89 H LEU A 6 3.753 1.892 0.300 1.00 0.22 H ATOM 90 HA LEU A 6 1.893 -0.086 -0.137 1.00 0.32 H ATOM 91 HB2 LEU A 6 1.082 2.074 -0.234 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.368 2.622 -1.285 1.00 0.85 H ATOM 93 HG LEU A 6 0.469 0.678 -2.461 1.00 1.34 H ATOM 94 HD11 LEU A 6 -1.038 2.068 -1.164 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.190 2.434 -2.883 1.00 1.71 H ATOM 96 HD13 LEU A 6 -0.294 3.524 -1.824 1.00 1.70 H ATOM 97 HD21 LEU A 6 2.300 1.674 -3.752 1.00 1.76 H ATOM 98 HD22 LEU A 6 1.666 3.283 -3.408 1.00 1.73 H ATOM 99 HD23 LEU A 6 0.727 2.158 -4.389 1.00 1.81 H ATOM 100 N ILE A 7 4.095 -0.040 -2.492 1.00 0.16 N ATOM 101 CA ILE A 7 4.537 -0.713 -3.696 1.00 0.18 C ATOM 102 C ILE A 7 4.664 -2.222 -3.477 1.00 0.16 C ATOM 103 O ILE A 7 3.881 -2.995 -4.032 1.00 0.19 O ATOM 104 CB ILE A 7 5.876 -0.147 -4.215 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.761 1.360 -4.464 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.302 -0.864 -5.489 1.00 0.27 C ATOM 107 CD1 ILE A 7 7.045 1.993 -4.961 1.00 1.07 C ATOM 108 H ILE A 7 4.715 0.545 -2.009 1.00 0.16 H ATOM 109 HA ILE A 7 3.788 -0.541 -4.455 1.00 0.23 H ATOM 110 HB ILE A 7 6.629 -0.322 -3.464 1.00 0.20 H ATOM 111 HG12 ILE A 7 4.994 1.544 -5.201 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.487 1.849 -3.541 1.00 0.79 H ATOM 113 HG21 ILE A 7 5.543 -0.732 -6.246 1.00 1.06 H ATOM 114 HG22 ILE A 7 6.428 -1.916 -5.283 1.00 1.06 H ATOM 115 HG23 ILE A 7 7.236 -0.450 -5.838 1.00 1.06 H ATOM 116 HD11 ILE A 7 7.836 1.811 -4.249 1.00 1.67 H ATOM 117 HD12 ILE A 7 6.901 3.057 -5.074 1.00 1.67 H ATOM 118 HD13 ILE A 7 7.313 1.563 -5.915 1.00 1.64 H ATOM 119 N LYS A 8 5.634 -2.658 -2.671 1.00 0.13 N ATOM 120 CA LYS A 8 5.906 -4.099 -2.598 1.00 0.12 C ATOM 121 C LYS A 8 5.145 -4.803 -1.479 1.00 0.11 C ATOM 122 O LYS A 8 4.152 -5.483 -1.723 1.00 0.13 O ATOM 123 CB LYS A 8 7.398 -4.398 -2.408 1.00 0.17 C ATOM 124 CG LYS A 8 8.341 -3.622 -3.322 1.00 0.49 C ATOM 125 CD LYS A 8 8.658 -2.241 -2.773 1.00 0.78 C ATOM 126 CE LYS A 8 9.652 -1.498 -3.654 1.00 0.98 C ATOM 127 NZ LYS A 8 10.973 -2.180 -3.709 1.00 1.70 N ATOM 128 H LYS A 8 6.149 -2.014 -2.120 1.00 0.13 H ATOM 129 HA LYS A 8 5.587 -4.527 -3.534 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.658 -4.183 -1.382 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.556 -5.453 -2.584 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.262 -4.176 -3.424 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.876 -3.516 -4.292 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.747 -1.669 -2.716 1.00 1.28 H ATOM 135 HD3 LYS A 8 9.079 -2.347 -1.785 1.00 1.16 H ATOM 136 HE2 LYS A 8 9.249 -1.433 -4.654 1.00 1.43 H ATOM 137 HE3 LYS A 8 9.788 -0.502 -3.257 1.00 1.50 H ATOM 138 HZ1 LYS A 8 10.880 -3.081 -4.135 1.00 2.17 H ATOM 139 HZ2 LYS A 8 11.342 -2.298 -2.787 1.00 2.16 H ATOM 140 HZ3 LYS A 8 11.618 -1.636 -4.245 1.00 2.17 H ATOM 141 N LYS A 9 5.609 -4.625 -0.251 1.00 0.12 N ATOM 142 CA LYS A 9 5.080 -5.377 0.883 1.00 0.14 C ATOM 143 C LYS A 9 3.956 -4.607 1.541 1.00 0.13 C ATOM 144 O LYS A 9 2.959 -5.170 1.992 1.00 0.17 O ATOM 145 CB LYS A 9 6.186 -5.682 1.898 1.00 0.21 C ATOM 146 CG LYS A 9 7.287 -6.577 1.350 1.00 0.84 C ATOM 147 CD LYS A 9 6.748 -7.939 0.947 1.00 1.34 C ATOM 148 CE LYS A 9 7.842 -8.836 0.398 1.00 2.00 C ATOM 149 NZ LYS A 9 7.324 -10.179 0.031 1.00 2.66 N ATOM 150 H LYS A 9 6.312 -3.960 -0.100 1.00 0.13 H ATOM 151 HA LYS A 9 4.695 -6.302 0.496 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.632 -4.752 2.217 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.747 -6.171 2.755 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.725 -6.104 0.484 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.043 -6.709 2.111 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.310 -8.412 1.812 1.00 1.78 H ATOM 157 HD3 LYS A 9 5.992 -7.806 0.187 1.00 1.82 H ATOM 158 HE2 LYS A 9 8.265 -8.371 -0.479 1.00 2.46 H ATOM 159 HE3 LYS A 9 8.608 -8.948 1.151 1.00 2.44 H ATOM 160 HZ1 LYS A 9 8.060 -10.737 -0.355 1.00 3.04 H ATOM 161 HZ2 LYS A 9 6.594 -10.096 -0.646 1.00 3.03 H ATOM 162 HZ3 LYS A 9 6.958 -10.642 0.840 1.00 3.05 H ATOM 163 N GLY A 10 4.145 -3.305 1.561 1.00 0.14 N ATOM 164 CA GLY A 10 3.155 -2.362 2.029 1.00 0.17 C ATOM 165 C GLY A 10 1.884 -2.404 1.229 1.00 0.16 C ATOM 166 O GLY A 10 0.906 -1.790 1.623 1.00 0.20 O ATOM 167 H GLY A 10 5.000 -2.956 1.227 1.00 0.15 H ATOM 168 HA2 GLY A 10 2.926 -2.572 3.062 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.567 -1.371 1.957 1.00 0.21 H ATOM 170 N VAL A 11 1.968 -3.037 0.051 1.00 0.14 N ATOM 171 CA VAL A 11 0.907 -3.083 -0.964 1.00 0.16 C ATOM 172 C VAL A 11 -0.510 -3.162 -0.370 1.00 0.16 C ATOM 173 O VAL A 11 -1.473 -2.736 -1.003 1.00 0.18 O ATOM 174 CB VAL A 11 1.148 -4.278 -1.917 1.00 0.18 C ATOM 175 CG1 VAL A 11 0.959 -5.602 -1.194 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.254 -4.191 -3.139 1.00 0.23 C ATOM 177 H VAL A 11 2.794 -3.516 -0.141 1.00 0.14 H ATOM 178 HA VAL A 11 0.984 -2.180 -1.549 1.00 0.19 H ATOM 179 HB VAL A 11 2.177 -4.231 -2.254 1.00 0.19 H ATOM 180 HG11 VAL A 11 -0.049 -5.660 -0.810 1.00 1.03 H ATOM 181 HG12 VAL A 11 1.660 -5.668 -0.376 1.00 1.04 H ATOM 182 HG13 VAL A 11 1.129 -6.416 -1.882 1.00 1.04 H ATOM 183 HG21 VAL A 11 0.469 -5.017 -3.800 1.00 1.06 H ATOM 184 HG22 VAL A 11 0.439 -3.260 -3.651 1.00 1.04 H ATOM 185 HG23 VAL A 11 -0.779 -4.235 -2.828 1.00 1.04 H ATOM 186 N LYS A 12 -0.619 -3.709 0.834 1.00 0.16 N ATOM 187 CA LYS A 12 -1.834 -3.620 1.641 1.00 0.19 C ATOM 188 C LYS A 12 -2.449 -2.213 1.593 1.00 0.15 C ATOM 189 O LYS A 12 -3.662 -2.068 1.442 1.00 0.14 O ATOM 190 CB LYS A 12 -1.488 -3.990 3.089 1.00 0.27 C ATOM 191 CG LYS A 12 -2.533 -3.576 4.117 1.00 0.46 C ATOM 192 CD LYS A 12 -3.901 -4.177 3.814 1.00 0.97 C ATOM 193 CE LYS A 12 -3.916 -5.680 4.062 1.00 1.65 C ATOM 194 NZ LYS A 12 -5.216 -6.293 3.689 1.00 2.26 N ATOM 195 H LYS A 12 0.150 -4.192 1.194 1.00 0.16 H ATOM 196 HA LYS A 12 -2.548 -4.333 1.255 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.358 -5.057 3.148 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.555 -3.513 3.349 1.00 0.33 H ATOM 199 HG2 LYS A 12 -2.213 -3.917 5.092 1.00 0.85 H ATOM 200 HG3 LYS A 12 -2.607 -2.495 4.120 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.642 -3.702 4.443 1.00 1.47 H ATOM 202 HD3 LYS A 12 -4.138 -3.991 2.777 1.00 1.42 H ATOM 203 HE2 LYS A 12 -3.133 -6.136 3.477 1.00 2.23 H ATOM 204 HE3 LYS A 12 -3.731 -5.859 5.110 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -5.955 -5.893 4.230 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -5.195 -7.278 3.856 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -5.406 -6.136 2.718 1.00 2.67 H ATOM 208 N LEU A 13 -1.607 -1.187 1.718 1.00 0.15 N ATOM 209 CA LEU A 13 -2.051 0.205 1.682 1.00 0.15 C ATOM 210 C LEU A 13 -2.826 0.458 0.393 1.00 0.13 C ATOM 211 O LEU A 13 -3.854 1.134 0.391 1.00 0.15 O ATOM 212 CB LEU A 13 -0.827 1.140 1.781 1.00 0.20 C ATOM 213 CG LEU A 13 -1.083 2.586 2.250 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.942 3.367 1.266 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.717 2.595 3.633 1.00 0.38 C ATOM 216 H LEU A 13 -0.647 -1.372 1.833 1.00 0.19 H ATOM 217 HA LEU A 13 -2.701 0.373 2.526 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.124 0.691 2.467 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.362 1.182 0.810 1.00 0.21 H ATOM 220 HG LEU A 13 -0.133 3.096 2.317 1.00 0.30 H ATOM 221 HD11 LEU A 13 -1.425 3.448 0.322 1.00 1.08 H ATOM 222 HD12 LEU A 13 -2.133 4.355 1.659 1.00 1.08 H ATOM 223 HD13 LEU A 13 -2.879 2.849 1.120 1.00 1.09 H ATOM 224 HD21 LEU A 13 -2.681 2.110 3.591 1.00 1.09 H ATOM 225 HD22 LEU A 13 -1.842 3.614 3.965 1.00 1.09 H ATOM 226 HD23 LEU A 13 -1.078 2.066 4.325 1.00 1.10 H ATOM 227 N GLY A 14 -2.344 -0.135 -0.691 1.00 0.18 N ATOM 228 CA GLY A 14 -3.005 -0.011 -1.971 1.00 0.23 C ATOM 229 C GLY A 14 -4.417 -0.556 -1.932 1.00 0.22 C ATOM 230 O GLY A 14 -5.316 -0.014 -2.564 1.00 0.29 O ATOM 231 H GLY A 14 -1.534 -0.682 -0.615 1.00 0.22 H ATOM 232 HA2 GLY A 14 -3.035 1.032 -2.250 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.440 -0.557 -2.710 1.00 0.29 H ATOM 234 N LEU A 15 -4.615 -1.612 -1.159 1.00 0.22 N ATOM 235 CA LEU A 15 -5.921 -2.238 -1.033 1.00 0.29 C ATOM 236 C LEU A 15 -6.770 -1.524 0.012 1.00 0.28 C ATOM 237 O LEU A 15 -7.973 -1.755 0.114 1.00 0.39 O ATOM 238 CB LEU A 15 -5.782 -3.719 -0.664 1.00 0.35 C ATOM 239 CG LEU A 15 -5.304 -4.651 -1.784 1.00 0.41 C ATOM 240 CD1 LEU A 15 -6.169 -4.486 -3.025 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.840 -4.413 -2.115 1.00 0.39 C ATOM 242 H LEU A 15 -3.859 -1.980 -0.651 1.00 0.22 H ATOM 243 HA LEU A 15 -6.416 -2.161 -1.989 1.00 0.36 H ATOM 244 HB2 LEU A 15 -5.083 -3.795 0.157 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.742 -4.068 -0.324 1.00 0.41 H ATOM 246 HG LEU A 15 -5.404 -5.673 -1.448 1.00 0.51 H ATOM 247 HD11 LEU A 15 -7.201 -4.683 -2.775 1.00 1.13 H ATOM 248 HD12 LEU A 15 -5.844 -5.182 -3.784 1.00 1.16 H ATOM 249 HD13 LEU A 15 -6.075 -3.477 -3.401 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.239 -4.584 -1.233 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.708 -3.394 -2.447 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.533 -5.090 -2.896 1.00 1.10 H ATOM 253 N LYS A 16 -6.141 -0.663 0.795 1.00 0.21 N ATOM 254 CA LYS A 16 -6.860 0.135 1.776 1.00 0.28 C ATOM 255 C LYS A 16 -7.314 1.446 1.147 1.00 0.34 C ATOM 256 O LYS A 16 -8.370 1.981 1.481 1.00 0.46 O ATOM 257 CB LYS A 16 -5.982 0.423 2.996 1.00 0.34 C ATOM 258 CG LYS A 16 -5.424 -0.823 3.669 1.00 0.39 C ATOM 259 CD LYS A 16 -4.650 -0.477 4.931 1.00 1.31 C ATOM 260 CE LYS A 16 -5.532 0.197 5.973 1.00 1.54 C ATOM 261 NZ LYS A 16 -6.686 -0.655 6.366 1.00 2.08 N ATOM 262 H LYS A 16 -5.166 -0.570 0.720 1.00 0.18 H ATOM 263 HA LYS A 16 -7.729 -0.425 2.088 1.00 0.35 H ATOM 264 HB2 LYS A 16 -5.151 1.039 2.686 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.568 0.966 3.722 1.00 0.43 H ATOM 266 HG2 LYS A 16 -6.233 -1.488 3.927 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.758 -1.319 2.979 1.00 0.78 H ATOM 268 HD2 LYS A 16 -4.247 -1.385 5.352 1.00 2.01 H ATOM 269 HD3 LYS A 16 -3.841 0.191 4.673 1.00 1.98 H ATOM 270 HE2 LYS A 16 -4.937 0.403 6.849 1.00 2.03 H ATOM 271 HE3 LYS A 16 -5.903 1.126 5.568 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -6.362 -1.533 6.719 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -7.277 -0.825 5.579 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -7.223 -0.200 7.076 1.00 2.48 H ATOM 275 N MET A 17 -6.503 1.955 0.229 1.00 0.37 N ATOM 276 CA MET A 17 -6.804 3.204 -0.458 1.00 0.49 C ATOM 277 C MET A 17 -7.742 2.959 -1.631 1.00 0.55 C ATOM 278 O MET A 17 -8.667 3.734 -1.879 1.00 0.66 O ATOM 279 CB MET A 17 -5.500 3.881 -0.913 1.00 0.60 C ATOM 280 CG MET A 17 -4.698 3.127 -1.970 1.00 0.69 C ATOM 281 SD MET A 17 -5.196 3.515 -3.661 1.00 1.70 S ATOM 282 CE MET A 17 -4.075 2.470 -4.588 1.00 2.33 C ATOM 283 H MET A 17 -5.665 1.485 0.023 1.00 0.37 H ATOM 284 HA MET A 17 -7.302 3.852 0.248 1.00 0.54 H ATOM 285 HB2 MET A 17 -5.731 4.859 -1.301 1.00 1.19 H ATOM 286 HB3 MET A 17 -4.875 3.989 -0.051 1.00 1.22 H ATOM 287 HG2 MET A 17 -3.652 3.374 -1.853 1.00 1.19 H ATOM 288 HG3 MET A 17 -4.833 2.068 -1.807 1.00 1.28 H ATOM 289 HE1 MET A 17 -3.057 2.746 -4.363 1.00 2.74 H ATOM 290 HE2 MET A 17 -4.257 2.595 -5.644 1.00 2.78 H ATOM 291 HE3 MET A 17 -4.237 1.436 -4.315 1.00 2.74 H ATOM 292 N ALA A 18 -7.500 1.873 -2.340 1.00 0.57 N ATOM 293 CA ALA A 18 -8.336 1.492 -3.477 1.00 0.70 C ATOM 294 C ALA A 18 -9.577 0.732 -3.027 1.00 0.79 C ATOM 295 O ALA A 18 -10.657 0.916 -3.588 1.00 1.34 O ATOM 296 CB ALA A 18 -7.546 0.654 -4.472 1.00 0.81 C ATOM 297 H ALA A 18 -6.714 1.329 -2.110 1.00 0.58 H ATOM 298 HA ALA A 18 -8.647 2.399 -3.976 1.00 0.78 H ATOM 299 HB1 ALA A 18 -6.665 1.199 -4.783 1.00 1.33 H ATOM 300 HB2 ALA A 18 -8.160 0.443 -5.334 1.00 1.31 H ATOM 301 HB3 ALA A 18 -7.248 -0.276 -4.006 1.00 1.33 H ATOM 302 N LEU A 19 -9.411 -0.109 -2.007 1.00 0.75 N ATOM 303 CA LEU A 19 -10.486 -0.965 -1.504 1.00 0.82 C ATOM 304 C LEU A 19 -10.969 -1.924 -2.589 1.00 1.31 C ATOM 305 O LEU A 19 -11.983 -1.626 -3.253 1.00 1.89 O ATOM 306 CB LEU A 19 -11.656 -0.128 -0.969 1.00 1.07 C ATOM 307 CG LEU A 19 -11.344 0.733 0.255 1.00 1.32 C ATOM 308 CD1 LEU A 19 -12.563 1.550 0.649 1.00 2.07 C ATOM 309 CD2 LEU A 19 -10.889 -0.135 1.418 1.00 1.78 C ATOM 310 OXT LEU A 19 -10.321 -2.976 -2.779 1.00 1.90 O ATOM 311 H LEU A 19 -8.534 -0.160 -1.579 1.00 1.05 H ATOM 312 HA LEU A 19 -10.079 -1.550 -0.692 1.00 0.82 H ATOM 313 HB2 LEU A 19 -11.997 0.520 -1.761 1.00 1.70 H ATOM 314 HB3 LEU A 19 -12.459 -0.801 -0.709 1.00 1.39 H ATOM 315 HG LEU A 19 -10.545 1.419 0.013 1.00 1.78 H ATOM 316 HD11 LEU A 19 -12.842 2.200 -0.167 1.00 2.52 H ATOM 317 HD12 LEU A 19 -12.332 2.144 1.520 1.00 2.57 H ATOM 318 HD13 LEU A 19 -13.384 0.885 0.876 1.00 2.47 H ATOM 319 HD21 LEU A 19 -11.654 -0.863 1.645 1.00 2.23 H ATOM 320 HD22 LEU A 19 -10.715 0.486 2.284 1.00 2.18 H ATOM 321 HD23 LEU A 19 -9.976 -0.644 1.152 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 13 ATOM 1 N GLY A 1 8.904 5.833 2.008 1.00 1.26 N ATOM 2 CA GLY A 1 7.604 6.335 2.512 1.00 0.47 C ATOM 3 C GLY A 1 6.523 5.276 2.441 1.00 0.35 C ATOM 4 O GLY A 1 6.779 4.155 1.997 1.00 0.42 O ATOM 5 H1 GLY A 1 9.199 5.048 2.549 1.00 1.79 H ATOM 6 H2 GLY A 1 9.599 6.548 2.070 1.00 1.72 H ATOM 7 H3 GLY A 1 8.815 5.551 1.049 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.722 6.648 3.538 1.00 0.89 H ATOM 9 HA3 GLY A 1 7.303 7.185 1.918 1.00 0.90 H ATOM 10 N ILE A 2 5.308 5.626 2.856 1.00 0.27 N ATOM 11 CA ILE A 2 4.202 4.679 2.846 1.00 0.21 C ATOM 12 C ILE A 2 3.743 4.402 1.416 1.00 0.14 C ATOM 13 O ILE A 2 3.170 3.353 1.131 1.00 0.22 O ATOM 14 CB ILE A 2 3.012 5.158 3.695 1.00 0.27 C ATOM 15 CG1 ILE A 2 2.068 3.986 3.941 1.00 0.31 C ATOM 16 CG2 ILE A 2 2.270 6.302 3.014 1.00 0.33 C ATOM 17 CD1 ILE A 2 1.023 4.263 4.985 1.00 0.77 C ATOM 18 H ILE A 2 5.154 6.545 3.171 1.00 0.31 H ATOM 19 HA ILE A 2 4.557 3.755 3.277 1.00 0.27 H ATOM 20 HB ILE A 2 3.387 5.514 4.641 1.00 0.34 H ATOM 21 HG12 ILE A 2 1.563 3.743 3.021 1.00 0.63 H ATOM 22 HG13 ILE A 2 2.641 3.128 4.265 1.00 0.74 H ATOM 23 HG21 ILE A 2 1.444 6.616 3.633 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.894 5.967 2.057 1.00 1.10 H ATOM 25 HG23 ILE A 2 2.946 7.131 2.865 1.00 1.08 H ATOM 26 HD11 ILE A 2 0.412 3.385 5.123 1.00 1.38 H ATOM 27 HD12 ILE A 2 0.407 5.089 4.665 1.00 1.38 H ATOM 28 HD13 ILE A 2 1.511 4.513 5.913 1.00 1.42 H ATOM 29 N VAL A 3 4.003 5.340 0.514 1.00 0.14 N ATOM 30 CA VAL A 3 3.698 5.129 -0.894 1.00 0.20 C ATOM 31 C VAL A 3 4.599 4.035 -1.459 1.00 0.16 C ATOM 32 O VAL A 3 4.170 3.200 -2.251 1.00 0.19 O ATOM 33 CB VAL A 3 3.859 6.424 -1.728 1.00 0.33 C ATOM 34 CG1 VAL A 3 5.251 7.014 -1.563 1.00 0.92 C ATOM 35 CG2 VAL A 3 3.570 6.154 -3.199 1.00 0.94 C ATOM 36 H VAL A 3 4.401 6.190 0.804 1.00 0.20 H ATOM 37 HA VAL A 3 2.668 4.804 -0.959 1.00 0.25 H ATOM 38 HB VAL A 3 3.142 7.148 -1.370 1.00 0.65 H ATOM 39 HG11 VAL A 3 5.438 7.209 -0.519 1.00 1.51 H ATOM 40 HG12 VAL A 3 5.321 7.937 -2.121 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.984 6.312 -1.934 1.00 1.49 H ATOM 42 HG21 VAL A 3 3.688 7.066 -3.761 1.00 1.54 H ATOM 43 HG22 VAL A 3 2.559 5.790 -3.307 1.00 1.49 H ATOM 44 HG23 VAL A 3 4.263 5.410 -3.570 1.00 1.53 H ATOM 45 N THR A 4 5.845 4.031 -1.014 1.00 0.17 N ATOM 46 CA THR A 4 6.806 3.041 -1.446 1.00 0.21 C ATOM 47 C THR A 4 6.513 1.697 -0.785 1.00 0.18 C ATOM 48 O THR A 4 6.770 0.628 -1.362 1.00 0.21 O ATOM 49 CB THR A 4 8.228 3.509 -1.114 1.00 0.32 C ATOM 50 OG1 THR A 4 8.182 4.850 -0.597 1.00 0.63 O ATOM 51 CG2 THR A 4 9.100 3.471 -2.356 1.00 0.66 C ATOM 52 H THR A 4 6.130 4.721 -0.379 1.00 0.21 H ATOM 53 HA THR A 4 6.720 2.933 -2.519 1.00 0.24 H ATOM 54 HB THR A 4 8.648 2.852 -0.367 1.00 0.54 H ATOM 55 HG1 THR A 4 8.502 5.465 -1.272 1.00 1.24 H ATOM 56 HG21 THR A 4 10.080 3.855 -2.121 1.00 1.24 H ATOM 57 HG22 THR A 4 8.649 4.079 -3.129 1.00 1.30 H ATOM 58 HG23 THR A 4 9.185 2.453 -2.705 1.00 1.28 H ATOM 59 N LYS A 5 5.969 1.754 0.427 1.00 0.18 N ATOM 60 CA LYS A 5 5.461 0.569 1.077 1.00 0.27 C ATOM 61 C LYS A 5 4.289 0.026 0.264 1.00 0.21 C ATOM 62 O LYS A 5 4.246 -1.162 -0.042 1.00 0.22 O ATOM 63 CB LYS A 5 5.074 0.879 2.537 1.00 0.46 C ATOM 64 CG LYS A 5 3.577 0.867 2.846 1.00 0.94 C ATOM 65 CD LYS A 5 3.316 0.544 4.310 1.00 0.90 C ATOM 66 CE LYS A 5 1.831 0.368 4.598 1.00 0.81 C ATOM 67 NZ LYS A 5 1.578 0.080 6.032 1.00 1.23 N ATOM 68 H LYS A 5 5.931 2.610 0.903 1.00 0.19 H ATOM 69 HA LYS A 5 6.251 -0.167 1.071 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.553 0.163 3.175 1.00 1.25 H ATOM 71 HB3 LYS A 5 5.451 1.862 2.783 1.00 1.15 H ATOM 72 HG2 LYS A 5 3.172 1.844 2.631 1.00 1.72 H ATOM 73 HG3 LYS A 5 3.087 0.136 2.227 1.00 1.75 H ATOM 74 HD2 LYS A 5 3.830 -0.372 4.563 1.00 1.31 H ATOM 75 HD3 LYS A 5 3.698 1.351 4.919 1.00 1.33 H ATOM 76 HE2 LYS A 5 1.313 1.275 4.326 1.00 1.09 H ATOM 77 HE3 LYS A 5 1.455 -0.452 4.003 1.00 0.97 H ATOM 78 HZ1 LYS A 5 1.871 0.850 6.597 1.00 1.66 H ATOM 79 HZ2 LYS A 5 2.081 -0.735 6.315 1.00 1.71 H ATOM 80 HZ3 LYS A 5 0.601 -0.082 6.183 1.00 1.67 H ATOM 81 N LEU A 6 3.393 0.929 -0.148 1.00 0.21 N ATOM 82 CA LEU A 6 2.236 0.595 -0.983 1.00 0.25 C ATOM 83 C LEU A 6 2.650 -0.182 -2.231 1.00 0.21 C ATOM 84 O LEU A 6 1.841 -0.884 -2.838 1.00 0.26 O ATOM 85 CB LEU A 6 1.494 1.894 -1.364 1.00 0.36 C ATOM 86 CG LEU A 6 0.548 1.824 -2.570 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.610 2.789 -2.384 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.294 2.165 -3.853 1.00 1.21 C ATOM 89 H LEU A 6 3.512 1.865 0.130 1.00 0.22 H ATOM 90 HA LEU A 6 1.573 -0.022 -0.397 1.00 0.32 H ATOM 91 HB2 LEU A 6 0.913 2.211 -0.513 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.236 2.651 -1.567 1.00 0.85 H ATOM 93 HG LEU A 6 0.150 0.825 -2.661 1.00 1.34 H ATOM 94 HD11 LEU A 6 -0.226 3.787 -2.232 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.191 2.491 -1.525 1.00 1.71 H ATOM 96 HD13 LEU A 6 -1.235 2.774 -3.264 1.00 1.70 H ATOM 97 HD21 LEU A 6 0.615 2.105 -4.690 1.00 1.76 H ATOM 98 HD22 LEU A 6 2.104 1.465 -3.993 1.00 1.73 H ATOM 99 HD23 LEU A 6 1.692 3.166 -3.782 1.00 1.81 H ATOM 100 N ILE A 7 3.910 -0.056 -2.607 1.00 0.16 N ATOM 101 CA ILE A 7 4.409 -0.707 -3.797 1.00 0.18 C ATOM 102 C ILE A 7 4.581 -2.216 -3.599 1.00 0.16 C ATOM 103 O ILE A 7 3.815 -3.000 -4.164 1.00 0.19 O ATOM 104 CB ILE A 7 5.739 -0.079 -4.256 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.553 1.428 -4.445 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.224 -0.728 -5.544 1.00 0.27 C ATOM 107 CD1 ILE A 7 6.794 2.150 -4.918 1.00 1.07 C ATOM 108 H ILE A 7 4.513 0.500 -2.073 1.00 0.16 H ATOM 109 HA ILE A 7 3.683 -0.549 -4.580 1.00 0.23 H ATOM 110 HB ILE A 7 6.479 -0.251 -3.490 1.00 0.20 H ATOM 111 HG12 ILE A 7 4.775 1.600 -5.173 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.256 1.860 -3.499 1.00 0.79 H ATOM 113 HG21 ILE A 7 7.149 -0.264 -5.852 1.00 1.06 H ATOM 114 HG22 ILE A 7 5.480 -0.596 -6.314 1.00 1.06 H ATOM 115 HG23 ILE A 7 6.387 -1.781 -5.376 1.00 1.06 H ATOM 116 HD11 ILE A 7 7.593 1.996 -4.209 1.00 1.67 H ATOM 117 HD12 ILE A 7 6.586 3.206 -5.003 1.00 1.67 H ATOM 118 HD13 ILE A 7 7.089 1.762 -5.881 1.00 1.64 H ATOM 119 N LYS A 8 5.571 -2.640 -2.815 1.00 0.13 N ATOM 120 CA LYS A 8 5.871 -4.075 -2.756 1.00 0.12 C ATOM 121 C LYS A 8 5.190 -4.834 -1.603 1.00 0.11 C ATOM 122 O LYS A 8 4.205 -5.533 -1.821 1.00 0.13 O ATOM 123 CB LYS A 8 7.387 -4.342 -2.747 1.00 0.17 C ATOM 124 CG LYS A 8 8.273 -3.121 -2.526 1.00 0.49 C ATOM 125 CD LYS A 8 8.227 -2.629 -1.089 1.00 0.78 C ATOM 126 CE LYS A 8 9.344 -1.635 -0.797 1.00 0.98 C ATOM 127 NZ LYS A 8 9.318 -0.464 -1.714 1.00 1.70 N ATOM 128 H LYS A 8 6.083 -1.993 -2.276 1.00 0.13 H ATOM 129 HA LYS A 8 5.481 -4.489 -3.668 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.604 -5.051 -1.963 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.658 -4.784 -3.694 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.289 -3.382 -2.772 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.939 -2.327 -3.179 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.276 -2.151 -0.916 1.00 1.28 H ATOM 135 HD3 LYS A 8 8.331 -3.477 -0.426 1.00 1.16 H ATOM 136 HE2 LYS A 8 9.238 -1.283 0.217 1.00 1.43 H ATOM 137 HE3 LYS A 8 10.293 -2.140 -0.902 1.00 1.50 H ATOM 138 HZ1 LYS A 8 8.451 0.026 -1.624 1.00 2.17 H ATOM 139 HZ2 LYS A 8 9.423 -0.763 -2.661 1.00 2.16 H ATOM 140 HZ3 LYS A 8 10.071 0.160 -1.491 1.00 2.17 H ATOM 141 N LYS A 9 5.699 -4.691 -0.386 1.00 0.12 N ATOM 142 CA LYS A 9 5.215 -5.496 0.745 1.00 0.14 C ATOM 143 C LYS A 9 4.132 -4.759 1.519 1.00 0.13 C ATOM 144 O LYS A 9 3.131 -5.340 1.941 1.00 0.17 O ATOM 145 CB LYS A 9 6.374 -5.872 1.672 1.00 0.21 C ATOM 146 CG LYS A 9 7.394 -6.804 1.035 1.00 0.84 C ATOM 147 CD LYS A 9 6.809 -8.183 0.772 1.00 1.34 C ATOM 148 CE LYS A 9 7.870 -9.163 0.285 1.00 2.00 C ATOM 149 NZ LYS A 9 8.350 -8.843 -1.083 1.00 2.66 N ATOM 150 H LYS A 9 6.401 -4.027 -0.235 1.00 0.13 H ATOM 151 HA LYS A 9 4.787 -6.402 0.340 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.884 -4.970 1.972 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.975 -6.357 2.549 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.718 -6.380 0.096 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.240 -6.904 1.696 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.379 -8.561 1.686 1.00 1.78 H ATOM 157 HD3 LYS A 9 6.039 -8.098 0.019 1.00 1.82 H ATOM 158 HE2 LYS A 9 8.708 -9.131 0.964 1.00 2.46 H ATOM 159 HE3 LYS A 9 7.448 -10.158 0.286 1.00 2.44 H ATOM 160 HZ1 LYS A 9 7.603 -8.940 -1.742 1.00 3.04 H ATOM 161 HZ2 LYS A 9 9.087 -9.462 -1.345 1.00 3.03 H ATOM 162 HZ3 LYS A 9 8.691 -7.905 -1.119 1.00 3.05 H ATOM 163 N GLY A 10 4.364 -3.470 1.684 1.00 0.14 N ATOM 164 CA GLY A 10 3.433 -2.569 2.338 1.00 0.17 C ATOM 165 C GLY A 10 2.115 -2.459 1.598 1.00 0.16 C ATOM 166 O GLY A 10 1.175 -1.838 2.095 1.00 0.20 O ATOM 167 H GLY A 10 5.202 -3.097 1.333 1.00 0.15 H ATOM 168 HA2 GLY A 10 3.242 -2.932 3.336 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.885 -1.595 2.401 1.00 0.21 H ATOM 170 N VAL A 11 2.134 -2.964 0.357 1.00 0.14 N ATOM 171 CA VAL A 11 1.057 -2.861 -0.642 1.00 0.16 C ATOM 172 C VAL A 11 -0.370 -2.934 -0.069 1.00 0.16 C ATOM 173 O VAL A 11 -1.318 -2.522 -0.734 1.00 0.18 O ATOM 174 CB VAL A 11 1.244 -3.965 -1.711 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.083 -5.348 -1.098 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.284 -3.779 -2.871 1.00 0.23 C ATOM 177 H VAL A 11 2.936 -3.452 0.094 1.00 0.14 H ATOM 178 HA VAL A 11 1.175 -1.913 -1.139 1.00 0.19 H ATOM 179 HB VAL A 11 2.253 -3.891 -2.096 1.00 0.19 H ATOM 180 HG11 VAL A 11 1.213 -6.097 -1.865 1.00 1.03 H ATOM 181 HG12 VAL A 11 0.098 -5.439 -0.670 1.00 1.04 H ATOM 182 HG13 VAL A 11 1.827 -5.489 -0.328 1.00 1.04 H ATOM 183 HG21 VAL A 11 0.424 -2.797 -3.297 1.00 1.06 H ATOM 184 HG22 VAL A 11 -0.731 -3.877 -2.516 1.00 1.04 H ATOM 185 HG23 VAL A 11 0.480 -4.529 -3.623 1.00 1.04 H ATOM 186 N LYS A 12 -0.521 -3.462 1.139 1.00 0.16 N ATOM 187 CA LYS A 12 -1.772 -3.361 1.891 1.00 0.19 C ATOM 188 C LYS A 12 -2.393 -1.970 1.744 1.00 0.15 C ATOM 189 O LYS A 12 -3.598 -1.847 1.535 1.00 0.14 O ATOM 190 CB LYS A 12 -1.507 -3.646 3.375 1.00 0.27 C ATOM 191 CG LYS A 12 -2.704 -3.414 4.297 1.00 0.46 C ATOM 192 CD LYS A 12 -3.529 -4.679 4.528 1.00 0.97 C ATOM 193 CE LYS A 12 -4.216 -5.173 3.264 1.00 1.65 C ATOM 194 NZ LYS A 12 -4.985 -6.421 3.505 1.00 2.26 N ATOM 195 H LYS A 12 0.234 -3.942 1.538 1.00 0.16 H ATOM 196 HA LYS A 12 -2.455 -4.094 1.500 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.199 -4.675 3.477 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.700 -3.010 3.707 1.00 0.33 H ATOM 199 HG2 LYS A 12 -2.340 -3.065 5.251 1.00 0.85 H ATOM 200 HG3 LYS A 12 -3.340 -2.651 3.859 1.00 0.95 H ATOM 201 HD2 LYS A 12 -2.876 -5.457 4.892 1.00 1.47 H ATOM 202 HD3 LYS A 12 -4.281 -4.468 5.273 1.00 1.42 H ATOM 203 HE2 LYS A 12 -4.889 -4.408 2.910 1.00 2.23 H ATOM 204 HE3 LYS A 12 -3.466 -5.367 2.516 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -4.368 -7.156 3.792 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -5.451 -6.706 2.668 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -5.670 -6.275 4.218 1.00 2.67 H ATOM 208 N LEU A 13 -1.556 -0.933 1.833 1.00 0.15 N ATOM 209 CA LEU A 13 -2.008 0.448 1.691 1.00 0.15 C ATOM 210 C LEU A 13 -2.727 0.629 0.352 1.00 0.13 C ATOM 211 O LEU A 13 -3.768 1.278 0.279 1.00 0.15 O ATOM 212 CB LEU A 13 -0.799 1.395 1.806 1.00 0.20 C ATOM 213 CG LEU A 13 -1.100 2.866 2.151 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.800 3.580 1.011 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.935 2.959 3.421 1.00 0.38 C ATOM 216 H LEU A 13 -0.599 -1.105 1.996 1.00 0.19 H ATOM 217 HA LEU A 13 -2.701 0.659 2.491 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.143 1.004 2.570 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.270 1.375 0.868 1.00 0.21 H ATOM 220 HG LEU A 13 -0.167 3.380 2.330 1.00 0.30 H ATOM 221 HD11 LEU A 13 -2.054 4.584 1.316 1.00 1.08 H ATOM 222 HD12 LEU A 13 -2.699 3.042 0.753 1.00 1.08 H ATOM 223 HD13 LEU A 13 -1.144 3.618 0.155 1.00 1.09 H ATOM 224 HD21 LEU A 13 -2.083 3.998 3.677 1.00 1.09 H ATOM 225 HD22 LEU A 13 -1.422 2.458 4.226 1.00 1.09 H ATOM 226 HD23 LEU A 13 -2.895 2.490 3.257 1.00 1.10 H ATOM 227 N GLY A 14 -2.186 0.012 -0.692 1.00 0.18 N ATOM 228 CA GLY A 14 -2.784 0.098 -2.009 1.00 0.23 C ATOM 229 C GLY A 14 -4.160 -0.534 -2.057 1.00 0.22 C ATOM 230 O GLY A 14 -5.076 0.002 -2.683 1.00 0.29 O ATOM 231 H GLY A 14 -1.378 -0.530 -0.561 1.00 0.22 H ATOM 232 HA2 GLY A 14 -2.867 1.139 -2.288 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.144 -0.404 -2.719 1.00 0.29 H ATOM 234 N LEU A 15 -4.317 -1.665 -1.382 1.00 0.22 N ATOM 235 CA LEU A 15 -5.607 -2.337 -1.321 1.00 0.29 C ATOM 236 C LEU A 15 -6.570 -1.570 -0.427 1.00 0.28 C ATOM 237 O LEU A 15 -7.781 -1.654 -0.593 1.00 0.39 O ATOM 238 CB LEU A 15 -5.470 -3.777 -0.815 1.00 0.35 C ATOM 239 CG LEU A 15 -4.822 -4.781 -1.779 1.00 0.41 C ATOM 240 CD1 LEU A 15 -5.410 -4.649 -3.172 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.312 -4.618 -1.815 1.00 0.39 C ATOM 242 H LEU A 15 -3.547 -2.058 -0.915 1.00 0.22 H ATOM 243 HA LEU A 15 -6.011 -2.357 -2.323 1.00 0.36 H ATOM 244 HB2 LEU A 15 -4.885 -3.759 0.094 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.459 -4.135 -0.573 1.00 0.41 H ATOM 246 HG LEU A 15 -5.037 -5.781 -1.431 1.00 0.51 H ATOM 247 HD11 LEU A 15 -6.485 -4.728 -3.116 1.00 1.13 H ATOM 248 HD12 LEU A 15 -5.025 -5.437 -3.801 1.00 1.16 H ATOM 249 HD13 LEU A 15 -5.140 -3.690 -3.589 1.00 1.18 H ATOM 250 HD21 LEU A 15 -2.909 -4.782 -0.828 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.066 -3.619 -2.144 1.00 1.09 H ATOM 252 HD23 LEU A 15 -2.889 -5.336 -2.501 1.00 1.10 H ATOM 253 N LYS A 16 -6.024 -0.833 0.530 1.00 0.21 N ATOM 254 CA LYS A 16 -6.834 0.008 1.404 1.00 0.28 C ATOM 255 C LYS A 16 -7.336 1.231 0.640 1.00 0.34 C ATOM 256 O LYS A 16 -8.402 1.771 0.933 1.00 0.46 O ATOM 257 CB LYS A 16 -6.025 0.428 2.637 1.00 0.34 C ATOM 258 CG LYS A 16 -5.655 -0.741 3.544 1.00 0.39 C ATOM 259 CD LYS A 16 -6.845 -1.240 4.358 1.00 1.31 C ATOM 260 CE LYS A 16 -7.084 -0.411 5.620 1.00 1.54 C ATOM 261 NZ LYS A 16 -7.545 0.975 5.332 1.00 2.08 N ATOM 262 H LYS A 16 -5.049 -0.863 0.661 1.00 0.18 H ATOM 263 HA LYS A 16 -7.686 -0.573 1.723 1.00 0.35 H ATOM 264 HB2 LYS A 16 -5.114 0.908 2.311 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.608 1.131 3.212 1.00 0.43 H ATOM 266 HG2 LYS A 16 -5.298 -1.552 2.927 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.869 -0.433 4.218 1.00 0.78 H ATOM 268 HD2 LYS A 16 -7.730 -1.194 3.743 1.00 2.01 H ATOM 269 HD3 LYS A 16 -6.662 -2.266 4.644 1.00 1.98 H ATOM 270 HE2 LYS A 16 -7.832 -0.906 6.220 1.00 2.03 H ATOM 271 HE3 LYS A 16 -6.161 -0.363 6.177 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -7.795 1.437 6.184 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -8.344 0.957 4.735 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -6.819 1.498 4.884 1.00 2.48 H ATOM 275 N MET A 17 -6.563 1.659 -0.350 1.00 0.37 N ATOM 276 CA MET A 17 -6.970 2.753 -1.223 1.00 0.49 C ATOM 277 C MET A 17 -8.040 2.270 -2.193 1.00 0.55 C ATOM 278 O MET A 17 -9.056 2.931 -2.405 1.00 0.66 O ATOM 279 CB MET A 17 -5.773 3.294 -2.011 1.00 0.60 C ATOM 280 CG MET A 17 -4.630 3.823 -1.154 1.00 0.69 C ATOM 281 SD MET A 17 -5.006 5.385 -0.326 1.00 1.70 S ATOM 282 CE MET A 17 -5.780 4.820 1.191 1.00 2.33 C ATOM 283 H MET A 17 -5.691 1.229 -0.493 1.00 0.37 H ATOM 284 HA MET A 17 -7.382 3.540 -0.612 1.00 0.54 H ATOM 285 HB2 MET A 17 -5.384 2.500 -2.632 1.00 1.19 H ATOM 286 HB3 MET A 17 -6.115 4.097 -2.648 1.00 1.22 H ATOM 287 HG2 MET A 17 -4.401 3.086 -0.401 1.00 1.19 H ATOM 288 HG3 MET A 17 -3.762 3.966 -1.785 1.00 1.28 H ATOM 289 HE1 MET A 17 -5.095 4.179 1.726 1.00 2.74 H ATOM 290 HE2 MET A 17 -6.678 4.270 0.959 1.00 2.78 H ATOM 291 HE3 MET A 17 -6.028 5.671 1.806 1.00 2.74 H ATOM 292 N ALA A 18 -7.808 1.097 -2.765 1.00 0.57 N ATOM 293 CA ALA A 18 -8.722 0.522 -3.741 1.00 0.70 C ATOM 294 C ALA A 18 -9.733 -0.406 -3.073 1.00 0.79 C ATOM 295 O ALA A 18 -10.325 -1.264 -3.728 1.00 1.34 O ATOM 296 CB ALA A 18 -7.941 -0.225 -4.811 1.00 0.81 C ATOM 297 H ALA A 18 -6.994 0.601 -2.523 1.00 0.58 H ATOM 298 HA ALA A 18 -9.253 1.334 -4.217 1.00 0.78 H ATOM 299 HB1 ALA A 18 -7.232 0.445 -5.274 1.00 1.33 H ATOM 300 HB2 ALA A 18 -8.624 -0.600 -5.560 1.00 1.31 H ATOM 301 HB3 ALA A 18 -7.412 -1.054 -4.360 1.00 1.33 H ATOM 302 N LEU A 19 -9.920 -0.230 -1.770 1.00 0.75 N ATOM 303 CA LEU A 19 -10.870 -1.033 -1.009 1.00 0.82 C ATOM 304 C LEU A 19 -12.290 -0.727 -1.480 1.00 1.31 C ATOM 305 O LEU A 19 -12.771 0.399 -1.223 1.00 1.89 O ATOM 306 CB LEU A 19 -10.720 -0.746 0.495 1.00 1.07 C ATOM 307 CG LEU A 19 -11.262 -1.822 1.450 1.00 1.32 C ATOM 308 CD1 LEU A 19 -10.775 -1.562 2.867 1.00 2.07 C ATOM 309 CD2 LEU A 19 -12.782 -1.865 1.434 1.00 1.78 C ATOM 310 OXT LEU A 19 -12.915 -1.607 -2.108 1.00 1.90 O ATOM 311 H LEU A 19 -9.396 0.452 -1.304 1.00 1.05 H ATOM 312 HA LEU A 19 -10.649 -2.076 -1.197 1.00 0.82 H ATOM 313 HB2 LEU A 19 -9.670 -0.608 0.705 1.00 1.70 H ATOM 314 HB3 LEU A 19 -11.232 0.181 0.710 1.00 1.39 H ATOM 315 HG LEU A 19 -10.894 -2.790 1.141 1.00 1.78 H ATOM 316 HD11 LEU A 19 -9.695 -1.554 2.881 1.00 2.52 H ATOM 317 HD12 LEU A 19 -11.137 -2.342 3.521 1.00 2.57 H ATOM 318 HD13 LEU A 19 -11.147 -0.607 3.206 1.00 2.47 H ATOM 319 HD21 LEU A 19 -13.126 -2.662 2.077 1.00 2.23 H ATOM 320 HD22 LEU A 19 -13.127 -2.041 0.427 1.00 2.18 H ATOM 321 HD23 LEU A 19 -13.171 -0.924 1.789 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 14 ATOM 1 N GLY A 1 8.607 6.022 2.031 1.00 1.26 N ATOM 2 CA GLY A 1 7.325 6.403 2.674 1.00 0.47 C ATOM 3 C GLY A 1 6.293 5.301 2.564 1.00 0.35 C ATOM 4 O GLY A 1 6.611 4.192 2.127 1.00 0.42 O ATOM 5 H1 GLY A 1 8.460 5.817 1.061 1.00 1.79 H ATOM 6 H2 GLY A 1 8.985 5.212 2.475 1.00 1.72 H ATOM 7 H3 GLY A 1 9.267 6.768 2.109 1.00 1.76 H ATOM 8 HA2 GLY A 1 7.502 6.613 3.718 1.00 0.89 H ATOM 9 HA3 GLY A 1 6.944 7.291 2.197 1.00 0.90 H ATOM 10 N ILE A 2 5.051 5.604 2.932 1.00 0.27 N ATOM 11 CA ILE A 2 3.985 4.611 2.886 1.00 0.21 C ATOM 12 C ILE A 2 3.644 4.261 1.441 1.00 0.14 C ATOM 13 O ILE A 2 3.201 3.155 1.152 1.00 0.22 O ATOM 14 CB ILE A 2 2.703 5.078 3.620 1.00 0.27 C ATOM 15 CG1 ILE A 2 1.675 3.946 3.648 1.00 0.31 C ATOM 16 CG2 ILE A 2 2.111 6.320 2.968 1.00 0.33 C ATOM 17 CD1 ILE A 2 2.027 2.843 4.613 1.00 0.77 C ATOM 18 H ILE A 2 4.847 6.518 3.230 1.00 0.31 H ATOM 19 HA ILE A 2 4.348 3.721 3.379 1.00 0.27 H ATOM 20 HB ILE A 2 2.971 5.328 4.633 1.00 0.34 H ATOM 21 HG12 ILE A 2 0.708 4.333 3.927 1.00 0.63 H ATOM 22 HG13 ILE A 2 1.610 3.510 2.661 1.00 0.74 H ATOM 23 HG21 ILE A 2 1.853 6.098 1.942 1.00 1.04 H ATOM 24 HG22 ILE A 2 2.834 7.121 2.994 1.00 1.10 H ATOM 25 HG23 ILE A 2 1.222 6.619 3.504 1.00 1.08 H ATOM 26 HD11 ILE A 2 1.272 2.073 4.570 1.00 1.38 H ATOM 27 HD12 ILE A 2 2.077 3.244 5.613 1.00 1.38 H ATOM 28 HD13 ILE A 2 2.984 2.423 4.345 1.00 1.42 H ATOM 29 N VAL A 3 3.861 5.205 0.539 1.00 0.14 N ATOM 30 CA VAL A 3 3.627 4.974 -0.878 1.00 0.20 C ATOM 31 C VAL A 3 4.606 3.937 -1.420 1.00 0.16 C ATOM 32 O VAL A 3 4.242 3.074 -2.218 1.00 0.19 O ATOM 33 CB VAL A 3 3.751 6.282 -1.687 1.00 0.33 C ATOM 34 CG1 VAL A 3 3.872 6.002 -3.179 1.00 0.92 C ATOM 35 CG2 VAL A 3 2.559 7.181 -1.406 1.00 0.94 C ATOM 36 H VAL A 3 4.182 6.084 0.837 1.00 0.20 H ATOM 37 HA VAL A 3 2.619 4.598 -0.987 1.00 0.25 H ATOM 38 HB VAL A 3 4.644 6.796 -1.367 1.00 0.65 H ATOM 39 HG11 VAL A 3 4.755 5.400 -3.360 1.00 1.51 H ATOM 40 HG12 VAL A 3 3.955 6.934 -3.716 1.00 1.51 H ATOM 41 HG13 VAL A 3 2.998 5.466 -3.517 1.00 1.49 H ATOM 42 HG21 VAL A 3 1.649 6.669 -1.683 1.00 1.54 H ATOM 43 HG22 VAL A 3 2.650 8.090 -1.982 1.00 1.49 H ATOM 44 HG23 VAL A 3 2.531 7.422 -0.354 1.00 1.53 H ATOM 45 N THR A 4 5.846 4.020 -0.971 1.00 0.17 N ATOM 46 CA THR A 4 6.859 3.063 -1.368 1.00 0.21 C ATOM 47 C THR A 4 6.542 1.697 -0.769 1.00 0.18 C ATOM 48 O THR A 4 6.764 0.650 -1.401 1.00 0.21 O ATOM 49 CB THR A 4 8.246 3.534 -0.910 1.00 0.32 C ATOM 50 OG1 THR A 4 8.220 4.955 -0.719 1.00 0.63 O ATOM 51 CG2 THR A 4 9.296 3.185 -1.950 1.00 0.66 C ATOM 52 H THR A 4 6.088 4.746 -0.358 1.00 0.21 H ATOM 53 HA THR A 4 6.852 2.986 -2.448 1.00 0.24 H ATOM 54 HB THR A 4 8.497 3.048 0.022 1.00 0.54 H ATOM 55 HG1 THR A 4 7.945 5.381 -1.544 1.00 1.24 H ATOM 56 HG21 THR A 4 9.036 3.654 -2.890 1.00 1.24 H ATOM 57 HG22 THR A 4 9.332 2.114 -2.080 1.00 1.30 H ATOM 58 HG23 THR A 4 10.261 3.543 -1.624 1.00 1.28 H ATOM 59 N LYS A 5 6.006 1.721 0.450 1.00 0.18 N ATOM 60 CA LYS A 5 5.468 0.525 1.069 1.00 0.27 C ATOM 61 C LYS A 5 4.375 -0.035 0.171 1.00 0.21 C ATOM 62 O LYS A 5 4.447 -1.185 -0.258 1.00 0.22 O ATOM 63 CB LYS A 5 4.896 0.842 2.460 1.00 0.46 C ATOM 64 CG LYS A 5 5.452 -0.043 3.570 1.00 0.94 C ATOM 65 CD LYS A 5 4.734 0.171 4.900 1.00 0.90 C ATOM 66 CE LYS A 5 3.288 -0.317 4.866 1.00 0.81 C ATOM 67 NZ LYS A 5 2.680 -0.347 6.220 1.00 1.23 N ATOM 68 H LYS A 5 5.981 2.569 0.944 1.00 0.19 H ATOM 69 HA LYS A 5 6.262 -0.198 1.160 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.122 1.868 2.701 1.00 1.25 H ATOM 71 HB3 LYS A 5 3.822 0.717 2.430 1.00 1.15 H ATOM 72 HG2 LYS A 5 5.348 -1.078 3.283 1.00 1.72 H ATOM 73 HG3 LYS A 5 6.497 0.187 3.700 1.00 1.75 H ATOM 74 HD2 LYS A 5 5.263 -0.369 5.670 1.00 1.31 H ATOM 75 HD3 LYS A 5 4.742 1.225 5.132 1.00 1.33 H ATOM 76 HE2 LYS A 5 2.709 0.348 4.240 1.00 1.09 H ATOM 77 HE3 LYS A 5 3.263 -1.309 4.451 1.00 0.97 H ATOM 78 HZ1 LYS A 5 2.677 0.569 6.618 1.00 1.66 H ATOM 79 HZ2 LYS A 5 3.200 -0.956 6.816 1.00 1.71 H ATOM 80 HZ3 LYS A 5 1.737 -0.681 6.166 1.00 1.67 H ATOM 81 N LEU A 6 3.402 0.825 -0.142 1.00 0.21 N ATOM 82 CA LEU A 6 2.263 0.505 -1.013 1.00 0.25 C ATOM 83 C LEU A 6 2.686 -0.235 -2.280 1.00 0.21 C ATOM 84 O LEU A 6 1.882 -0.930 -2.901 1.00 0.26 O ATOM 85 CB LEU A 6 1.526 1.811 -1.364 1.00 0.36 C ATOM 86 CG LEU A 6 0.642 1.792 -2.617 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.555 2.705 -2.424 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.439 2.240 -3.835 1.00 1.21 C ATOM 89 H LEU A 6 3.448 1.731 0.238 1.00 0.22 H ATOM 90 HA LEU A 6 1.590 -0.128 -0.454 1.00 0.32 H ATOM 91 HB2 LEU A 6 0.903 2.080 -0.527 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.268 2.585 -1.494 1.00 0.85 H ATOM 93 HG LEU A 6 0.283 0.789 -2.792 1.00 1.34 H ATOM 94 HD11 LEU A 6 -0.214 3.712 -2.236 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.136 2.359 -1.582 1.00 1.71 H ATOM 96 HD13 LEU A 6 -1.166 2.691 -3.314 1.00 1.70 H ATOM 97 HD21 LEU A 6 2.293 1.592 -3.965 1.00 1.76 H ATOM 98 HD22 LEU A 6 1.779 3.255 -3.688 1.00 1.73 H ATOM 99 HD23 LEU A 6 0.813 2.192 -4.715 1.00 1.81 H ATOM 100 N ILE A 7 3.939 -0.081 -2.666 1.00 0.16 N ATOM 101 CA ILE A 7 4.451 -0.759 -3.835 1.00 0.18 C ATOM 102 C ILE A 7 4.606 -2.264 -3.591 1.00 0.16 C ATOM 103 O ILE A 7 3.852 -3.061 -4.150 1.00 0.19 O ATOM 104 CB ILE A 7 5.798 -0.163 -4.291 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.667 1.347 -4.515 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.278 -0.845 -5.563 1.00 0.27 C ATOM 107 CD1 ILE A 7 6.955 2.014 -4.949 1.00 1.07 C ATOM 108 H ILE A 7 4.532 0.503 -2.150 1.00 0.16 H ATOM 109 HA ILE A 7 3.737 -0.614 -4.632 1.00 0.23 H ATOM 110 HB ILE A 7 6.529 -0.343 -3.516 1.00 0.20 H ATOM 111 HG12 ILE A 7 4.926 1.530 -5.278 1.00 0.88 H ATOM 112 HG13 ILE A 7 5.346 1.812 -3.593 1.00 0.79 H ATOM 113 HG21 ILE A 7 6.445 -1.894 -5.368 1.00 1.06 H ATOM 114 HG22 ILE A 7 7.200 -0.387 -5.889 1.00 1.06 H ATOM 115 HG23 ILE A 7 5.529 -0.735 -6.333 1.00 1.06 H ATOM 116 HD11 ILE A 7 6.795 3.076 -5.049 1.00 1.67 H ATOM 117 HD12 ILE A 7 7.269 1.605 -5.898 1.00 1.67 H ATOM 118 HD13 ILE A 7 7.721 1.833 -4.208 1.00 1.64 H ATOM 119 N LYS A 8 5.572 -2.668 -2.766 1.00 0.13 N ATOM 120 CA LYS A 8 5.884 -4.099 -2.668 1.00 0.12 C ATOM 121 C LYS A 8 5.155 -4.819 -1.529 1.00 0.11 C ATOM 122 O LYS A 8 4.192 -5.543 -1.762 1.00 0.13 O ATOM 123 CB LYS A 8 7.391 -4.342 -2.518 1.00 0.17 C ATOM 124 CG LYS A 8 8.284 -3.175 -2.922 1.00 0.49 C ATOM 125 CD LYS A 8 8.552 -2.250 -1.742 1.00 0.78 C ATOM 126 CE LYS A 8 9.591 -1.190 -2.074 1.00 0.98 C ATOM 127 NZ LYS A 8 9.121 -0.251 -3.122 1.00 1.70 N ATOM 128 H LYS A 8 6.056 -2.010 -2.214 1.00 0.13 H ATOM 129 HA LYS A 8 5.560 -4.549 -3.596 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.598 -4.575 -1.485 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.658 -5.195 -3.123 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.224 -3.560 -3.286 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.794 -2.614 -3.704 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.631 -1.758 -1.466 1.00 1.28 H ATOM 135 HD3 LYS A 8 8.908 -2.840 -0.910 1.00 1.16 H ATOM 136 HE2 LYS A 8 9.815 -0.629 -1.179 1.00 1.43 H ATOM 137 HE3 LYS A 8 10.488 -1.683 -2.420 1.00 1.50 H ATOM 138 HZ1 LYS A 8 8.914 -0.752 -3.964 1.00 2.17 H ATOM 139 HZ2 LYS A 8 9.831 0.424 -3.320 1.00 2.16 H ATOM 140 HZ3 LYS A 8 8.299 0.225 -2.812 1.00 2.17 H ATOM 141 N LYS A 9 5.624 -4.619 -0.299 1.00 0.12 N ATOM 142 CA LYS A 9 5.116 -5.344 0.854 1.00 0.14 C ATOM 143 C LYS A 9 4.020 -4.543 1.537 1.00 0.13 C ATOM 144 O LYS A 9 2.994 -5.075 1.960 1.00 0.17 O ATOM 145 CB LYS A 9 6.270 -5.614 1.815 1.00 0.21 C ATOM 146 CG LYS A 9 5.849 -6.253 3.113 1.00 0.84 C ATOM 147 CD LYS A 9 5.344 -7.671 2.905 1.00 1.34 C ATOM 148 CE LYS A 9 4.994 -8.344 4.221 1.00 2.00 C ATOM 149 NZ LYS A 9 3.819 -7.718 4.884 1.00 2.66 N ATOM 150 H LYS A 9 6.328 -3.961 -0.154 1.00 0.13 H ATOM 151 HA LYS A 9 4.709 -6.283 0.513 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.978 -6.270 1.331 1.00 0.63 H ATOM 153 HB3 LYS A 9 6.759 -4.679 2.042 1.00 0.64 H ATOM 154 HG2 LYS A 9 6.695 -6.272 3.777 1.00 1.45 H ATOM 155 HG3 LYS A 9 5.062 -5.657 3.542 1.00 1.47 H ATOM 156 HD2 LYS A 9 4.462 -7.638 2.286 1.00 1.78 H ATOM 157 HD3 LYS A 9 6.111 -8.248 2.410 1.00 1.82 H ATOM 158 HE2 LYS A 9 4.774 -9.382 4.028 1.00 2.46 H ATOM 159 HE3 LYS A 9 5.846 -8.274 4.879 1.00 2.44 H ATOM 160 HZ1 LYS A 9 3.999 -6.753 5.067 1.00 3.04 H ATOM 161 HZ2 LYS A 9 3.629 -8.178 5.751 1.00 3.03 H ATOM 162 HZ3 LYS A 9 3.011 -7.795 4.299 1.00 3.05 H ATOM 163 N GLY A 10 4.274 -3.253 1.631 1.00 0.14 N ATOM 164 CA GLY A 10 3.321 -2.295 2.143 1.00 0.17 C ATOM 165 C GLY A 10 2.047 -2.249 1.342 1.00 0.16 C ATOM 166 O GLY A 10 1.091 -1.605 1.759 1.00 0.20 O ATOM 167 H GLY A 10 5.151 -2.929 1.332 1.00 0.15 H ATOM 168 HA2 GLY A 10 3.080 -2.561 3.159 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.771 -1.315 2.132 1.00 0.21 H ATOM 170 N VAL A 11 2.110 -2.833 0.139 1.00 0.14 N ATOM 171 CA VAL A 11 1.016 -2.877 -0.842 1.00 0.16 C ATOM 172 C VAL A 11 -0.378 -3.026 -0.204 1.00 0.16 C ATOM 173 O VAL A 11 -1.387 -2.704 -0.826 1.00 0.18 O ATOM 174 CB VAL A 11 1.264 -4.030 -1.843 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.210 -5.380 -1.147 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.283 -3.977 -2.998 1.00 0.23 C ATOM 177 H VAL A 11 2.953 -3.262 -0.108 1.00 0.14 H ATOM 178 HA VAL A 11 1.043 -1.951 -1.395 1.00 0.19 H ATOM 179 HB VAL A 11 2.261 -3.909 -2.248 1.00 0.19 H ATOM 180 HG11 VAL A 11 1.970 -5.417 -0.379 1.00 1.03 H ATOM 181 HG12 VAL A 11 1.389 -6.163 -1.868 1.00 1.04 H ATOM 182 HG13 VAL A 11 0.237 -5.515 -0.699 1.00 1.04 H ATOM 183 HG21 VAL A 11 0.374 -3.026 -3.501 1.00 1.06 H ATOM 184 HG22 VAL A 11 -0.721 -4.092 -2.620 1.00 1.04 H ATOM 185 HG23 VAL A 11 0.504 -4.774 -3.692 1.00 1.04 H ATOM 186 N LYS A 12 -0.419 -3.529 1.020 1.00 0.16 N ATOM 187 CA LYS A 12 -1.593 -3.427 1.881 1.00 0.19 C ATOM 188 C LYS A 12 -2.268 -2.044 1.752 1.00 0.15 C ATOM 189 O LYS A 12 -3.479 -1.962 1.548 1.00 0.14 O ATOM 190 CB LYS A 12 -1.158 -3.692 3.330 1.00 0.27 C ATOM 191 CG LYS A 12 -2.202 -3.350 4.382 1.00 0.46 C ATOM 192 CD LYS A 12 -3.542 -4.015 4.095 1.00 0.97 C ATOM 193 CE LYS A 12 -3.474 -5.531 4.215 1.00 1.65 C ATOM 194 NZ LYS A 12 -3.169 -5.970 5.603 1.00 2.26 N ATOM 195 H LYS A 12 0.372 -3.991 1.358 1.00 0.16 H ATOM 196 HA LYS A 12 -2.298 -4.189 1.583 1.00 0.24 H ATOM 197 HB2 LYS A 12 -0.912 -4.737 3.430 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.274 -3.106 3.534 1.00 0.33 H ATOM 199 HG2 LYS A 12 -1.845 -3.687 5.344 1.00 0.85 H ATOM 200 HG3 LYS A 12 -2.330 -2.276 4.403 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.270 -3.645 4.797 1.00 1.47 H ATOM 202 HD3 LYS A 12 -3.849 -3.758 3.092 1.00 1.42 H ATOM 203 HE2 LYS A 12 -4.426 -5.946 3.920 1.00 2.23 H ATOM 204 HE3 LYS A 12 -2.702 -5.899 3.553 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -3.861 -5.620 6.235 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -2.273 -5.631 5.886 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -3.161 -6.967 5.653 1.00 2.67 H ATOM 208 N LEU A 13 -1.479 -0.965 1.851 1.00 0.15 N ATOM 209 CA LEU A 13 -1.990 0.397 1.688 1.00 0.15 C ATOM 210 C LEU A 13 -2.646 0.546 0.315 1.00 0.13 C ATOM 211 O LEU A 13 -3.663 1.225 0.170 1.00 0.15 O ATOM 212 CB LEU A 13 -0.833 1.404 1.855 1.00 0.20 C ATOM 213 CG LEU A 13 -1.210 2.869 2.164 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.937 3.529 1.005 1.00 0.35 C ATOM 215 CD2 LEU A 13 -2.046 2.952 3.431 1.00 0.38 C ATOM 216 H LEU A 13 -0.519 -1.088 2.039 1.00 0.19 H ATOM 217 HA LEU A 13 -2.733 0.572 2.453 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.203 1.052 2.657 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.254 1.396 0.946 1.00 0.21 H ATOM 220 HG LEU A 13 -0.302 3.429 2.331 1.00 0.30 H ATOM 221 HD11 LEU A 13 -2.222 4.534 1.283 1.00 1.08 H ATOM 222 HD12 LEU A 13 -2.822 2.957 0.765 1.00 1.08 H ATOM 223 HD13 LEU A 13 -1.286 3.565 0.144 1.00 1.09 H ATOM 224 HD21 LEU A 13 -2.251 3.988 3.660 1.00 1.09 H ATOM 225 HD22 LEU A 13 -1.505 2.502 4.250 1.00 1.09 H ATOM 226 HD23 LEU A 13 -2.977 2.426 3.283 1.00 1.10 H ATOM 227 N GLY A 14 -2.074 -0.120 -0.679 1.00 0.18 N ATOM 228 CA GLY A 14 -2.620 -0.088 -2.022 1.00 0.23 C ATOM 229 C GLY A 14 -4.044 -0.601 -2.072 1.00 0.22 C ATOM 230 O GLY A 14 -4.846 -0.137 -2.877 1.00 0.29 O ATOM 231 H GLY A 14 -1.279 -0.663 -0.493 1.00 0.22 H ATOM 232 HA2 GLY A 14 -2.600 0.929 -2.385 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.005 -0.701 -2.664 1.00 0.29 H ATOM 234 N LEU A 15 -4.360 -1.554 -1.209 1.00 0.22 N ATOM 235 CA LEU A 15 -5.715 -2.068 -1.108 1.00 0.29 C ATOM 236 C LEU A 15 -6.556 -1.169 -0.210 1.00 0.28 C ATOM 237 O LEU A 15 -7.750 -1.001 -0.434 1.00 0.39 O ATOM 238 CB LEU A 15 -5.728 -3.504 -0.570 1.00 0.35 C ATOM 239 CG LEU A 15 -5.244 -4.597 -1.536 1.00 0.41 C ATOM 240 CD1 LEU A 15 -5.981 -4.512 -2.864 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.743 -4.517 -1.752 1.00 0.39 C ATOM 242 H LEU A 15 -3.663 -1.924 -0.626 1.00 0.22 H ATOM 243 HA LEU A 15 -6.144 -2.061 -2.099 1.00 0.36 H ATOM 244 HB2 LEU A 15 -5.104 -3.536 0.312 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.740 -3.737 -0.277 1.00 0.41 H ATOM 246 HG LEU A 15 -5.465 -5.562 -1.104 1.00 0.51 H ATOM 247 HD11 LEU A 15 -5.746 -3.576 -3.349 1.00 1.13 H ATOM 248 HD12 LEU A 15 -7.044 -4.570 -2.691 1.00 1.16 H ATOM 249 HD13 LEU A 15 -5.674 -5.331 -3.498 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.487 -3.547 -2.151 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.438 -5.284 -2.447 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.235 -4.663 -0.809 1.00 1.10 H ATOM 253 N LYS A 16 -5.920 -0.596 0.809 1.00 0.21 N ATOM 254 CA LYS A 16 -6.586 0.338 1.711 1.00 0.28 C ATOM 255 C LYS A 16 -7.064 1.579 0.962 1.00 0.34 C ATOM 256 O LYS A 16 -8.106 2.145 1.278 1.00 0.46 O ATOM 257 CB LYS A 16 -5.638 0.757 2.837 1.00 0.34 C ATOM 258 CG LYS A 16 -5.114 -0.411 3.654 1.00 0.39 C ATOM 259 CD LYS A 16 -4.190 0.039 4.779 1.00 1.31 C ATOM 260 CE LYS A 16 -4.864 1.029 5.720 1.00 1.54 C ATOM 261 NZ LYS A 16 -6.071 0.458 6.376 1.00 2.08 N ATOM 262 H LYS A 16 -4.978 -0.826 0.973 1.00 0.18 H ATOM 263 HA LYS A 16 -7.441 -0.163 2.140 1.00 0.35 H ATOM 264 HB2 LYS A 16 -4.794 1.276 2.407 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.162 1.427 3.501 1.00 0.43 H ATOM 266 HG2 LYS A 16 -5.947 -0.939 4.075 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.566 -1.073 2.999 1.00 0.78 H ATOM 268 HD2 LYS A 16 -3.889 -0.827 5.348 1.00 2.01 H ATOM 269 HD3 LYS A 16 -3.317 0.505 4.347 1.00 1.98 H ATOM 270 HE2 LYS A 16 -4.156 1.315 6.483 1.00 2.03 H ATOM 271 HE3 LYS A 16 -5.150 1.902 5.154 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -6.753 0.208 5.689 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -6.476 1.128 6.996 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -5.825 -0.357 6.901 1.00 2.48 H ATOM 275 N MET A 17 -6.287 2.010 -0.015 1.00 0.37 N ATOM 276 CA MET A 17 -6.650 3.172 -0.813 1.00 0.49 C ATOM 277 C MET A 17 -7.628 2.768 -1.903 1.00 0.55 C ATOM 278 O MET A 17 -8.533 3.519 -2.265 1.00 0.66 O ATOM 279 CB MET A 17 -5.387 3.818 -1.397 1.00 0.60 C ATOM 280 CG MET A 17 -4.702 3.045 -2.518 1.00 0.69 C ATOM 281 SD MET A 17 -5.410 3.373 -4.145 1.00 1.70 S ATOM 282 CE MET A 17 -4.340 2.373 -5.181 1.00 2.33 C ATOM 283 H MET A 17 -5.439 1.546 -0.195 1.00 0.37 H ATOM 284 HA MET A 17 -7.136 3.880 -0.159 1.00 0.54 H ATOM 285 HB2 MET A 17 -5.636 4.798 -1.768 1.00 1.19 H ATOM 286 HB3 MET A 17 -4.680 3.919 -0.597 1.00 1.22 H ATOM 287 HG2 MET A 17 -3.656 3.316 -2.536 1.00 1.19 H ATOM 288 HG3 MET A 17 -4.791 1.988 -2.310 1.00 1.28 H ATOM 289 HE1 MET A 17 -4.656 2.457 -6.210 1.00 2.74 H ATOM 290 HE2 MET A 17 -4.399 1.342 -4.869 1.00 2.78 H ATOM 291 HE3 MET A 17 -3.323 2.721 -5.087 1.00 2.74 H ATOM 292 N ALA A 18 -7.448 1.562 -2.397 1.00 0.57 N ATOM 293 CA ALA A 18 -8.301 1.025 -3.450 1.00 0.70 C ATOM 294 C ALA A 18 -9.418 0.150 -2.886 1.00 0.79 C ATOM 295 O ALA A 18 -9.874 -0.780 -3.552 1.00 1.34 O ATOM 296 CB ALA A 18 -7.471 0.238 -4.449 1.00 0.81 C ATOM 297 H ALA A 18 -6.698 1.025 -2.058 1.00 0.58 H ATOM 298 HA ALA A 18 -8.746 1.860 -3.971 1.00 0.78 H ATOM 299 HB1 ALA A 18 -7.013 -0.604 -3.951 1.00 1.33 H ATOM 300 HB2 ALA A 18 -6.703 0.875 -4.861 1.00 1.31 H ATOM 301 HB3 ALA A 18 -8.109 -0.119 -5.243 1.00 1.33 H ATOM 302 N LEU A 19 -9.840 0.435 -1.656 1.00 0.75 N ATOM 303 CA LEU A 19 -10.972 -0.260 -1.045 1.00 0.82 C ATOM 304 C LEU A 19 -12.198 -0.183 -1.947 1.00 1.31 C ATOM 305 O LEU A 19 -12.769 0.921 -2.080 1.00 1.89 O ATOM 306 CB LEU A 19 -11.313 0.337 0.324 1.00 1.07 C ATOM 307 CG LEU A 19 -10.331 0.021 1.455 1.00 1.32 C ATOM 308 CD1 LEU A 19 -10.719 0.777 2.715 1.00 2.07 C ATOM 309 CD2 LEU A 19 -10.290 -1.475 1.732 1.00 1.78 C ATOM 310 OXT LEU A 19 -12.587 -1.223 -2.516 1.00 1.90 O ATOM 311 H LEU A 19 -9.364 1.114 -1.137 1.00 1.05 H ATOM 312 HA LEU A 19 -10.695 -1.296 -0.919 1.00 0.82 H ATOM 313 HB2 LEU A 19 -11.365 1.410 0.217 1.00 1.70 H ATOM 314 HB3 LEU A 19 -12.287 -0.024 0.615 1.00 1.39 H ATOM 315 HG LEU A 19 -9.340 0.338 1.165 1.00 1.78 H ATOM 316 HD11 LEU A 19 -11.709 0.476 3.026 1.00 2.52 H ATOM 317 HD12 LEU A 19 -10.713 1.838 2.514 1.00 2.57 H ATOM 318 HD13 LEU A 19 -10.012 0.555 3.499 1.00 2.47 H ATOM 319 HD21 LEU A 19 -9.620 -1.669 2.556 1.00 2.23 H ATOM 320 HD22 LEU A 19 -9.939 -1.994 0.854 1.00 2.18 H ATOM 321 HD23 LEU A 19 -11.281 -1.822 1.984 1.00 2.26 H TER 322 LEU A 19 ENDMDL MODEL 15 ATOM 1 N GLY A 1 8.201 7.229 3.596 1.00 1.26 N ATOM 2 CA GLY A 1 7.288 7.111 2.434 1.00 0.47 C ATOM 3 C GLY A 1 6.377 5.906 2.542 1.00 0.35 C ATOM 4 O GLY A 1 6.837 4.763 2.508 1.00 0.42 O ATOM 5 H1 GLY A 1 7.672 7.314 4.441 1.00 1.79 H ATOM 6 H2 GLY A 1 8.782 8.035 3.497 1.00 1.72 H ATOM 7 H3 GLY A 1 8.783 6.419 3.658 1.00 1.76 H ATOM 8 HA2 GLY A 1 6.683 8.003 2.375 1.00 0.89 H ATOM 9 HA3 GLY A 1 7.876 7.026 1.533 1.00 0.90 H ATOM 10 N ILE A 2 5.081 6.148 2.677 1.00 0.27 N ATOM 11 CA ILE A 2 4.127 5.058 2.787 1.00 0.21 C ATOM 12 C ILE A 2 3.802 4.491 1.417 1.00 0.14 C ATOM 13 O ILE A 2 3.494 3.310 1.277 1.00 0.22 O ATOM 14 CB ILE A 2 2.820 5.484 3.485 1.00 0.27 C ATOM 15 CG1 ILE A 2 1.940 4.260 3.705 1.00 0.31 C ATOM 16 CG2 ILE A 2 2.071 6.519 2.660 1.00 0.33 C ATOM 17 CD1 ILE A 2 0.982 4.407 4.860 1.00 0.77 C ATOM 18 H ILE A 2 4.762 7.077 2.708 1.00 0.31 H ATOM 19 HA ILE A 2 4.581 4.280 3.384 1.00 0.27 H ATOM 20 HB ILE A 2 3.067 5.922 4.438 1.00 0.34 H ATOM 21 HG12 ILE A 2 1.358 4.081 2.813 1.00 0.63 H ATOM 22 HG13 ILE A 2 2.568 3.404 3.890 1.00 0.74 H ATOM 23 HG21 ILE A 2 1.192 6.840 3.197 1.00 1.04 H ATOM 24 HG22 ILE A 2 1.773 6.076 1.719 1.00 1.10 H ATOM 25 HG23 ILE A 2 2.711 7.366 2.474 1.00 1.08 H ATOM 26 HD11 ILE A 2 1.541 4.592 5.763 1.00 1.38 H ATOM 27 HD12 ILE A 2 0.410 3.499 4.969 1.00 1.38 H ATOM 28 HD13 ILE A 2 0.316 5.235 4.673 1.00 1.42 H ATOM 29 N VAL A 3 3.893 5.325 0.398 1.00 0.14 N ATOM 30 CA VAL A 3 3.546 4.889 -0.937 1.00 0.20 C ATOM 31 C VAL A 3 4.563 3.871 -1.454 1.00 0.16 C ATOM 32 O VAL A 3 4.218 2.965 -2.204 1.00 0.19 O ATOM 33 CB VAL A 3 3.427 6.075 -1.925 1.00 0.33 C ATOM 34 CG1 VAL A 3 4.697 6.907 -1.927 1.00 0.92 C ATOM 35 CG2 VAL A 3 3.108 5.582 -3.331 1.00 0.94 C ATOM 36 H VAL A 3 4.192 6.246 0.550 1.00 0.20 H ATOM 37 HA VAL A 3 2.577 4.408 -0.861 1.00 0.25 H ATOM 38 HB VAL A 3 2.614 6.706 -1.597 1.00 0.65 H ATOM 39 HG11 VAL A 3 4.864 7.312 -0.940 1.00 1.51 H ATOM 40 HG12 VAL A 3 4.598 7.716 -2.636 1.00 1.51 H ATOM 41 HG13 VAL A 3 5.534 6.284 -2.206 1.00 1.49 H ATOM 42 HG21 VAL A 3 2.144 5.098 -3.333 1.00 1.54 H ATOM 43 HG22 VAL A 3 3.867 4.875 -3.645 1.00 1.49 H ATOM 44 HG23 VAL A 3 3.094 6.419 -4.013 1.00 1.53 H ATOM 45 N THR A 4 5.813 4.006 -1.028 1.00 0.17 N ATOM 46 CA THR A 4 6.850 3.072 -1.428 1.00 0.21 C ATOM 47 C THR A 4 6.638 1.712 -0.766 1.00 0.18 C ATOM 48 O THR A 4 6.878 0.663 -1.383 1.00 0.21 O ATOM 49 CB THR A 4 8.246 3.624 -1.098 1.00 0.32 C ATOM 50 OG1 THR A 4 8.203 4.327 0.148 1.00 0.63 O ATOM 51 CG2 THR A 4 8.730 4.558 -2.195 1.00 0.66 C ATOM 52 H THR A 4 6.044 4.748 -0.431 1.00 0.21 H ATOM 53 HA THR A 4 6.781 2.944 -2.502 1.00 0.24 H ATOM 54 HB THR A 4 8.936 2.797 -1.014 1.00 0.54 H ATOM 55 HG1 THR A 4 8.574 3.770 0.843 1.00 1.24 H ATOM 56 HG21 THR A 4 8.812 4.011 -3.124 1.00 1.24 H ATOM 57 HG22 THR A 4 9.696 4.959 -1.928 1.00 1.30 H ATOM 58 HG23 THR A 4 8.025 5.366 -2.315 1.00 1.28 H ATOM 59 N LYS A 5 6.173 1.715 0.485 1.00 0.18 N ATOM 60 CA LYS A 5 5.772 0.483 1.113 1.00 0.27 C ATOM 61 C LYS A 5 4.579 -0.083 0.347 1.00 0.21 C ATOM 62 O LYS A 5 4.559 -1.260 -0.002 1.00 0.22 O ATOM 63 CB LYS A 5 5.459 0.701 2.604 1.00 0.46 C ATOM 64 CG LYS A 5 3.992 0.949 2.951 1.00 0.94 C ATOM 65 CD LYS A 5 3.695 0.599 4.403 1.00 0.90 C ATOM 66 CE LYS A 5 2.200 0.582 4.698 1.00 0.81 C ATOM 67 NZ LYS A 5 1.931 0.339 6.140 1.00 1.23 N ATOM 68 H LYS A 5 6.120 2.550 0.994 1.00 0.19 H ATOM 69 HA LYS A 5 6.595 -0.210 1.023 1.00 0.37 H ATOM 70 HB2 LYS A 5 5.789 -0.159 3.143 1.00 1.25 H ATOM 71 HB3 LYS A 5 6.027 1.555 2.945 1.00 1.15 H ATOM 72 HG2 LYS A 5 3.772 1.996 2.796 1.00 1.72 H ATOM 73 HG3 LYS A 5 3.366 0.355 2.306 1.00 1.75 H ATOM 74 HD2 LYS A 5 4.102 -0.378 4.614 1.00 1.31 H ATOM 75 HD3 LYS A 5 4.170 1.331 5.040 1.00 1.33 H ATOM 76 HE2 LYS A 5 1.776 1.534 4.418 1.00 1.09 H ATOM 77 HE3 LYS A 5 1.732 -0.206 4.118 1.00 0.97 H ATOM 78 HZ1 LYS A 5 2.308 1.085 6.691 1.00 1.66 H ATOM 79 HZ2 LYS A 5 2.355 -0.518 6.430 1.00 1.71 H ATOM 80 HZ3 LYS A 5 0.947 0.280 6.302 1.00 1.67 H ATOM 81 N LEU A 6 3.632 0.800 0.020 1.00 0.21 N ATOM 82 CA LEU A 6 2.442 0.457 -0.759 1.00 0.25 C ATOM 83 C LEU A 6 2.811 -0.214 -2.081 1.00 0.21 C ATOM 84 O LEU A 6 1.982 -0.865 -2.713 1.00 0.26 O ATOM 85 CB LEU A 6 1.615 1.732 -0.993 1.00 0.36 C ATOM 86 CG LEU A 6 0.569 1.691 -2.113 1.00 0.58 C ATOM 87 CD1 LEU A 6 -0.585 2.609 -1.772 1.00 1.15 C ATOM 88 CD2 LEU A 6 1.179 2.117 -3.440 1.00 1.21 C ATOM 89 H LEU A 6 3.738 1.729 0.322 1.00 0.22 H ATOM 90 HA LEU A 6 1.852 -0.234 -0.176 1.00 0.32 H ATOM 91 HB2 LEU A 6 1.103 1.966 -0.074 1.00 0.76 H ATOM 92 HB3 LEU A 6 2.302 2.535 -1.209 1.00 0.85 H ATOM 93 HG LEU A 6 0.188 0.684 -2.217 1.00 1.34 H ATOM 94 HD11 LEU A 6 -0.211 3.606 -1.595 1.00 1.71 H ATOM 95 HD12 LEU A 6 -1.081 2.246 -0.884 1.00 1.71 H ATOM 96 HD13 LEU A 6 -1.285 2.626 -2.593 1.00 1.70 H ATOM 97 HD21 LEU A 6 0.424 2.083 -4.210 1.00 1.76 H ATOM 98 HD22 LEU A 6 1.988 1.448 -3.694 1.00 1.73 H ATOM 99 HD23 LEU A 6 1.559 3.123 -3.351 1.00 1.81 H ATOM 100 N ILE A 7 4.050 -0.044 -2.500 1.00 0.16 N ATOM 101 CA ILE A 7 4.516 -0.658 -3.721 1.00 0.18 C ATOM 102 C ILE A 7 4.655 -2.174 -3.561 1.00 0.16 C ATOM 103 O ILE A 7 3.891 -2.929 -4.161 1.00 0.19 O ATOM 104 CB ILE A 7 5.848 -0.038 -4.187 1.00 0.21 C ATOM 105 CG1 ILE A 7 5.677 1.471 -4.376 1.00 0.24 C ATOM 106 CG2 ILE A 7 6.325 -0.686 -5.479 1.00 0.27 C ATOM 107 CD1 ILE A 7 4.664 1.854 -5.431 1.00 1.07 C ATOM 108 H ILE A 7 4.662 0.511 -1.974 1.00 0.16 H ATOM 109 HA ILE A 7 3.779 -0.461 -4.483 1.00 0.23 H ATOM 110 HB ILE A 7 6.590 -0.216 -3.427 1.00 0.20 H ATOM 111 HG12 ILE A 7 5.353 1.903 -3.442 1.00 0.88 H ATOM 112 HG13 ILE A 7 6.622 1.902 -4.653 1.00 0.79 H ATOM 113 HG21 ILE A 7 6.485 -1.741 -5.317 1.00 1.06 H ATOM 114 HG22 ILE A 7 7.251 -0.223 -5.790 1.00 1.06 H ATOM 115 HG23 ILE A 7 5.580 -0.548 -6.248 1.00 1.06 H ATOM 116 HD11 ILE A 7 4.960 1.439 -6.383 1.00 1.67 H ATOM 117 HD12 ILE A 7 4.617 2.930 -5.507 1.00 1.67 H ATOM 118 HD13 ILE A 7 3.693 1.470 -5.155 1.00 1.64 H ATOM 119 N LYS A 8 5.613 -2.633 -2.754 1.00 0.13 N ATOM 120 CA LYS A 8 5.890 -4.077 -2.706 1.00 0.12 C ATOM 121 C LYS A 8 5.138 -4.808 -1.593 1.00 0.11 C ATOM 122 O LYS A 8 4.157 -5.505 -1.841 1.00 0.13 O ATOM 123 CB LYS A 8 7.381 -4.363 -2.514 1.00 0.17 C ATOM 124 CG LYS A 8 8.312 -3.538 -3.389 1.00 0.49 C ATOM 125 CD LYS A 8 8.653 -2.202 -2.750 1.00 0.78 C ATOM 126 CE LYS A 8 9.595 -1.398 -3.627 1.00 0.98 C ATOM 127 NZ LYS A 8 10.902 -2.084 -3.827 1.00 1.70 N ATOM 128 H LYS A 8 6.121 -2.005 -2.184 1.00 0.13 H ATOM 129 HA LYS A 8 5.580 -4.493 -3.651 1.00 0.14 H ATOM 130 HB2 LYS A 8 7.631 -4.180 -1.480 1.00 0.45 H ATOM 131 HB3 LYS A 8 7.554 -5.407 -2.730 1.00 0.49 H ATOM 132 HG2 LYS A 8 9.224 -4.092 -3.544 1.00 0.70 H ATOM 133 HG3 LYS A 8 7.832 -3.360 -4.339 1.00 0.87 H ATOM 134 HD2 LYS A 8 7.745 -1.641 -2.601 1.00 1.28 H ATOM 135 HD3 LYS A 8 9.129 -2.382 -1.798 1.00 1.16 H ATOM 136 HE2 LYS A 8 9.129 -1.247 -4.589 1.00 1.43 H ATOM 137 HE3 LYS A 8 9.770 -0.440 -3.161 1.00 1.50 H ATOM 138 HZ1 LYS A 8 11.409 -2.116 -2.964 1.00 2.17 H ATOM 139 HZ2 LYS A 8 11.450 -1.593 -4.503 1.00 2.16 H ATOM 140 HZ3 LYS A 8 10.757 -3.019 -4.152 1.00 2.17 H ATOM 141 N LYS A 9 5.620 -4.650 -0.367 1.00 0.12 N ATOM 142 CA LYS A 9 5.134 -5.445 0.758 1.00 0.14 C ATOM 143 C LYS A 9 4.033 -4.704 1.500 1.00 0.13 C ATOM 144 O LYS A 9 3.031 -5.285 1.927 1.00 0.17 O ATOM 145 CB LYS A 9 6.287 -5.789 1.706 1.00 0.21 C ATOM 146 CG LYS A 9 7.482 -6.423 1.008 1.00 0.84 C ATOM 147 CD LYS A 9 7.094 -7.700 0.280 1.00 1.34 C ATOM 148 CE LYS A 9 8.277 -8.305 -0.460 1.00 2.00 C ATOM 149 NZ LYS A 9 7.907 -9.564 -1.155 1.00 2.66 N ATOM 150 H LYS A 9 6.310 -3.970 -0.210 1.00 0.13 H ATOM 151 HA LYS A 9 4.732 -6.356 0.354 1.00 0.16 H ATOM 152 HB2 LYS A 9 6.620 -4.885 2.192 1.00 0.63 H ATOM 153 HB3 LYS A 9 5.928 -6.477 2.455 1.00 0.64 H ATOM 154 HG2 LYS A 9 7.881 -5.721 0.292 1.00 1.45 H ATOM 155 HG3 LYS A 9 8.235 -6.655 1.746 1.00 1.47 H ATOM 156 HD2 LYS A 9 6.731 -8.416 0.998 1.00 1.78 H ATOM 157 HD3 LYS A 9 6.314 -7.474 -0.433 1.00 1.82 H ATOM 158 HE2 LYS A 9 8.630 -7.592 -1.190 1.00 2.46 H ATOM 159 HE3 LYS A 9 9.062 -8.511 0.251 1.00 2.44 H ATOM 160 HZ1 LYS A 9 7.619 -10.254 -0.489 1.00 3.04 H ATOM 161 HZ2 LYS A 9 8.687 -9.918 -1.668 1.00 3.03 H ATOM 162 HZ3 LYS A 9 7.154 -9.397 -1.793 1.00 3.05 H ATOM 163 N GLY A 10 4.257 -3.412 1.636 1.00 0.14 N ATOM 164 CA GLY A 10 3.302 -2.489 2.214 1.00 0.17 C ATOM 165 C GLY A 10 2.025 -2.404 1.413 1.00 0.16 C ATOM 166 O GLY A 10 1.055 -1.808 1.871 1.00 0.20 O ATOM 167 H GLY A 10 5.115 -3.054 1.316 1.00 0.15 H ATOM 168 HA2 GLY A 10 3.067 -2.809 3.218 1.00 0.21 H ATOM 169 HA3 GLY A 10 3.751 -1.511 2.254 1.00 0.21 H ATOM 170 N VAL A 11 2.099 -2.904 0.168 1.00 0.14 N ATOM 171 CA VAL A 11 1.022 -2.857 -0.838 1.00 0.16 C ATOM 172 C VAL A 11 -0.393 -3.031 -0.260 1.00 0.16 C ATOM 173 O VAL A 11 -1.376 -2.659 -0.898 1.00 0.18 O ATOM 174 CB VAL A 11 1.267 -3.935 -1.917 1.00 0.18 C ATOM 175 CG1 VAL A 11 1.070 -5.332 -1.350 1.00 0.20 C ATOM 176 CG2 VAL A 11 0.376 -3.705 -3.123 1.00 0.23 C ATOM 177 H VAL A 11 2.943 -3.324 -0.096 1.00 0.14 H ATOM 178 HA VAL A 11 1.076 -1.897 -1.322 1.00 0.19 H ATOM 179 HB VAL A 11 2.297 -3.853 -2.242 1.00 0.19 H ATOM 180 HG11 VAL A 11 1.200 -6.061 -2.135 1.00 1.03 H ATOM 181 HG12 VAL A 11 0.074 -5.416 -0.940 1.00 1.04 H ATOM 182 HG13 VAL A 11 1.796 -5.509 -0.570 1.00 1.04 H ATOM 183 HG21 VAL A 11 0.592 -4.448 -3.877 1.00 1.06 H ATOM 184 HG22 VAL A 11 0.561 -2.720 -3.522 1.00 1.04 H ATOM 185 HG23 VAL A 11 -0.657 -3.785 -2.822 1.00 1.04 H ATOM 186 N LYS A 12 -0.488 -3.611 0.926 1.00 0.16 N ATOM 187 CA LYS A 12 -1.715 -3.594 1.715 1.00 0.19 C ATOM 188 C LYS A 12 -2.378 -2.204 1.681 1.00 0.15 C ATOM 189 O LYS A 12 -3.598 -2.093 1.550 1.00 0.14 O ATOM 190 CB LYS A 12 -1.378 -3.977 3.161 1.00 0.27 C ATOM 191 CG LYS A 12 -2.546 -3.858 4.123 1.00 0.46 C ATOM 192 CD LYS A 12 -3.695 -4.779 3.735 1.00 0.97 C ATOM 193 CE LYS A 12 -3.292 -6.246 3.799 1.00 1.65 C ATOM 194 NZ LYS A 12 -4.408 -7.148 3.416 1.00 2.26 N ATOM 195 H LYS A 12 0.296 -4.072 1.282 1.00 0.16 H ATOM 196 HA LYS A 12 -2.395 -4.322 1.303 1.00 0.24 H ATOM 197 HB2 LYS A 12 -1.031 -4.999 3.176 1.00 0.34 H ATOM 198 HB3 LYS A 12 -0.585 -3.334 3.512 1.00 0.33 H ATOM 199 HG2 LYS A 12 -2.210 -4.118 5.115 1.00 0.85 H ATOM 200 HG3 LYS A 12 -2.893 -2.831 4.115 1.00 0.95 H ATOM 201 HD2 LYS A 12 -4.517 -4.616 4.412 1.00 1.47 H ATOM 202 HD3 LYS A 12 -4.006 -4.545 2.727 1.00 1.42 H ATOM 203 HE2 LYS A 12 -2.464 -6.409 3.124 1.00 2.23 H ATOM 204 HE3 LYS A 12 -2.982 -6.477 4.808 1.00 2.14 H ATOM 205 HZ1 LYS A 12 -4.666 -6.992 2.462 1.00 2.61 H ATOM 206 HZ2 LYS A 12 -5.204 -6.979 3.994 1.00 2.66 H ATOM 207 HZ3 LYS A 12 -4.131 -8.104 3.523 1.00 2.67 H ATOM 208 N LEU A 13 -1.557 -1.153 1.772 1.00 0.15 N ATOM 209 CA LEU A 13 -2.035 0.227 1.747 1.00 0.15 C ATOM 210 C LEU A 13 -2.746 0.510 0.420 1.00 0.13 C ATOM 211 O LEU A 13 -3.719 1.259 0.371 1.00 0.15 O ATOM 212 CB LEU A 13 -0.834 1.175 1.937 1.00 0.20 C ATOM 213 CG LEU A 13 -1.121 2.590 2.473 1.00 0.29 C ATOM 214 CD1 LEU A 13 -1.923 3.427 1.492 1.00 0.35 C ATOM 215 CD2 LEU A 13 -1.832 2.520 3.814 1.00 0.38 C ATOM 216 H LEU A 13 -0.588 -1.312 1.858 1.00 0.19 H ATOM 217 HA LEU A 13 -2.735 0.357 2.563 1.00 0.16 H ATOM 218 HB2 LEU A 13 -0.145 0.700 2.619 1.00 0.25 H ATOM 219 HB3 LEU A 13 -0.340 1.279 0.984 1.00 0.21 H ATOM 220 HG LEU A 13 -0.177 3.094 2.625 1.00 0.30 H ATOM 221 HD11 LEU A 13 -1.349 3.574 0.591 1.00 1.08 H ATOM 222 HD12 LEU A 13 -2.149 4.385 1.937 1.00 1.08 H ATOM 223 HD13 LEU A 13 -2.844 2.916 1.253 1.00 1.09 H ATOM 224 HD21 LEU A 13 -1.241 1.938 4.505 1.00 1.09 H ATOM 225 HD22 LEU A 13 -2.799 2.057 3.687 1.00 1.09 H ATOM 226 HD23 LEU A 13 -1.961 3.518 4.206 1.00 1.10 H ATOM 227 N GLY A 14 -2.268 -0.121 -0.646 1.00 0.18 N ATOM 228 CA GLY A 14 -2.857 0.068 -1.957 1.00 0.23 C ATOM 229 C GLY A 14 -4.286 -0.418 -2.010 1.00 0.22 C ATOM 230 O GLY A 14 -5.137 0.190 -2.661 1.00 0.29 O ATOM 231 H GLY A 14 -1.515 -0.741 -0.538 1.00 0.22 H ATOM 232 HA2 GLY A 14 -2.834 1.119 -2.205 1.00 0.26 H ATOM 233 HA3 GLY A 14 -2.275 -0.478 -2.686 1.00 0.29 H ATOM 234 N LEU A 15 -4.553 -1.505 -1.302 1.00 0.22 N ATOM 235 CA LEU A 15 -5.897 -2.047 -1.213 1.00 0.29 C ATOM 236 C LEU A 15 -6.728 -1.217 -0.246 1.00 0.28 C ATOM 237 O LEU A 15 -7.944 -1.121 -0.384 1.00 0.39 O ATOM 238 CB LEU A 15 -5.874 -3.515 -0.767 1.00 0.35 C ATOM 239 CG LEU A 15 -5.370 -4.530 -1.806 1.00 0.41 C ATOM 240 CD1 LEU A 15 -6.145 -4.406 -3.107 1.00 0.51 C ATOM 241 CD2 LEU A 15 -3.878 -4.371 -2.056 1.00 0.39 C ATOM 242 H LEU A 15 -3.824 -1.955 -0.824 1.00 0.22 H ATOM 243 HA LEU A 15 -6.343 -1.983 -2.193 1.00 0.36 H ATOM 244 HB2 LEU A 15 -5.245 -3.589 0.107 1.00 0.36 H ATOM 245 HB3 LEU A 15 -6.878 -3.793 -0.487 1.00 0.41 H ATOM 246 HG LEU A 15 -5.536 -5.526 -1.422 1.00 0.51 H ATOM 247 HD11 LEU A 15 -7.199 -4.545 -2.915 1.00 1.13 H ATOM 248 HD12 LEU A 15 -5.804 -5.160 -3.802 1.00 1.16 H ATOM 249 HD13 LEU A 15 -5.984 -3.427 -3.533 1.00 1.18 H ATOM 250 HD21 LEU A 15 -3.559 -5.088 -2.799 1.00 1.08 H ATOM 251 HD22 LEU A 15 -3.337 -4.541 -1.137 1.00 1.09 H ATOM 252 HD23 LEU A 15 -3.678 -3.372 -2.413 1.00 1.10 H ATOM 253 N LYS A 16 -6.063 -0.620 0.739 1.00 0.21 N ATOM 254 CA LYS A 16 -6.717 0.319 1.639 1.00 0.28 C ATOM 255 C LYS A 16 -7.190 1.546 0.869 1.00 0.34 C ATOM 256 O LYS A 16 -8.212 2.149 1.203 1.00 0.46 O ATOM 257 CB LYS A 16 -5.767 0.750 2.761 1.00 0.34 C ATOM 258 CG LYS A 16 -5.320 -0.391 3.658 1.00 0.39 C ATOM 259 CD LYS A 16 -4.632 0.128 4.909 1.00 1.31 C ATOM 260 CE LYS A 16 -4.518 -0.948 5.977 1.00 1.54 C ATOM 261 NZ LYS A 16 -5.846 -1.333 6.525 1.00 2.08 N ATOM 262 H LYS A 16 -5.114 -0.831 0.874 1.00 0.18 H ATOM 263 HA LYS A 16 -7.573 -0.176 2.071 1.00 0.35 H ATOM 264 HB2 LYS A 16 -4.890 1.197 2.321 1.00 0.36 H ATOM 265 HB3 LYS A 16 -6.266 1.486 3.374 1.00 0.43 H ATOM 266 HG2 LYS A 16 -6.178 -0.970 3.939 1.00 0.77 H ATOM 267 HG3 LYS A 16 -4.628 -1.017 3.111 1.00 0.78 H ATOM 268 HD2 LYS A 16 -3.640 0.463 4.649 1.00 2.01 H ATOM 269 HD3 LYS A 16 -5.201 0.955 5.305 1.00 1.98 H ATOM 270 HE2 LYS A 16 -4.052 -1.821 5.545 1.00 2.03 H ATOM 271 HE3 LYS A 16 -3.901 -0.574 6.781 1.00 2.00 H ATOM 272 HZ1 LYS A 16 -6.326 -0.523 6.861 1.00 2.39 H ATOM 273 HZ2 LYS A 16 -5.734 -1.974 7.282 1.00 2.51 H ATOM 274 HZ3 LYS A 16 -6.401 -1.769 5.815 1.00 2.48 H ATOM 275 N MET A 17 -6.434 1.913 -0.159 1.00 0.37 N ATOM 276 CA MET A 17 -6.790 3.041 -1.008 1.00 0.49 C ATOM 277 C MET A 17 -7.907 2.657 -1.970 1.00 0.55 C ATOM 278 O MET A 17 -8.876 3.396 -2.135 1.00 0.66 O ATOM 279 CB MET A 17 -5.580 3.538 -1.808 1.00 0.60 C ATOM 280 CG MET A 17 -4.432 4.051 -0.954 1.00 0.69 C ATOM 281 SD MET A 17 -3.199 4.943 -1.922 1.00 1.70 S ATOM 282 CE MET A 17 -4.153 6.358 -2.471 1.00 2.33 C ATOM 283 H MET A 17 -5.608 1.415 -0.343 1.00 0.37 H ATOM 284 HA MET A 17 -7.141 3.837 -0.370 1.00 0.54 H ATOM 285 HB2 MET A 17 -5.210 2.726 -2.415 1.00 1.19 H ATOM 286 HB3 MET A 17 -5.902 4.339 -2.456 1.00 1.22 H ATOM 287 HG2 MET A 17 -4.826 4.714 -0.199 1.00 1.19 H ATOM 288 HG3 MET A 17 -3.946 3.208 -0.476 1.00 1.28 H ATOM 289 HE1 MET A 17 -4.979 6.023 -3.080 1.00 2.74 H ATOM 290 HE2 MET A 17 -3.521 7.015 -3.051 1.00 2.78 H ATOM 291 HE3 MET A 17 -4.533 6.892 -1.612 1.00 2.74 H ATOM 292 N ALA A 18 -7.773 1.491 -2.589 1.00 0.57 N ATOM 293 CA ALA A 18 -8.727 1.046 -3.597 1.00 0.70 C ATOM 294 C ALA A 18 -9.755 0.079 -3.011 1.00 0.79 C ATOM 295 O ALA A 18 -10.236 -0.820 -3.700 1.00 1.34 O ATOM 296 CB ALA A 18 -7.992 0.397 -4.761 1.00 0.81 C ATOM 297 H ALA A 18 -7.010 0.915 -2.366 1.00 0.58 H ATOM 298 HA ALA A 18 -9.244 1.917 -3.973 1.00 0.78 H ATOM 299 HB1 ALA A 18 -8.700 0.130 -5.531 1.00 1.33 H ATOM 300 HB2 ALA A 18 -7.484 -0.492 -4.414 1.00 1.31 H ATOM 301 HB3 ALA A 18 -7.268 1.091 -5.161 1.00 1.33 H ATOM 302 N LEU A 19 -10.070 0.252 -1.737 1.00 0.75 N ATOM 303 CA LEU A 19 -11.084 -0.564 -1.086 1.00 0.82 C ATOM 304 C LEU A 19 -12.467 -0.157 -1.588 1.00 1.31 C ATOM 305 O LEU A 19 -12.947 0.927 -1.195 1.00 1.89 O ATOM 306 CB LEU A 19 -10.988 -0.410 0.441 1.00 1.07 C ATOM 307 CG LEU A 19 -11.641 -1.521 1.284 1.00 1.32 C ATOM 308 CD1 LEU A 19 -13.160 -1.474 1.193 1.00 2.07 C ATOM 309 CD2 LEU A 19 -11.129 -2.889 0.855 1.00 1.78 C ATOM 310 OXT LEU A 19 -13.061 -0.912 -2.386 1.00 1.90 O ATOM 311 H LEU A 19 -9.598 0.933 -1.217 1.00 1.05 H ATOM 312 HA LEU A 19 -10.902 -1.593 -1.352 1.00 0.82 H ATOM 313 HB2 LEU A 19 -9.941 -0.361 0.707 1.00 1.70 H ATOM 314 HB3 LEU A 19 -11.448 0.529 0.711 1.00 1.39 H ATOM 315 HG LEU A 19 -11.372 -1.378 2.320 1.00 1.78 H ATOM 316 HD11 LEU A 19 -13.463 -1.603 0.164 1.00 2.52 H ATOM 317 HD12 LEU A 19 -13.514 -0.520 1.555 1.00 2.57 H ATOM 318 HD13 LEU A 19 -13.581 -2.266 1.794 1.00 2.47 H ATOM 319 HD21 LEU A 19 -11.526 -3.644 1.516 1.00 2.23 H ATOM 320 HD22 LEU A 19 -10.050 -2.901 0.900 1.00 2.18 H ATOM 321 HD23 LEU A 19 -11.449 -3.093 -0.155 1.00 2.26 H TER 322 LEU A 19 ENDMDL MASTER 79 0 0 0 0 0 0 6 140 1 0 2 END