HEADER NEUROPEPTIDE 06-AUG-10 SMS20127 TITLE NOCICEPTIN AGONIST COMPND MOL_ID: 1; COMPND 2 MOLECULE: NOCICEPTIN AGONIST; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; SOURCE 4 ORGANISM_TAXID: 32630; SOURCE 5 OTHER_DETAILS: CHEMICAL SYNTHESIS KEYWDS NOCICEPTIN, HELICAL, NEUROPEPTIDE EXPDTA SOLUTION NMR NUMMDL 20 AUTHOR D.P.FAIRLIE,T.A.HILL,R.HARRISON,H.H.HOANG JRNL AUTH D.P.FAIRLIE,T.A.HILL JRNL TITL SOLUTION STRUCTURE OF NOCICEPTIN AGONIST JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 NULL COMPLIES WITH FORMAT V. 3.20, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 21-SEP-10. REMARK 100 THE BMRB ID CODE IS SMS20127. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 288 REMARK 210 PH : 4 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : 4MG NOCICEPTIN AGONIST; 90% H2O/ REMARK 210 10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-1H COSY; 2D 1H-1H NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 100 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LOWEST 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 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 1 PHE A 4 -35.92 -176.04 REMARK 500 2 THR A 5 -113.62 -94.59 REMARK 500 2 LYS A 6 0.70 -65.41 REMARK 500 4 THR A 5 -128.22 -75.15 REMARK 500 5 PHE A 4 -34.64 75.07 REMARK 500 6 PHE A 4 -61.93 -164.02 REMARK 500 7 PHE A 4 51.60 -168.43 REMARK 500 7 THR A 5 -130.18 -95.47 REMARK 500 8 PHE A 4 -45.21 -154.60 REMARK 500 11 PHE A 4 15.24 -148.19 REMARK 500 14 PHE A 4 29.19 -163.12 REMARK 500 17 PHE A 4 -51.99 174.61 REMARK 500 17 THR A 5 -74.66 -74.04 REMARK 500 18 PHE A 4 70.43 -113.44 REMARK 500 20 PHE A 4 -56.31 -174.82 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 20127 RELATED DB: BMRB DBREF A 1 15 BMRB SMS20127 SMS20127 1 15 SEQADV NH2 A 16 BMRB SMS20127 AMIDATION SEQRES 1 A 16 PHE GLY GLY PHE THR LYS ALA ARG LYS ASP LYS ARG LYS SEQRES 2 A 16 LEU ASP NH2 HET NH2 A 16 3 HETNAM NH2 AMINO GROUP FORMUL 1 NH2 H2 N HELIX 1 1 PHE A 4 ASP A 15 1 12 LINK NZ LYS A 6 CG ASP A 10 1555 1555 1.34 LINK NZ LYS A 11 CG ASP A 15 1555 1555 1.34 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 PHE A 1 22.152 10.764 4.596 1.00 0.00 N ATOM 2 CA PHE A 1 21.018 10.327 5.404 1.00 0.00 C ATOM 3 C PHE A 1 20.637 11.386 6.438 1.00 0.00 C ATOM 4 O PHE A 1 21.506 12.038 7.023 1.00 0.00 O ATOM 5 CB PHE A 1 21.331 8.987 6.088 1.00 0.00 C ATOM 6 CG PHE A 1 22.555 9.007 6.967 1.00 0.00 C ATOM 7 CD1 PHE A 1 22.542 9.660 8.191 1.00 0.00 C ATOM 8 CD2 PHE A 1 23.716 8.362 6.571 1.00 0.00 C ATOM 9 CE1 PHE A 1 23.663 9.672 8.998 1.00 0.00 C ATOM 10 CE2 PHE A 1 24.840 8.370 7.376 1.00 0.00 C ATOM 11 CZ PHE A 1 24.813 9.026 8.590 1.00 0.00 C ATOM 12 H1 PHE A 1 21.999 11.382 3.851 1.00 0.00 H ATOM 13 HA PHE A 1 20.181 10.186 4.736 1.00 0.00 H ATOM 14 HB2 PHE A 1 20.490 8.704 6.704 1.00 0.00 H ATOM 15 HB3 PHE A 1 21.480 8.233 5.329 1.00 0.00 H ATOM 16 HD1 PHE A 1 21.643 10.165 8.512 1.00 0.00 H ATOM 17 HD2 PHE A 1 23.740 7.850 5.620 1.00 0.00 H ATOM 18 HE1 PHE A 1 23.640 10.186 9.948 1.00 0.00 H ATOM 19 HE2 PHE A 1 25.737 7.862 7.055 1.00 0.00 H ATOM 20 HZ PHE A 1 25.690 9.034 9.220 1.00 0.00 H ATOM 21 N GLY A 2 19.332 11.558 6.652 1.00 0.00 N ATOM 22 CA GLY A 2 18.853 12.539 7.610 1.00 0.00 C ATOM 23 C GLY A 2 19.129 12.136 9.046 1.00 0.00 C ATOM 24 O GLY A 2 18.780 11.029 9.463 1.00 0.00 O ATOM 25 H GLY A 2 18.687 11.015 6.153 1.00 0.00 H ATOM 26 HA2 GLY A 2 19.338 13.484 7.413 1.00 0.00 H ATOM 27 HA3 GLY A 2 17.788 12.661 7.480 1.00 0.00 H ATOM 28 N GLY A 3 19.752 13.038 9.804 1.00 0.00 N ATOM 29 CA GLY A 3 20.062 12.762 11.198 1.00 0.00 C ATOM 30 C GLY A 3 18.822 12.712 12.074 1.00 0.00 C ATOM 31 O GLY A 3 18.692 11.827 12.921 1.00 0.00 O ATOM 32 H GLY A 3 20.000 13.903 9.414 1.00 0.00 H ATOM 33 HA2 GLY A 3 20.572 11.812 11.260 1.00 0.00 H ATOM 34 HA3 GLY A 3 20.719 13.536 11.568 1.00 0.00 H ATOM 35 N PHE A 4 17.910 13.666 11.864 1.00 0.00 N ATOM 36 CA PHE A 4 16.666 13.738 12.637 1.00 0.00 C ATOM 37 C PHE A 4 15.748 14.861 12.140 1.00 0.00 C ATOM 38 O PHE A 4 14.526 14.703 12.130 1.00 0.00 O ATOM 39 CB PHE A 4 16.961 13.898 14.138 1.00 0.00 C ATOM 40 CG PHE A 4 17.929 15.001 14.476 1.00 0.00 C ATOM 41 CD1 PHE A 4 17.538 16.330 14.433 1.00 0.00 C ATOM 42 CD2 PHE A 4 19.229 14.703 14.854 1.00 0.00 C ATOM 43 CE1 PHE A 4 18.426 17.339 14.755 1.00 0.00 C ATOM 44 CE2 PHE A 4 20.120 15.707 15.178 1.00 0.00 C ATOM 45 CZ PHE A 4 19.718 17.027 15.128 1.00 0.00 C ATOM 46 H PHE A 4 18.079 14.336 11.169 1.00 0.00 H ATOM 47 HA PHE A 4 16.151 12.799 12.492 1.00 0.00 H ATOM 48 HB2 PHE A 4 16.036 14.105 14.655 1.00 0.00 H ATOM 49 HB3 PHE A 4 17.371 12.971 14.514 1.00 0.00 H ATOM 50 HD1 PHE A 4 16.527 16.576 14.143 1.00 0.00 H ATOM 51 HD2 PHE A 4 19.545 13.671 14.890 1.00 0.00 H ATOM 52 HE1 PHE A 4 18.109 18.370 14.716 1.00 0.00 H ATOM 53 HE2 PHE A 4 21.130 15.460 15.471 1.00 0.00 H ATOM 54 HZ PHE A 4 20.413 17.814 15.381 1.00 0.00 H ATOM 55 N THR A 5 16.334 15.986 11.714 1.00 0.00 N ATOM 56 CA THR A 5 15.550 17.113 11.203 1.00 0.00 C ATOM 57 C THR A 5 14.975 16.787 9.844 1.00 0.00 C ATOM 58 O THR A 5 13.809 17.063 9.556 1.00 0.00 O ATOM 59 CB THR A 5 16.370 18.420 11.116 1.00 0.00 C ATOM 60 OG1 THR A 5 17.541 18.222 10.309 1.00 0.00 O ATOM 61 CG2 THR A 5 16.773 18.908 12.501 1.00 0.00 C ATOM 62 H THR A 5 17.306 16.052 11.730 1.00 0.00 H ATOM 63 HA THR A 5 14.741 17.260 11.868 1.00 0.00 H ATOM 64 HB THR A 5 15.754 19.177 10.653 1.00 0.00 H ATOM 65 HG1 THR A 5 18.185 17.699 10.794 1.00 0.00 H ATOM 66 HG21 THR A 5 16.607 19.974 12.568 1.00 0.00 H ATOM 67 HG22 THR A 5 17.818 18.695 12.668 1.00 0.00 H ATOM 68 HG23 THR A 5 16.178 18.404 13.248 1.00 0.00 H ATOM 69 N LYS A 6 15.803 16.157 9.041 1.00 0.00 N ATOM 70 CA LYS A 6 15.414 15.719 7.708 1.00 0.00 C ATOM 71 C LYS A 6 14.283 14.696 7.802 1.00 0.00 C ATOM 72 O LYS A 6 13.541 14.498 6.842 1.00 0.00 O ATOM 73 CB LYS A 6 16.613 15.110 6.966 1.00 0.00 C ATOM 74 CG LYS A 6 16.231 14.299 5.731 1.00 0.00 C ATOM 75 CD LYS A 6 15.571 15.158 4.661 1.00 0.00 C ATOM 76 CE LYS A 6 14.927 14.307 3.571 1.00 0.00 C ATOM 77 NZ LYS A 6 13.665 13.703 4.010 1.00 0.00 N ATOM 78 H LYS A 6 16.693 15.954 9.375 1.00 0.00 H ATOM 79 HA LYS A 6 15.061 16.582 7.163 1.00 0.00 H ATOM 80 HB2 LYS A 6 17.270 15.909 6.654 1.00 0.00 H ATOM 81 HB3 LYS A 6 17.148 14.462 7.644 1.00 0.00 H ATOM 82 HG2 LYS A 6 17.124 13.856 5.317 1.00 0.00 H ATOM 83 HG3 LYS A 6 15.547 13.518 6.026 1.00 0.00 H ATOM 84 HD2 LYS A 6 14.809 15.768 5.123 1.00 0.00 H ATOM 85 HD3 LYS A 6 16.320 15.794 4.212 1.00 0.00 H ATOM 86 HE2 LYS A 6 14.734 14.933 2.713 1.00 0.00 H ATOM 87 HE3 LYS A 6 15.614 13.521 3.294 1.00 0.00 H ATOM 88 HZ1 LYS A 6 12.848 14.211 3.839 1.00 0.00 H ATOM 89 N ALA A 7 14.158 14.042 8.963 1.00 0.00 N ATOM 90 CA ALA A 7 13.113 13.039 9.155 1.00 0.00 C ATOM 91 C ALA A 7 11.729 13.656 9.065 1.00 0.00 C ATOM 92 O ALA A 7 10.853 13.127 8.382 1.00 0.00 O ATOM 93 CB ALA A 7 13.298 12.304 10.475 1.00 0.00 C ATOM 94 H ALA A 7 14.780 14.242 9.705 1.00 0.00 H ATOM 95 HA ALA A 7 13.207 12.331 8.356 1.00 0.00 H ATOM 96 HB1 ALA A 7 12.936 12.920 11.284 1.00 0.00 H ATOM 97 HB2 ALA A 7 14.346 12.092 10.626 1.00 0.00 H ATOM 98 HB3 ALA A 7 12.743 11.378 10.452 1.00 0.00 H ATOM 99 N ARG A 8 11.548 14.789 9.728 1.00 0.00 N ATOM 100 CA ARG A 8 10.279 15.499 9.693 1.00 0.00 C ATOM 101 C ARG A 8 9.956 15.888 8.265 1.00 0.00 C ATOM 102 O ARG A 8 8.801 15.930 7.853 1.00 0.00 O ATOM 103 CB ARG A 8 10.366 16.758 10.544 1.00 0.00 C ATOM 104 CG ARG A 8 10.484 16.488 12.037 1.00 0.00 C ATOM 105 CD ARG A 8 10.661 17.777 12.827 1.00 0.00 C ATOM 106 NE ARG A 8 11.894 18.482 12.467 1.00 0.00 N ATOM 107 CZ ARG A 8 12.278 19.640 13.010 1.00 0.00 C ATOM 108 NH1 ARG A 8 11.532 20.232 13.940 1.00 0.00 N ATOM 109 NH2 ARG A 8 13.413 20.209 12.620 1.00 0.00 N ATOM 110 H ARG A 8 12.295 15.171 10.236 1.00 0.00 H ATOM 111 HA ARG A 8 9.505 14.849 10.071 1.00 0.00 H ATOM 112 HB2 ARG A 8 11.238 17.318 10.230 1.00 0.00 H ATOM 113 HB3 ARG A 8 9.486 17.354 10.369 1.00 0.00 H ATOM 114 HG2 ARG A 8 9.586 15.992 12.375 1.00 0.00 H ATOM 115 HG3 ARG A 8 11.338 15.849 12.211 1.00 0.00 H ATOM 116 HD2 ARG A 8 9.819 18.423 12.630 1.00 0.00 H ATOM 117 HD3 ARG A 8 10.690 17.536 13.880 1.00 0.00 H ATOM 118 HE ARG A 8 12.466 18.072 11.785 1.00 0.00 H ATOM 119 HH11 ARG A 8 10.676 19.811 14.240 1.00 0.00 H ATOM 120 HH12 ARG A 8 11.828 21.099 14.341 1.00 0.00 H ATOM 121 HH21 ARG A 8 13.979 19.771 11.921 1.00 0.00 H ATOM 122 HH22 ARG A 8 13.704 21.077 13.024 1.00 0.00 H ATOM 123 N LYS A 9 11.008 16.167 7.520 1.00 0.00 N ATOM 124 CA LYS A 9 10.878 16.557 6.120 1.00 0.00 C ATOM 125 C LYS A 9 10.539 15.350 5.250 1.00 0.00 C ATOM 126 O LYS A 9 9.663 15.421 4.387 1.00 0.00 O ATOM 127 CB LYS A 9 12.172 17.213 5.626 1.00 0.00 C ATOM 128 CG LYS A 9 12.134 17.611 4.158 1.00 0.00 C ATOM 129 CD LYS A 9 13.441 18.253 3.719 1.00 0.00 C ATOM 130 CE LYS A 9 13.429 18.592 2.235 1.00 0.00 C ATOM 131 NZ LYS A 9 12.349 19.559 1.886 1.00 0.00 N ATOM 132 H LYS A 9 11.901 16.096 7.928 1.00 0.00 H ATOM 133 HA LYS A 9 10.073 17.272 6.050 1.00 0.00 H ATOM 134 HB2 LYS A 9 12.357 18.101 6.212 1.00 0.00 H ATOM 135 HB3 LYS A 9 12.990 16.523 5.768 1.00 0.00 H ATOM 136 HG2 LYS A 9 11.960 16.729 3.560 1.00 0.00 H ATOM 137 HG3 LYS A 9 11.329 18.315 4.007 1.00 0.00 H ATOM 138 HD2 LYS A 9 13.593 19.161 4.283 1.00 0.00 H ATOM 139 HD3 LYS A 9 14.251 17.566 3.915 1.00 0.00 H ATOM 140 HE2 LYS A 9 14.383 19.023 1.970 1.00 0.00 H ATOM 141 HE3 LYS A 9 13.279 17.681 1.673 1.00 0.00 H ATOM 142 HZ1 LYS A 9 11.425 19.081 1.890 1.00 0.00 H ATOM 143 HZ2 LYS A 9 12.517 19.957 0.940 1.00 0.00 H ATOM 144 HZ3 LYS A 9 12.328 20.337 2.577 1.00 0.00 H ATOM 145 N ASP A 10 11.250 14.248 5.482 1.00 0.00 N ATOM 146 CA ASP A 10 11.049 13.018 4.723 1.00 0.00 C ATOM 147 C ASP A 10 9.688 12.382 5.027 1.00 0.00 C ATOM 148 O ASP A 10 9.083 11.767 4.147 1.00 0.00 O ATOM 149 CB ASP A 10 12.178 12.017 5.014 1.00 0.00 C ATOM 150 CG ASP A 10 13.574 12.510 4.618 1.00 0.00 C ATOM 151 OD1 ASP A 10 14.563 11.815 4.856 1.00 0.00 O ATOM 152 H ASP A 10 11.937 14.266 6.181 1.00 0.00 H ATOM 153 HA ASP A 10 11.078 13.275 3.675 1.00 0.00 H ATOM 154 HB2 ASP A 10 12.189 11.802 6.072 1.00 0.00 H ATOM 155 HB3 ASP A 10 11.978 11.102 4.474 1.00 0.00 H ATOM 156 N LYS A 11 9.206 12.530 6.269 1.00 0.00 N ATOM 157 CA LYS A 11 7.916 11.960 6.654 1.00 0.00 C ATOM 158 C LYS A 11 6.780 12.847 6.161 1.00 0.00 C ATOM 159 O LYS A 11 5.908 12.391 5.423 1.00 0.00 O ATOM 160 CB LYS A 11 7.816 11.783 8.177 1.00 0.00 C ATOM 161 CG LYS A 11 6.887 10.648 8.609 1.00 0.00 C ATOM 162 CD LYS A 11 5.536 10.701 7.902 1.00 0.00 C ATOM 163 CE LYS A 11 4.720 11.922 8.311 1.00 0.00 C ATOM 164 NZ LYS A 11 3.871 12.415 7.222 1.00 0.00 N ATOM 165 H LYS A 11 9.722 13.035 6.932 1.00 0.00 H ATOM 166 HA LYS A 11 7.829 10.994 6.182 1.00 0.00 H ATOM 167 HB2 LYS A 11 8.801 11.579 8.568 1.00 0.00 H ATOM 168 HB3 LYS A 11 7.450 12.702 8.610 1.00 0.00 H ATOM 169 HG2 LYS A 11 7.360 9.705 8.379 1.00 0.00 H ATOM 170 HG3 LYS A 11 6.726 10.718 9.675 1.00 0.00 H ATOM 171 HD2 LYS A 11 5.700 10.732 6.836 1.00 0.00 H ATOM 172 HD3 LYS A 11 4.979 9.810 8.152 1.00 0.00 H ATOM 173 HE2 LYS A 11 4.093 11.654 9.148 1.00 0.00 H ATOM 174 HE3 LYS A 11 5.399 12.708 8.609 1.00 0.00 H ATOM 175 HZ1 LYS A 11 3.879 13.378 7.053 1.00 0.00 H ATOM 176 N ARG A 12 6.805 14.122 6.563 1.00 0.00 N ATOM 177 CA ARG A 12 5.778 15.079 6.150 1.00 0.00 C ATOM 178 C ARG A 12 5.592 15.032 4.642 1.00 0.00 C ATOM 179 O ARG A 12 4.494 15.250 4.132 1.00 0.00 O ATOM 180 CB ARG A 12 6.137 16.500 6.596 1.00 0.00 C ATOM 181 CG ARG A 12 6.051 16.709 8.102 1.00 0.00 C ATOM 182 CD ARG A 12 4.635 16.499 8.618 1.00 0.00 C ATOM 183 NE ARG A 12 4.540 16.693 10.065 1.00 0.00 N ATOM 184 CZ ARG A 12 3.411 16.556 10.766 1.00 0.00 C ATOM 185 NH1 ARG A 12 2.275 16.222 10.158 1.00 0.00 N ATOM 186 NH2 ARG A 12 3.420 16.754 12.080 1.00 0.00 N ATOM 187 H ARG A 12 7.536 14.424 7.143 1.00 0.00 H ATOM 188 HA ARG A 12 4.852 14.790 6.619 1.00 0.00 H ATOM 189 HB2 ARG A 12 7.146 16.721 6.281 1.00 0.00 H ATOM 190 HB3 ARG A 12 5.461 17.196 6.119 1.00 0.00 H ATOM 191 HG2 ARG A 12 6.707 16.006 8.591 1.00 0.00 H ATOM 192 HG3 ARG A 12 6.363 17.717 8.333 1.00 0.00 H ATOM 193 HD2 ARG A 12 3.979 17.203 8.127 1.00 0.00 H ATOM 194 HD3 ARG A 12 4.324 15.492 8.378 1.00 0.00 H ATOM 195 HE ARG A 12 5.361 16.939 10.542 1.00 0.00 H ATOM 196 HH11 ARG A 12 2.259 16.070 9.170 1.00 0.00 H ATOM 197 HH12 ARG A 12 1.434 16.122 10.692 1.00 0.00 H ATOM 198 HH21 ARG A 12 4.270 17.004 12.543 1.00 0.00 H ATOM 199 HH22 ARG A 12 2.576 16.652 12.607 1.00 0.00 H ATOM 200 N LYS A 13 6.674 14.726 3.936 1.00 0.00 N ATOM 201 CA LYS A 13 6.622 14.629 2.482 1.00 0.00 C ATOM 202 C LYS A 13 5.989 13.309 2.060 1.00 0.00 C ATOM 203 O LYS A 13 5.124 13.278 1.183 1.00 0.00 O ATOM 204 CB LYS A 13 8.025 14.771 1.880 1.00 0.00 C ATOM 205 CG LYS A 13 8.049 14.766 0.357 1.00 0.00 C ATOM 206 CD LYS A 13 7.281 15.945 -0.228 1.00 0.00 C ATOM 207 CE LYS A 13 7.873 17.280 0.206 1.00 0.00 C ATOM 208 NZ LYS A 13 9.290 17.438 -0.232 1.00 0.00 N ATOM 209 H LYS A 13 7.522 14.546 4.407 1.00 0.00 H ATOM 210 HA LYS A 13 5.998 15.428 2.128 1.00 0.00 H ATOM 211 HB2 LYS A 13 8.456 15.701 2.220 1.00 0.00 H ATOM 212 HB3 LYS A 13 8.638 13.953 2.230 1.00 0.00 H ATOM 213 HG2 LYS A 13 9.074 14.818 0.023 1.00 0.00 H ATOM 214 HG3 LYS A 13 7.602 13.847 0.004 1.00 0.00 H ATOM 215 HD2 LYS A 13 7.315 15.883 -1.305 1.00 0.00 H ATOM 216 HD3 LYS A 13 6.254 15.892 0.104 1.00 0.00 H ATOM 217 HE2 LYS A 13 7.284 18.076 -0.225 1.00 0.00 H ATOM 218 HE3 LYS A 13 7.828 17.346 1.283 1.00 0.00 H ATOM 219 HZ1 LYS A 13 9.581 18.432 -0.144 1.00 0.00 H ATOM 220 HZ2 LYS A 13 9.394 17.145 -1.224 1.00 0.00 H ATOM 221 HZ3 LYS A 13 9.914 16.851 0.359 1.00 0.00 H ATOM 222 N LEU A 14 6.413 12.225 2.705 1.00 0.00 N ATOM 223 CA LEU A 14 5.880 10.897 2.422 1.00 0.00 C ATOM 224 C LEU A 14 4.382 10.823 2.748 1.00 0.00 C ATOM 225 O LEU A 14 3.676 9.954 2.234 1.00 0.00 O ATOM 226 CB LEU A 14 6.645 9.838 3.226 1.00 0.00 C ATOM 227 CG LEU A 14 6.217 8.388 2.981 1.00 0.00 C ATOM 228 CD1 LEU A 14 6.443 7.998 1.528 1.00 0.00 C ATOM 229 CD2 LEU A 14 6.970 7.448 3.912 1.00 0.00 C ATOM 230 H LEU A 14 7.095 12.323 3.403 1.00 0.00 H ATOM 231 HA LEU A 14 6.016 10.703 1.369 1.00 0.00 H ATOM 232 HB2 LEU A 14 7.695 9.926 2.985 1.00 0.00 H ATOM 233 HB3 LEU A 14 6.517 10.054 4.276 1.00 0.00 H ATOM 234 HG LEU A 14 5.162 8.291 3.191 1.00 0.00 H ATOM 235 HD11 LEU A 14 7.471 8.192 1.258 1.00 0.00 H ATOM 236 HD12 LEU A 14 5.789 8.577 0.893 1.00 0.00 H ATOM 237 HD13 LEU A 14 6.230 6.947 1.399 1.00 0.00 H ATOM 238 HD21 LEU A 14 6.772 6.425 3.628 1.00 0.00 H ATOM 239 HD22 LEU A 14 6.643 7.609 4.928 1.00 0.00 H ATOM 240 HD23 LEU A 14 8.030 7.643 3.840 1.00 0.00 H ATOM 241 N ASP A 15 3.902 11.738 3.601 1.00 0.00 N ATOM 242 CA ASP A 15 2.487 11.759 3.982 1.00 0.00 C ATOM 243 C ASP A 15 1.660 12.533 2.957 1.00 0.00 C ATOM 244 O ASP A 15 0.666 12.026 2.438 1.00 0.00 O ATOM 245 CB ASP A 15 2.298 12.368 5.379 1.00 0.00 C ATOM 246 CG ASP A 15 3.095 11.645 6.454 1.00 0.00 C ATOM 247 OD1 ASP A 15 3.009 10.423 6.590 1.00 0.00 O ATOM 248 H ASP A 15 4.510 12.418 3.975 1.00 0.00 H ATOM 249 HA ASP A 15 2.140 10.736 3.999 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.613 13.400 5.359 1.00 0.00 H ATOM 251 HB3 ASP A 15 1.251 12.323 5.643 1.00 0.00 H HETATM 252 N NH2 A 16 2.069 13.765 2.664 1.00 0.00 N HETATM 253 HN1 NH2 A 16 2.870 14.109 3.115 1.00 0.00 H HETATM 254 HN2 NH2 A 16 1.554 14.280 2.009 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 2 ATOM 1 N PHE A 1 25.107 8.480 7.210 1.00 0.00 N ATOM 2 CA PHE A 1 24.310 8.607 8.426 1.00 0.00 C ATOM 3 C PHE A 1 23.117 9.538 8.206 1.00 0.00 C ATOM 4 O PHE A 1 23.228 10.553 7.515 1.00 0.00 O ATOM 5 CB PHE A 1 25.180 9.110 9.589 1.00 0.00 C ATOM 6 CG PHE A 1 25.847 10.439 9.340 1.00 0.00 C ATOM 7 CD1 PHE A 1 25.109 11.614 9.328 1.00 0.00 C ATOM 8 CD2 PHE A 1 27.213 10.511 9.115 1.00 0.00 C ATOM 9 CE1 PHE A 1 25.721 12.831 9.096 1.00 0.00 C ATOM 10 CE2 PHE A 1 27.829 11.726 8.884 1.00 0.00 C ATOM 11 CZ PHE A 1 27.082 12.887 8.874 1.00 0.00 C ATOM 12 H1 PHE A 1 24.955 7.716 6.615 1.00 0.00 H ATOM 13 HA PHE A 1 23.937 7.625 8.674 1.00 0.00 H ATOM 14 HB2 PHE A 1 24.562 9.214 10.468 1.00 0.00 H ATOM 15 HB3 PHE A 1 25.954 8.383 9.787 1.00 0.00 H ATOM 16 HD1 PHE A 1 24.044 11.573 9.503 1.00 0.00 H ATOM 17 HD2 PHE A 1 27.799 9.604 9.122 1.00 0.00 H ATOM 18 HE1 PHE A 1 25.133 13.738 9.088 1.00 0.00 H ATOM 19 HE2 PHE A 1 28.894 11.768 8.710 1.00 0.00 H ATOM 20 HZ PHE A 1 27.562 13.838 8.692 1.00 0.00 H ATOM 21 N GLY A 2 21.974 9.182 8.795 1.00 0.00 N ATOM 22 CA GLY A 2 20.776 9.991 8.654 1.00 0.00 C ATOM 23 C GLY A 2 20.851 11.287 9.439 1.00 0.00 C ATOM 24 O GLY A 2 21.174 11.280 10.629 1.00 0.00 O ATOM 25 H GLY A 2 21.945 8.362 9.331 1.00 0.00 H ATOM 26 HA2 GLY A 2 20.633 10.224 7.609 1.00 0.00 H ATOM 27 HA3 GLY A 2 19.928 9.420 9.002 1.00 0.00 H ATOM 28 N GLY A 3 20.549 12.401 8.773 1.00 0.00 N ATOM 29 CA GLY A 3 20.584 13.700 9.427 1.00 0.00 C ATOM 30 C GLY A 3 19.466 13.874 10.441 1.00 0.00 C ATOM 31 O GLY A 3 19.692 14.395 11.535 1.00 0.00 O ATOM 32 H GLY A 3 20.295 12.342 7.827 1.00 0.00 H ATOM 33 HA2 GLY A 3 21.532 13.809 9.932 1.00 0.00 H ATOM 34 HA3 GLY A 3 20.499 14.471 8.678 1.00 0.00 H ATOM 35 N PHE A 4 18.256 13.442 10.068 1.00 0.00 N ATOM 36 CA PHE A 4 17.082 13.549 10.937 1.00 0.00 C ATOM 37 C PHE A 4 16.727 15.019 11.197 1.00 0.00 C ATOM 38 O PHE A 4 16.299 15.386 12.293 1.00 0.00 O ATOM 39 CB PHE A 4 17.333 12.809 12.259 1.00 0.00 C ATOM 40 CG PHE A 4 16.103 12.635 13.106 1.00 0.00 C ATOM 41 CD1 PHE A 4 14.940 12.111 12.563 1.00 0.00 C ATOM 42 CD2 PHE A 4 16.109 12.995 14.444 1.00 0.00 C ATOM 43 CE1 PHE A 4 13.808 11.949 13.338 1.00 0.00 C ATOM 44 CE2 PHE A 4 14.980 12.836 15.224 1.00 0.00 C ATOM 45 CZ PHE A 4 13.828 12.313 14.670 1.00 0.00 C ATOM 46 H PHE A 4 18.148 13.044 9.180 1.00 0.00 H ATOM 47 HA PHE A 4 16.254 13.080 10.426 1.00 0.00 H ATOM 48 HB2 PHE A 4 17.727 11.827 12.044 1.00 0.00 H ATOM 49 HB3 PHE A 4 18.059 13.360 12.838 1.00 0.00 H ATOM 50 HD1 PHE A 4 14.923 11.827 11.521 1.00 0.00 H ATOM 51 HD2 PHE A 4 17.009 13.404 14.879 1.00 0.00 H ATOM 52 HE1 PHE A 4 12.908 11.540 12.902 1.00 0.00 H ATOM 53 HE2 PHE A 4 14.998 13.120 16.265 1.00 0.00 H ATOM 54 HZ PHE A 4 12.943 12.187 15.278 1.00 0.00 H ATOM 55 N THR A 5 16.903 15.853 10.168 1.00 0.00 N ATOM 56 CA THR A 5 16.604 17.278 10.262 1.00 0.00 C ATOM 57 C THR A 5 15.199 17.575 9.760 1.00 0.00 C ATOM 58 O THR A 5 14.216 17.141 10.364 1.00 0.00 O ATOM 59 CB THR A 5 17.665 18.130 9.520 1.00 0.00 C ATOM 60 OG1 THR A 5 17.782 17.708 8.153 1.00 0.00 O ATOM 61 CG2 THR A 5 19.018 18.030 10.211 1.00 0.00 C ATOM 62 H THR A 5 17.240 15.498 9.320 1.00 0.00 H ATOM 63 HA THR A 5 16.628 17.547 11.282 1.00 0.00 H ATOM 64 HB THR A 5 17.347 19.163 9.540 1.00 0.00 H ATOM 65 HG1 THR A 5 18.304 16.903 8.106 1.00 0.00 H ATOM 66 HG21 THR A 5 19.136 17.042 10.631 1.00 0.00 H ATOM 67 HG22 THR A 5 19.075 18.766 11.000 1.00 0.00 H ATOM 68 HG23 THR A 5 19.805 18.211 9.493 1.00 0.00 H ATOM 69 N LYS A 6 15.109 18.299 8.656 1.00 0.00 N ATOM 70 CA LYS A 6 13.820 18.638 8.058 1.00 0.00 C ATOM 71 C LYS A 6 13.100 17.378 7.549 1.00 0.00 C ATOM 72 O LYS A 6 11.994 17.467 7.015 1.00 0.00 O ATOM 73 CB LYS A 6 14.010 19.678 6.930 1.00 0.00 C ATOM 74 CG LYS A 6 13.557 19.229 5.543 1.00 0.00 C ATOM 75 CD LYS A 6 14.477 18.169 4.961 1.00 0.00 C ATOM 76 CE LYS A 6 13.919 17.589 3.670 1.00 0.00 C ATOM 77 NZ LYS A 6 12.957 16.511 3.915 1.00 0.00 N ATOM 78 H LYS A 6 15.929 18.599 8.230 1.00 0.00 H ATOM 79 HA LYS A 6 13.214 19.082 8.835 1.00 0.00 H ATOM 80 HB2 LYS A 6 13.456 20.568 7.188 1.00 0.00 H ATOM 81 HB3 LYS A 6 15.059 19.933 6.872 1.00 0.00 H ATOM 82 HG2 LYS A 6 12.560 18.828 5.610 1.00 0.00 H ATOM 83 HG3 LYS A 6 13.553 20.087 4.886 1.00 0.00 H ATOM 84 HD2 LYS A 6 15.440 18.614 4.756 1.00 0.00 H ATOM 85 HD3 LYS A 6 14.594 17.373 5.681 1.00 0.00 H ATOM 86 HE2 LYS A 6 13.430 18.378 3.117 1.00 0.00 H ATOM 87 HE3 LYS A 6 14.739 17.199 3.086 1.00 0.00 H ATOM 88 HZ1 LYS A 6 13.220 15.815 4.552 1.00 0.00 H ATOM 89 N ALA A 7 13.721 16.201 7.731 1.00 0.00 N ATOM 90 CA ALA A 7 13.118 14.945 7.294 1.00 0.00 C ATOM 91 C ALA A 7 11.730 14.762 7.887 1.00 0.00 C ATOM 92 O ALA A 7 10.870 14.143 7.271 1.00 0.00 O ATOM 93 CB ALA A 7 14.017 13.766 7.641 1.00 0.00 C ATOM 94 H ALA A 7 14.598 16.178 8.175 1.00 0.00 H ATOM 95 HA ALA A 7 13.016 14.993 6.225 1.00 0.00 H ATOM 96 HB1 ALA A 7 13.694 12.891 7.096 1.00 0.00 H ATOM 97 HB2 ALA A 7 13.961 13.571 8.701 1.00 0.00 H ATOM 98 HB3 ALA A 7 15.038 13.999 7.372 1.00 0.00 H ATOM 99 N ARG A 8 11.510 15.328 9.069 1.00 0.00 N ATOM 100 CA ARG A 8 10.210 15.252 9.726 1.00 0.00 C ATOM 101 C ARG A 8 9.161 15.890 8.836 1.00 0.00 C ATOM 102 O ARG A 8 8.021 15.440 8.758 1.00 0.00 O ATOM 103 CB ARG A 8 10.270 15.999 11.053 1.00 0.00 C ATOM 104 CG ARG A 8 9.099 15.717 11.981 1.00 0.00 C ATOM 105 CD ARG A 8 9.204 16.523 13.268 1.00 0.00 C ATOM 106 NE ARG A 8 8.185 16.142 14.247 1.00 0.00 N ATOM 107 CZ ARG A 8 8.146 14.958 14.869 1.00 0.00 C ATOM 108 NH1 ARG A 8 9.085 14.040 14.644 1.00 0.00 N ATOM 109 NH2 ARG A 8 7.169 14.699 15.730 1.00 0.00 N ATOM 110 H ARG A 8 12.234 15.829 9.502 1.00 0.00 H ATOM 111 HA ARG A 8 9.957 14.216 9.891 1.00 0.00 H ATOM 112 HB2 ARG A 8 11.182 15.731 11.558 1.00 0.00 H ATOM 113 HB3 ARG A 8 10.286 17.061 10.840 1.00 0.00 H ATOM 114 HG2 ARG A 8 8.181 15.981 11.479 1.00 0.00 H ATOM 115 HG3 ARG A 8 9.089 14.664 12.224 1.00 0.00 H ATOM 116 HD2 ARG A 8 10.179 16.363 13.701 1.00 0.00 H ATOM 117 HD3 ARG A 8 9.085 17.570 13.030 1.00 0.00 H ATOM 118 HE ARG A 8 7.486 16.800 14.449 1.00 0.00 H ATOM 119 HH11 ARG A 8 9.830 14.229 14.005 1.00 0.00 H ATOM 120 HH12 ARG A 8 9.047 13.159 15.116 1.00 0.00 H ATOM 121 HH21 ARG A 8 6.465 15.386 15.912 1.00 0.00 H ATOM 122 HH22 ARG A 8 7.137 13.816 16.198 1.00 0.00 H ATOM 123 N LYS A 9 9.579 16.940 8.157 1.00 0.00 N ATOM 124 CA LYS A 9 8.698 17.662 7.248 1.00 0.00 C ATOM 125 C LYS A 9 8.482 16.847 5.973 1.00 0.00 C ATOM 126 O LYS A 9 7.345 16.661 5.529 1.00 0.00 O ATOM 127 CB LYS A 9 9.273 19.053 6.935 1.00 0.00 C ATOM 128 CG LYS A 9 8.393 19.912 6.032 1.00 0.00 C ATOM 129 CD LYS A 9 8.601 19.595 4.558 1.00 0.00 C ATOM 130 CE LYS A 9 10.014 19.944 4.110 1.00 0.00 C ATOM 131 NZ LYS A 9 10.218 19.695 2.656 1.00 0.00 N ATOM 132 H LYS A 9 10.517 17.226 8.263 1.00 0.00 H ATOM 133 HA LYS A 9 7.747 17.781 7.744 1.00 0.00 H ATOM 134 HB2 LYS A 9 9.416 19.584 7.864 1.00 0.00 H ATOM 135 HB3 LYS A 9 10.232 18.931 6.454 1.00 0.00 H ATOM 136 HG2 LYS A 9 7.358 19.736 6.282 1.00 0.00 H ATOM 137 HG3 LYS A 9 8.631 20.953 6.203 1.00 0.00 H ATOM 138 HD2 LYS A 9 8.432 18.542 4.397 1.00 0.00 H ATOM 139 HD3 LYS A 9 7.896 20.168 3.974 1.00 0.00 H ATOM 140 HE2 LYS A 9 10.194 20.989 4.313 1.00 0.00 H ATOM 141 HE3 LYS A 9 10.715 19.343 4.671 1.00 0.00 H ATOM 142 HZ1 LYS A 9 9.462 20.151 2.106 1.00 0.00 H ATOM 143 HZ2 LYS A 9 10.205 18.674 2.462 1.00 0.00 H ATOM 144 HZ3 LYS A 9 11.134 20.082 2.353 1.00 0.00 H ATOM 145 N ASP A 10 9.582 16.345 5.403 1.00 0.00 N ATOM 146 CA ASP A 10 9.524 15.527 4.191 1.00 0.00 C ATOM 147 C ASP A 10 8.774 14.214 4.443 1.00 0.00 C ATOM 148 O ASP A 10 8.089 13.706 3.556 1.00 0.00 O ATOM 149 CB ASP A 10 10.935 15.192 3.685 1.00 0.00 C ATOM 150 CG ASP A 10 11.770 16.408 3.311 1.00 0.00 C ATOM 151 OD1 ASP A 10 11.368 17.216 2.473 1.00 0.00 O ATOM 152 H ASP A 10 10.453 16.518 5.817 1.00 0.00 H ATOM 153 HA ASP A 10 9.003 16.090 3.432 1.00 0.00 H ATOM 154 HB2 ASP A 10 11.462 14.648 4.454 1.00 0.00 H ATOM 155 HB3 ASP A 10 10.847 14.563 2.810 1.00 0.00 H ATOM 156 N LYS A 11 8.928 13.660 5.652 1.00 0.00 N ATOM 157 CA LYS A 11 8.292 12.397 6.019 1.00 0.00 C ATOM 158 C LYS A 11 6.795 12.563 6.213 1.00 0.00 C ATOM 159 O LYS A 11 6.004 11.902 5.541 1.00 0.00 O ATOM 160 CB LYS A 11 8.926 11.821 7.291 1.00 0.00 C ATOM 161 CG LYS A 11 8.174 10.625 7.858 1.00 0.00 C ATOM 162 CD LYS A 11 8.084 9.487 6.851 1.00 0.00 C ATOM 163 CE LYS A 11 6.886 8.589 7.125 1.00 0.00 C ATOM 164 NZ LYS A 11 5.614 9.275 6.881 1.00 0.00 N ATOM 165 H LYS A 11 9.490 14.111 6.312 1.00 0.00 H ATOM 166 HA LYS A 11 8.455 11.705 5.210 1.00 0.00 H ATOM 167 HB2 LYS A 11 9.937 11.513 7.068 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.954 12.594 8.047 1.00 0.00 H ATOM 169 HG2 LYS A 11 8.693 10.273 8.736 1.00 0.00 H ATOM 170 HG3 LYS A 11 7.177 10.937 8.129 1.00 0.00 H ATOM 171 HD2 LYS A 11 7.991 9.900 5.859 1.00 0.00 H ATOM 172 HD3 LYS A 11 8.985 8.894 6.912 1.00 0.00 H ATOM 173 HE2 LYS A 11 6.945 7.724 6.482 1.00 0.00 H ATOM 174 HE3 LYS A 11 6.919 8.270 8.156 1.00 0.00 H ATOM 175 HZ1 LYS A 11 5.491 10.160 7.283 1.00 0.00 H ATOM 176 N ARG A 12 6.409 13.451 7.127 1.00 0.00 N ATOM 177 CA ARG A 12 4.992 13.697 7.386 1.00 0.00 C ATOM 178 C ARG A 12 4.256 13.984 6.082 1.00 0.00 C ATOM 179 O ARG A 12 3.067 13.686 5.953 1.00 0.00 O ATOM 180 CB ARG A 12 4.800 14.858 8.363 1.00 0.00 C ATOM 181 CG ARG A 12 5.288 14.556 9.771 1.00 0.00 C ATOM 182 CD ARG A 12 4.871 15.638 10.754 1.00 0.00 C ATOM 183 NE ARG A 12 5.348 16.966 10.364 1.00 0.00 N ATOM 184 CZ ARG A 12 5.066 18.085 11.038 1.00 0.00 C ATOM 185 NH1 ARG A 12 4.315 18.040 12.136 1.00 0.00 N ATOM 186 NH2 ARG A 12 5.534 19.253 10.612 1.00 0.00 N ATOM 187 H ARG A 12 7.090 13.953 7.629 1.00 0.00 H ATOM 188 HA ARG A 12 4.578 12.800 7.824 1.00 0.00 H ATOM 189 HB2 ARG A 12 5.343 15.716 7.993 1.00 0.00 H ATOM 190 HB3 ARG A 12 3.749 15.103 8.413 1.00 0.00 H ATOM 191 HG2 ARG A 12 4.869 13.614 10.092 1.00 0.00 H ATOM 192 HG3 ARG A 12 6.365 14.486 9.762 1.00 0.00 H ATOM 193 HD2 ARG A 12 3.793 15.657 10.809 1.00 0.00 H ATOM 194 HD3 ARG A 12 5.273 15.393 11.727 1.00 0.00 H ATOM 195 HE ARG A 12 5.903 17.030 9.559 1.00 0.00 H ATOM 196 HH11 ARG A 12 3.957 17.165 12.464 1.00 0.00 H ATOM 197 HH12 ARG A 12 4.106 18.881 12.634 1.00 0.00 H ATOM 198 HH21 ARG A 12 6.098 19.296 9.787 1.00 0.00 H ATOM 199 HH22 ARG A 12 5.321 20.091 11.114 1.00 0.00 H ATOM 200 N LYS A 13 4.976 14.557 5.112 1.00 0.00 N ATOM 201 CA LYS A 13 4.387 14.873 3.813 1.00 0.00 C ATOM 202 C LYS A 13 4.278 13.626 2.940 1.00 0.00 C ATOM 203 O LYS A 13 3.232 13.370 2.342 1.00 0.00 O ATOM 204 CB LYS A 13 5.204 15.960 3.109 1.00 0.00 C ATOM 205 CG LYS A 13 4.678 16.339 1.732 1.00 0.00 C ATOM 206 CD LYS A 13 5.404 17.553 1.177 1.00 0.00 C ATOM 207 CE LYS A 13 6.901 17.307 1.058 1.00 0.00 C ATOM 208 NZ LYS A 13 7.631 18.527 0.617 1.00 0.00 N ATOM 209 H LYS A 13 5.930 14.765 5.276 1.00 0.00 H ATOM 210 HA LYS A 13 3.393 15.238 3.993 1.00 0.00 H ATOM 211 HB2 LYS A 13 5.204 16.847 3.725 1.00 0.00 H ATOM 212 HB3 LYS A 13 6.220 15.611 2.998 1.00 0.00 H ATOM 213 HG2 LYS A 13 4.826 15.507 1.059 1.00 0.00 H ATOM 214 HG3 LYS A 13 3.624 16.562 1.807 1.00 0.00 H ATOM 215 HD2 LYS A 13 5.007 17.780 0.199 1.00 0.00 H ATOM 216 HD3 LYS A 13 5.237 18.391 1.838 1.00 0.00 H ATOM 217 HE2 LYS A 13 7.281 17.002 2.022 1.00 0.00 H ATOM 218 HE3 LYS A 13 7.067 16.518 0.339 1.00 0.00 H ATOM 219 HZ1 LYS A 13 7.649 19.228 1.385 1.00 0.00 H ATOM 220 HZ2 LYS A 13 7.161 18.947 -0.211 1.00 0.00 H ATOM 221 HZ3 LYS A 13 8.609 18.284 0.359 1.00 0.00 H ATOM 222 N LEU A 14 5.355 12.844 2.890 1.00 0.00 N ATOM 223 CA LEU A 14 5.373 11.607 2.112 1.00 0.00 C ATOM 224 C LEU A 14 4.361 10.594 2.657 1.00 0.00 C ATOM 225 O LEU A 14 3.956 9.673 1.946 1.00 0.00 O ATOM 226 CB LEU A 14 6.776 10.993 2.116 1.00 0.00 C ATOM 227 CG LEU A 14 7.823 11.735 1.280 1.00 0.00 C ATOM 228 CD1 LEU A 14 9.197 11.112 1.479 1.00 0.00 C ATOM 229 CD2 LEU A 14 7.440 11.721 -0.195 1.00 0.00 C ATOM 230 H LEU A 14 6.153 13.095 3.402 1.00 0.00 H ATOM 231 HA LEU A 14 5.103 11.853 1.096 1.00 0.00 H ATOM 232 HB2 LEU A 14 7.124 10.958 3.138 1.00 0.00 H ATOM 233 HB3 LEU A 14 6.704 9.981 1.745 1.00 0.00 H ATOM 234 HG LEU A 14 7.873 12.764 1.603 1.00 0.00 H ATOM 235 HD11 LEU A 14 9.846 11.402 0.666 1.00 0.00 H ATOM 236 HD12 LEU A 14 9.104 10.036 1.498 1.00 0.00 H ATOM 237 HD13 LEU A 14 9.615 11.454 2.414 1.00 0.00 H ATOM 238 HD21 LEU A 14 6.400 11.449 -0.296 1.00 0.00 H ATOM 239 HD22 LEU A 14 8.051 11.001 -0.720 1.00 0.00 H ATOM 240 HD23 LEU A 14 7.599 12.702 -0.618 1.00 0.00 H ATOM 241 N ASP A 15 3.958 10.770 3.920 1.00 0.00 N ATOM 242 CA ASP A 15 2.993 9.871 4.551 1.00 0.00 C ATOM 243 C ASP A 15 1.576 10.435 4.467 1.00 0.00 C ATOM 244 O ASP A 15 0.638 9.727 4.101 1.00 0.00 O ATOM 245 CB ASP A 15 3.370 9.610 6.013 1.00 0.00 C ATOM 246 CG ASP A 15 4.622 8.758 6.153 1.00 0.00 C ATOM 247 OD1 ASP A 15 4.688 7.648 5.622 1.00 0.00 O ATOM 248 H ASP A 15 4.310 11.532 4.435 1.00 0.00 H ATOM 249 HA ASP A 15 3.021 8.934 4.013 1.00 0.00 H ATOM 250 HB2 ASP A 15 3.544 10.554 6.506 1.00 0.00 H ATOM 251 HB3 ASP A 15 2.553 9.101 6.503 1.00 0.00 H HETATM 252 N NH2 A 16 1.417 11.709 4.817 1.00 0.00 N HETATM 253 HN1 NH2 A 16 2.207 12.217 5.099 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.514 12.088 4.781 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 3 ATOM 1 N PHE A 1 23.026 9.383 6.615 1.00 0.00 N ATOM 2 CA PHE A 1 24.059 10.261 7.156 1.00 0.00 C ATOM 3 C PHE A 1 23.441 11.368 8.010 1.00 0.00 C ATOM 4 O PHE A 1 23.885 11.614 9.133 1.00 0.00 O ATOM 5 CB PHE A 1 24.894 10.873 6.024 1.00 0.00 C ATOM 6 CG PHE A 1 25.683 9.863 5.232 1.00 0.00 C ATOM 7 CD1 PHE A 1 25.045 8.837 4.551 1.00 0.00 C ATOM 8 CD2 PHE A 1 27.066 9.939 5.174 1.00 0.00 C ATOM 9 CE1 PHE A 1 25.770 7.908 3.830 1.00 0.00 C ATOM 10 CE2 PHE A 1 27.796 9.013 4.453 1.00 0.00 C ATOM 11 CZ PHE A 1 27.147 7.997 3.780 1.00 0.00 C ATOM 12 H1 PHE A 1 23.080 8.419 6.786 1.00 0.00 H ATOM 13 HA PHE A 1 24.704 9.663 7.781 1.00 0.00 H ATOM 14 HB2 PHE A 1 24.235 11.387 5.339 1.00 0.00 H ATOM 15 HB3 PHE A 1 25.590 11.584 6.445 1.00 0.00 H ATOM 16 HD1 PHE A 1 23.968 8.767 4.586 1.00 0.00 H ATOM 17 HD2 PHE A 1 27.575 10.733 5.700 1.00 0.00 H ATOM 18 HE1 PHE A 1 25.260 7.114 3.305 1.00 0.00 H ATOM 19 HE2 PHE A 1 28.872 9.084 4.416 1.00 0.00 H ATOM 20 HZ PHE A 1 27.715 7.272 3.217 1.00 0.00 H ATOM 21 N GLY A 2 22.411 12.026 7.471 1.00 0.00 N ATOM 22 CA GLY A 2 21.737 13.094 8.195 1.00 0.00 C ATOM 23 C GLY A 2 21.035 12.596 9.446 1.00 0.00 C ATOM 24 O GLY A 2 20.519 11.476 9.467 1.00 0.00 O ATOM 25 H GLY A 2 22.101 11.780 6.574 1.00 0.00 H ATOM 26 HA2 GLY A 2 22.468 13.838 8.477 1.00 0.00 H ATOM 27 HA3 GLY A 2 21.008 13.551 7.543 1.00 0.00 H ATOM 28 N GLY A 3 21.017 13.425 10.493 1.00 0.00 N ATOM 29 CA GLY A 3 20.375 13.044 11.745 1.00 0.00 C ATOM 30 C GLY A 3 18.859 13.211 11.732 1.00 0.00 C ATOM 31 O GLY A 3 18.279 13.655 12.724 1.00 0.00 O ATOM 32 H GLY A 3 21.448 14.303 10.417 1.00 0.00 H ATOM 33 HA2 GLY A 3 20.604 12.009 11.950 1.00 0.00 H ATOM 34 HA3 GLY A 3 20.783 13.651 12.540 1.00 0.00 H ATOM 35 N PHE A 4 18.219 12.844 10.615 1.00 0.00 N ATOM 36 CA PHE A 4 16.763 12.939 10.473 1.00 0.00 C ATOM 37 C PHE A 4 16.227 14.312 10.894 1.00 0.00 C ATOM 38 O PHE A 4 15.171 14.406 11.526 1.00 0.00 O ATOM 39 CB PHE A 4 16.073 11.833 11.283 1.00 0.00 C ATOM 40 CG PHE A 4 16.309 10.444 10.752 1.00 0.00 C ATOM 41 CD1 PHE A 4 17.592 9.922 10.662 1.00 0.00 C ATOM 42 CD2 PHE A 4 15.243 9.657 10.346 1.00 0.00 C ATOM 43 CE1 PHE A 4 17.804 8.646 10.176 1.00 0.00 C ATOM 44 CE2 PHE A 4 15.449 8.380 9.860 1.00 0.00 C ATOM 45 CZ PHE A 4 16.731 7.875 9.774 1.00 0.00 C ATOM 46 H PHE A 4 18.737 12.489 9.867 1.00 0.00 H ATOM 47 HA PHE A 4 16.533 12.792 9.428 1.00 0.00 H ATOM 48 HB2 PHE A 4 16.437 11.863 12.299 1.00 0.00 H ATOM 49 HB3 PHE A 4 15.007 12.012 11.285 1.00 0.00 H ATOM 50 HD1 PHE A 4 18.432 10.523 10.976 1.00 0.00 H ATOM 51 HD2 PHE A 4 14.239 10.052 10.410 1.00 0.00 H ATOM 52 HE1 PHE A 4 18.807 8.252 10.111 1.00 0.00 H ATOM 53 HE2 PHE A 4 14.609 7.778 9.547 1.00 0.00 H ATOM 54 HZ PHE A 4 16.895 6.877 9.395 1.00 0.00 H ATOM 55 N THR A 5 16.945 15.378 10.533 1.00 0.00 N ATOM 56 CA THR A 5 16.512 16.733 10.874 1.00 0.00 C ATOM 57 C THR A 5 15.433 17.215 9.922 1.00 0.00 C ATOM 58 O THR A 5 14.443 17.824 10.329 1.00 0.00 O ATOM 59 CB THR A 5 17.687 17.739 10.903 1.00 0.00 C ATOM 60 OG1 THR A 5 17.217 19.034 11.299 1.00 0.00 O ATOM 61 CG2 THR A 5 18.369 17.839 9.543 1.00 0.00 C ATOM 62 H THR A 5 17.770 15.252 10.022 1.00 0.00 H ATOM 63 HA THR A 5 16.084 16.687 11.840 1.00 0.00 H ATOM 64 HB THR A 5 18.414 17.394 11.625 1.00 0.00 H ATOM 65 HG1 THR A 5 17.730 19.345 12.048 1.00 0.00 H ATOM 66 HG21 THR A 5 19.281 18.410 9.639 1.00 0.00 H ATOM 67 HG22 THR A 5 17.708 18.331 8.845 1.00 0.00 H ATOM 68 HG23 THR A 5 18.601 16.849 9.182 1.00 0.00 H ATOM 69 N LYS A 6 15.632 16.899 8.663 1.00 0.00 N ATOM 70 CA LYS A 6 14.686 17.247 7.607 1.00 0.00 C ATOM 71 C LYS A 6 13.650 16.134 7.413 1.00 0.00 C ATOM 72 O LYS A 6 12.813 16.212 6.512 1.00 0.00 O ATOM 73 CB LYS A 6 15.431 17.521 6.286 1.00 0.00 C ATOM 74 CG LYS A 6 16.378 16.406 5.836 1.00 0.00 C ATOM 75 CD LYS A 6 15.648 15.098 5.546 1.00 0.00 C ATOM 76 CE LYS A 6 14.658 15.238 4.397 1.00 0.00 C ATOM 77 NZ LYS A 6 13.489 14.377 4.575 1.00 0.00 N ATOM 78 H LYS A 6 16.432 16.392 8.445 1.00 0.00 H ATOM 79 HA LYS A 6 14.170 18.146 7.910 1.00 0.00 H ATOM 80 HB2 LYS A 6 14.702 17.675 5.507 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.010 18.426 6.402 1.00 0.00 H ATOM 82 HG2 LYS A 6 16.886 16.723 4.938 1.00 0.00 H ATOM 83 HG3 LYS A 6 17.106 16.233 6.616 1.00 0.00 H ATOM 84 HD2 LYS A 6 16.377 14.346 5.283 1.00 0.00 H ATOM 85 HD3 LYS A 6 15.119 14.787 6.432 1.00 0.00 H ATOM 86 HE2 LYS A 6 14.330 16.265 4.342 1.00 0.00 H ATOM 87 HE3 LYS A 6 15.154 14.970 3.476 1.00 0.00 H ATOM 88 HZ1 LYS A 6 13.423 13.876 5.414 1.00 0.00 H ATOM 89 N ALA A 7 13.717 15.093 8.257 1.00 0.00 N ATOM 90 CA ALA A 7 12.796 13.962 8.159 1.00 0.00 C ATOM 91 C ALA A 7 11.351 14.378 8.358 1.00 0.00 C ATOM 92 O ALA A 7 10.460 13.854 7.694 1.00 0.00 O ATOM 93 CB ALA A 7 13.182 12.864 9.141 1.00 0.00 C ATOM 94 H ALA A 7 14.409 15.082 8.956 1.00 0.00 H ATOM 95 HA ALA A 7 12.884 13.568 7.165 1.00 0.00 H ATOM 96 HB1 ALA A 7 14.202 12.559 8.957 1.00 0.00 H ATOM 97 HB2 ALA A 7 12.525 12.017 9.011 1.00 0.00 H ATOM 98 HB3 ALA A 7 13.095 13.237 10.151 1.00 0.00 H ATOM 99 N ARG A 8 11.122 15.326 9.255 1.00 0.00 N ATOM 100 CA ARG A 8 9.773 15.819 9.511 1.00 0.00 C ATOM 101 C ARG A 8 9.104 16.252 8.213 1.00 0.00 C ATOM 102 O ARG A 8 7.901 16.066 8.026 1.00 0.00 O ATOM 103 CB ARG A 8 9.822 17.007 10.464 1.00 0.00 C ATOM 104 CG ARG A 8 10.277 16.656 11.871 1.00 0.00 C ATOM 105 CD ARG A 8 10.272 17.878 12.778 1.00 0.00 C ATOM 106 NE ARG A 8 10.756 17.571 14.124 1.00 0.00 N ATOM 107 CZ ARG A 8 12.023 17.259 14.416 1.00 0.00 C ATOM 108 NH1 ARG A 8 12.957 17.250 13.466 1.00 0.00 N ATOM 109 NH2 ARG A 8 12.360 16.968 15.668 1.00 0.00 N ATOM 110 H ARG A 8 11.876 15.715 9.746 1.00 0.00 H ATOM 111 HA ARG A 8 9.199 15.020 9.952 1.00 0.00 H ATOM 112 HB2 ARG A 8 10.509 17.738 10.058 1.00 0.00 H ATOM 113 HB3 ARG A 8 8.839 17.445 10.518 1.00 0.00 H ATOM 114 HG2 ARG A 8 9.608 15.913 12.281 1.00 0.00 H ATOM 115 HG3 ARG A 8 11.278 16.254 11.826 1.00 0.00 H ATOM 116 HD2 ARG A 8 10.907 18.635 12.343 1.00 0.00 H ATOM 117 HD3 ARG A 8 9.261 18.254 12.846 1.00 0.00 H ATOM 118 HE ARG A 8 10.099 17.588 14.852 1.00 0.00 H ATOM 119 HH11 ARG A 8 12.717 17.479 12.523 1.00 0.00 H ATOM 120 HH12 ARG A 8 13.901 17.014 13.696 1.00 0.00 H ATOM 121 HH21 ARG A 8 11.666 16.983 16.389 1.00 0.00 H ATOM 122 HH22 ARG A 8 13.306 16.734 15.891 1.00 0.00 H ATOM 123 N LYS A 9 9.904 16.831 7.324 1.00 0.00 N ATOM 124 CA LYS A 9 9.408 17.300 6.032 1.00 0.00 C ATOM 125 C LYS A 9 9.152 16.128 5.087 1.00 0.00 C ATOM 126 O LYS A 9 8.094 16.044 4.460 1.00 0.00 O ATOM 127 CB LYS A 9 10.404 18.272 5.393 1.00 0.00 C ATOM 128 CG LYS A 9 10.695 19.499 6.244 1.00 0.00 C ATOM 129 CD LYS A 9 11.581 20.507 5.519 1.00 0.00 C ATOM 130 CE LYS A 9 12.978 19.959 5.241 1.00 0.00 C ATOM 131 NZ LYS A 9 12.989 18.941 4.149 1.00 0.00 N ATOM 132 H LYS A 9 10.859 16.937 7.546 1.00 0.00 H ATOM 133 HA LYS A 9 8.476 17.817 6.204 1.00 0.00 H ATOM 134 HB2 LYS A 9 11.332 17.750 5.223 1.00 0.00 H ATOM 135 HB3 LYS A 9 10.009 18.603 4.444 1.00 0.00 H ATOM 136 HG2 LYS A 9 9.761 19.978 6.497 1.00 0.00 H ATOM 137 HG3 LYS A 9 11.193 19.184 7.150 1.00 0.00 H ATOM 138 HD2 LYS A 9 11.118 20.763 4.579 1.00 0.00 H ATOM 139 HD3 LYS A 9 11.669 21.394 6.129 1.00 0.00 H ATOM 140 HE2 LYS A 9 13.620 20.779 4.957 1.00 0.00 H ATOM 141 HE3 LYS A 9 13.357 19.507 6.146 1.00 0.00 H ATOM 142 HZ1 LYS A 9 12.132 19.029 3.566 1.00 0.00 H ATOM 143 HZ2 LYS A 9 13.024 17.983 4.552 1.00 0.00 H ATOM 144 HZ3 LYS A 9 13.823 19.079 3.543 1.00 0.00 H ATOM 145 N ASP A 10 10.131 15.228 4.993 1.00 0.00 N ATOM 146 CA ASP A 10 10.028 14.055 4.126 1.00 0.00 C ATOM 147 C ASP A 10 8.925 13.104 4.599 1.00 0.00 C ATOM 148 O ASP A 10 8.268 12.461 3.780 1.00 0.00 O ATOM 149 CB ASP A 10 11.373 13.320 4.059 1.00 0.00 C ATOM 150 CG ASP A 10 12.514 14.250 3.678 1.00 0.00 C ATOM 151 OD1 ASP A 10 12.506 14.852 2.602 1.00 0.00 O ATOM 152 H ASP A 10 10.947 15.358 5.521 1.00 0.00 H ATOM 153 HA ASP A 10 9.776 14.405 3.136 1.00 0.00 H ATOM 154 HB2 ASP A 10 11.589 12.889 5.025 1.00 0.00 H ATOM 155 HB3 ASP A 10 11.310 12.533 3.322 1.00 0.00 H ATOM 156 N LYS A 11 8.717 13.023 5.920 1.00 0.00 N ATOM 157 CA LYS A 11 7.685 12.154 6.477 1.00 0.00 C ATOM 158 C LYS A 11 6.341 12.859 6.456 1.00 0.00 C ATOM 159 O LYS A 11 5.359 12.315 5.956 1.00 0.00 O ATOM 160 CB LYS A 11 8.035 11.737 7.911 1.00 0.00 C ATOM 161 CG LYS A 11 7.101 10.679 8.498 1.00 0.00 C ATOM 162 CD LYS A 11 6.183 11.245 9.582 1.00 0.00 C ATOM 163 CE LYS A 11 4.983 11.993 9.008 1.00 0.00 C ATOM 164 NZ LYS A 11 4.118 11.128 8.201 1.00 0.00 N ATOM 165 H LYS A 11 9.260 13.569 6.530 1.00 0.00 H ATOM 166 HA LYS A 11 7.624 11.272 5.859 1.00 0.00 H ATOM 167 HB2 LYS A 11 9.040 11.340 7.921 1.00 0.00 H ATOM 168 HB3 LYS A 11 7.998 12.610 8.546 1.00 0.00 H ATOM 169 HG2 LYS A 11 6.491 10.276 7.705 1.00 0.00 H ATOM 170 HG3 LYS A 11 7.700 9.888 8.926 1.00 0.00 H ATOM 171 HD2 LYS A 11 5.822 10.429 10.190 1.00 0.00 H ATOM 172 HD3 LYS A 11 6.755 11.923 10.199 1.00 0.00 H ATOM 173 HE2 LYS A 11 4.404 12.393 9.828 1.00 0.00 H ATOM 174 HE3 LYS A 11 5.338 12.804 8.399 1.00 0.00 H ATOM 175 HZ1 LYS A 11 4.283 10.163 8.243 1.00 0.00 H ATOM 176 N ARG A 12 6.310 14.077 7.001 1.00 0.00 N ATOM 177 CA ARG A 12 5.086 14.870 7.050 1.00 0.00 C ATOM 178 C ARG A 12 4.445 14.919 5.673 1.00 0.00 C ATOM 179 O ARG A 12 3.229 15.053 5.544 1.00 0.00 O ATOM 180 CB ARG A 12 5.387 16.288 7.552 1.00 0.00 C ATOM 181 CG ARG A 12 4.161 17.184 7.699 1.00 0.00 C ATOM 182 CD ARG A 12 3.259 16.744 8.847 1.00 0.00 C ATOM 183 NE ARG A 12 2.468 15.555 8.525 1.00 0.00 N ATOM 184 CZ ARG A 12 1.630 14.963 9.381 1.00 0.00 C ATOM 185 NH1 ARG A 12 1.493 15.426 10.621 1.00 0.00 N ATOM 186 NH2 ARG A 12 0.927 13.903 8.996 1.00 0.00 N ATOM 187 H ARG A 12 7.133 14.450 7.379 1.00 0.00 H ATOM 188 HA ARG A 12 4.405 14.384 7.734 1.00 0.00 H ATOM 189 HB2 ARG A 12 5.866 16.218 8.516 1.00 0.00 H ATOM 190 HB3 ARG A 12 6.067 16.762 6.859 1.00 0.00 H ATOM 191 HG2 ARG A 12 4.490 18.195 7.886 1.00 0.00 H ATOM 192 HG3 ARG A 12 3.595 17.155 6.779 1.00 0.00 H ATOM 193 HD2 ARG A 12 3.876 16.529 9.707 1.00 0.00 H ATOM 194 HD3 ARG A 12 2.587 17.556 9.087 1.00 0.00 H ATOM 195 HE ARG A 12 2.556 15.184 7.622 1.00 0.00 H ATOM 196 HH11 ARG A 12 2.020 16.221 10.922 1.00 0.00 H ATOM 197 HH12 ARG A 12 0.863 14.977 11.255 1.00 0.00 H ATOM 198 HH21 ARG A 12 1.025 13.548 8.066 1.00 0.00 H ATOM 199 HH22 ARG A 12 0.299 13.459 9.636 1.00 0.00 H ATOM 200 N LYS A 13 5.274 14.794 4.644 1.00 0.00 N ATOM 201 CA LYS A 13 4.778 14.807 3.276 1.00 0.00 C ATOM 202 C LYS A 13 4.414 13.402 2.821 1.00 0.00 C ATOM 203 O LYS A 13 3.347 13.188 2.242 1.00 0.00 O ATOM 204 CB LYS A 13 5.805 15.437 2.329 1.00 0.00 C ATOM 205 CG LYS A 13 5.327 15.551 0.889 1.00 0.00 C ATOM 206 CD LYS A 13 6.376 16.207 0.005 1.00 0.00 C ATOM 207 CE LYS A 13 5.899 16.326 -1.435 1.00 0.00 C ATOM 208 NZ LYS A 13 6.917 16.974 -2.308 1.00 0.00 N ATOM 209 H LYS A 13 6.238 14.678 4.812 1.00 0.00 H ATOM 210 HA LYS A 13 3.880 15.394 3.271 1.00 0.00 H ATOM 211 HB2 LYS A 13 6.043 16.428 2.684 1.00 0.00 H ATOM 212 HB3 LYS A 13 6.702 14.835 2.340 1.00 0.00 H ATOM 213 HG2 LYS A 13 5.119 14.561 0.509 1.00 0.00 H ATOM 214 HG3 LYS A 13 4.425 16.145 0.865 1.00 0.00 H ATOM 215 HD2 LYS A 13 6.586 17.195 0.385 1.00 0.00 H ATOM 216 HD3 LYS A 13 7.276 15.611 0.028 1.00 0.00 H ATOM 217 HE2 LYS A 13 5.690 15.337 -1.815 1.00 0.00 H ATOM 218 HE3 LYS A 13 4.994 16.916 -1.453 1.00 0.00 H ATOM 219 HZ1 LYS A 13 7.099 17.946 -1.985 1.00 0.00 H ATOM 220 HZ2 LYS A 13 6.578 17.006 -3.290 1.00 0.00 H ATOM 221 HZ3 LYS A 13 7.808 16.438 -2.279 1.00 0.00 H ATOM 222 N LEU A 14 5.293 12.444 3.104 1.00 0.00 N ATOM 223 CA LEU A 14 5.049 11.054 2.745 1.00 0.00 C ATOM 224 C LEU A 14 3.722 10.583 3.344 1.00 0.00 C ATOM 225 O LEU A 14 3.017 9.768 2.746 1.00 0.00 O ATOM 226 CB LEU A 14 6.209 10.172 3.233 1.00 0.00 C ATOM 227 CG LEU A 14 6.146 8.692 2.831 1.00 0.00 C ATOM 228 CD1 LEU A 14 7.493 8.024 3.068 1.00 0.00 C ATOM 229 CD2 LEU A 14 5.057 7.962 3.608 1.00 0.00 C ATOM 230 H LEU A 14 6.118 12.676 3.581 1.00 0.00 H ATOM 231 HA LEU A 14 4.987 10.994 1.669 1.00 0.00 H ATOM 232 HB2 LEU A 14 7.128 10.585 2.847 1.00 0.00 H ATOM 233 HB3 LEU A 14 6.239 10.225 4.312 1.00 0.00 H ATOM 234 HG LEU A 14 5.916 8.618 1.778 1.00 0.00 H ATOM 235 HD11 LEU A 14 7.674 7.945 4.130 1.00 0.00 H ATOM 236 HD12 LEU A 14 8.273 8.615 2.612 1.00 0.00 H ATOM 237 HD13 LEU A 14 7.487 7.037 2.630 1.00 0.00 H ATOM 238 HD21 LEU A 14 5.439 7.015 3.960 1.00 0.00 H ATOM 239 HD22 LEU A 14 4.209 7.789 2.963 1.00 0.00 H ATOM 240 HD23 LEU A 14 4.751 8.562 4.453 1.00 0.00 H ATOM 241 N ASP A 15 3.379 11.118 4.523 1.00 0.00 N ATOM 242 CA ASP A 15 2.126 10.759 5.191 1.00 0.00 C ATOM 243 C ASP A 15 1.037 11.810 4.964 1.00 0.00 C ATOM 244 O ASP A 15 -0.145 11.478 4.867 1.00 0.00 O ATOM 245 CB ASP A 15 2.332 10.494 6.695 1.00 0.00 C ATOM 246 CG ASP A 15 3.116 11.569 7.431 1.00 0.00 C ATOM 247 OD1 ASP A 15 2.814 12.758 7.330 1.00 0.00 O ATOM 248 H ASP A 15 3.971 11.789 4.936 1.00 0.00 H ATOM 249 HA ASP A 15 1.787 9.839 4.735 1.00 0.00 H ATOM 250 HB2 ASP A 15 1.368 10.404 7.168 1.00 0.00 H ATOM 251 HB3 ASP A 15 2.863 9.561 6.809 1.00 0.00 H HETATM 252 N NH2 A 16 1.427 13.077 4.875 1.00 0.00 N HETATM 253 HN1 NH2 A 16 2.383 13.278 4.961 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.742 13.762 4.728 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 4 ATOM 1 N PHE A 1 22.374 10.129 6.147 1.00 0.00 N ATOM 2 CA PHE A 1 21.285 11.099 6.119 1.00 0.00 C ATOM 3 C PHE A 1 20.691 11.301 7.513 1.00 0.00 C ATOM 4 O PHE A 1 20.388 10.333 8.214 1.00 0.00 O ATOM 5 CB PHE A 1 20.190 10.643 5.149 1.00 0.00 C ATOM 6 CG PHE A 1 18.998 11.561 5.108 1.00 0.00 C ATOM 7 CD1 PHE A 1 19.157 12.919 4.878 1.00 0.00 C ATOM 8 CD2 PHE A 1 17.720 11.064 5.308 1.00 0.00 C ATOM 9 CE1 PHE A 1 18.063 13.763 4.847 1.00 0.00 C ATOM 10 CE2 PHE A 1 16.623 11.903 5.278 1.00 0.00 C ATOM 11 CZ PHE A 1 16.795 13.254 5.047 1.00 0.00 C ATOM 12 H1 PHE A 1 22.196 9.218 6.462 1.00 0.00 H ATOM 13 HA PHE A 1 21.690 12.039 5.774 1.00 0.00 H ATOM 14 HB2 PHE A 1 20.602 10.591 4.152 1.00 0.00 H ATOM 15 HB3 PHE A 1 19.846 9.662 5.442 1.00 0.00 H ATOM 16 HD1 PHE A 1 20.148 13.317 4.720 1.00 0.00 H ATOM 17 HD2 PHE A 1 17.584 10.007 5.488 1.00 0.00 H ATOM 18 HE1 PHE A 1 18.200 14.819 4.668 1.00 0.00 H ATOM 19 HE2 PHE A 1 15.632 11.503 5.435 1.00 0.00 H ATOM 20 HZ PHE A 1 15.939 13.911 5.025 1.00 0.00 H ATOM 21 N GLY A 2 20.519 12.566 7.901 1.00 0.00 N ATOM 22 CA GLY A 2 19.953 12.878 9.202 1.00 0.00 C ATOM 23 C GLY A 2 18.461 12.605 9.264 1.00 0.00 C ATOM 24 O GLY A 2 17.706 13.063 8.405 1.00 0.00 O ATOM 25 H GLY A 2 20.772 13.293 7.295 1.00 0.00 H ATOM 26 HA2 GLY A 2 20.449 12.279 9.951 1.00 0.00 H ATOM 27 HA3 GLY A 2 20.126 13.921 9.417 1.00 0.00 H ATOM 28 N GLY A 3 18.041 11.854 10.282 1.00 0.00 N ATOM 29 CA GLY A 3 16.635 11.521 10.449 1.00 0.00 C ATOM 30 C GLY A 3 15.818 12.636 11.089 1.00 0.00 C ATOM 31 O GLY A 3 14.605 12.714 10.886 1.00 0.00 O ATOM 32 H GLY A 3 18.696 11.519 10.929 1.00 0.00 H ATOM 33 HA2 GLY A 3 16.214 11.298 9.480 1.00 0.00 H ATOM 34 HA3 GLY A 3 16.561 10.638 11.068 1.00 0.00 H ATOM 35 N PHE A 4 16.474 13.484 11.882 1.00 0.00 N ATOM 36 CA PHE A 4 15.794 14.581 12.570 1.00 0.00 C ATOM 37 C PHE A 4 15.845 15.888 11.773 1.00 0.00 C ATOM 38 O PHE A 4 15.007 16.768 11.972 1.00 0.00 O ATOM 39 CB PHE A 4 16.399 14.794 13.964 1.00 0.00 C ATOM 40 CG PHE A 4 16.185 13.639 14.911 1.00 0.00 C ATOM 41 CD1 PHE A 4 16.578 12.352 14.570 1.00 0.00 C ATOM 42 CD2 PHE A 4 15.585 13.845 16.143 1.00 0.00 C ATOM 43 CE1 PHE A 4 16.375 11.297 15.438 1.00 0.00 C ATOM 44 CE2 PHE A 4 15.381 12.793 17.015 1.00 0.00 C ATOM 45 CZ PHE A 4 15.776 11.518 16.662 1.00 0.00 C ATOM 46 H PHE A 4 17.437 13.364 12.018 1.00 0.00 H ATOM 47 HA PHE A 4 14.760 14.298 12.684 1.00 0.00 H ATOM 48 HB2 PHE A 4 17.463 14.945 13.866 1.00 0.00 H ATOM 49 HB3 PHE A 4 15.956 15.674 14.408 1.00 0.00 H ATOM 50 HD1 PHE A 4 17.048 12.176 13.614 1.00 0.00 H ATOM 51 HD2 PHE A 4 15.276 14.841 16.421 1.00 0.00 H ATOM 52 HE1 PHE A 4 16.685 10.301 15.160 1.00 0.00 H ATOM 53 HE2 PHE A 4 14.912 12.968 17.972 1.00 0.00 H ATOM 54 HZ PHE A 4 15.616 10.694 17.342 1.00 0.00 H ATOM 55 N THR A 5 16.830 16.019 10.881 1.00 0.00 N ATOM 56 CA THR A 5 16.983 17.219 10.076 1.00 0.00 C ATOM 57 C THR A 5 15.944 17.277 8.959 1.00 0.00 C ATOM 58 O THR A 5 14.745 17.136 9.209 1.00 0.00 O ATOM 59 CB THR A 5 18.438 17.335 9.540 1.00 0.00 C ATOM 60 OG1 THR A 5 18.588 18.522 8.749 1.00 0.00 O ATOM 61 CG2 THR A 5 18.833 16.113 8.716 1.00 0.00 C ATOM 62 H THR A 5 17.473 15.295 10.762 1.00 0.00 H ATOM 63 HA THR A 5 16.803 18.051 10.701 1.00 0.00 H ATOM 64 HB THR A 5 19.105 17.401 10.388 1.00 0.00 H ATOM 65 HG1 THR A 5 18.743 19.275 9.326 1.00 0.00 H ATOM 66 HG21 THR A 5 18.025 15.396 8.723 1.00 0.00 H ATOM 67 HG22 THR A 5 19.717 15.662 9.141 1.00 0.00 H ATOM 68 HG23 THR A 5 19.037 16.413 7.699 1.00 0.00 H ATOM 69 N LYS A 6 16.410 17.484 7.744 1.00 0.00 N ATOM 70 CA LYS A 6 15.549 17.559 6.565 1.00 0.00 C ATOM 71 C LYS A 6 14.628 16.334 6.491 1.00 0.00 C ATOM 72 O LYS A 6 13.622 16.347 5.787 1.00 0.00 O ATOM 73 CB LYS A 6 16.432 17.643 5.305 1.00 0.00 C ATOM 74 CG LYS A 6 15.780 18.297 4.083 1.00 0.00 C ATOM 75 CD LYS A 6 14.659 17.457 3.482 1.00 0.00 C ATOM 76 CE LYS A 6 15.114 16.039 3.148 1.00 0.00 C ATOM 77 NZ LYS A 6 14.081 15.047 3.452 1.00 0.00 N ATOM 78 H LYS A 6 17.367 17.585 7.636 1.00 0.00 H ATOM 79 HA LYS A 6 14.948 18.453 6.640 1.00 0.00 H ATOM 80 HB2 LYS A 6 17.319 18.209 5.547 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.729 16.642 5.030 1.00 0.00 H ATOM 82 HG2 LYS A 6 15.372 19.251 4.380 1.00 0.00 H ATOM 83 HG3 LYS A 6 16.540 18.454 3.331 1.00 0.00 H ATOM 84 HD2 LYS A 6 13.841 17.413 4.178 1.00 0.00 H ATOM 85 HD3 LYS A 6 14.324 17.935 2.573 1.00 0.00 H ATOM 86 HE2 LYS A 6 15.348 15.988 2.096 1.00 0.00 H ATOM 87 HE3 LYS A 6 15.999 15.810 3.723 1.00 0.00 H ATOM 88 HZ1 LYS A 6 14.205 14.504 4.258 1.00 0.00 H ATOM 89 N ALA A 7 14.969 15.272 7.231 1.00 0.00 N ATOM 90 CA ALA A 7 14.161 14.054 7.219 1.00 0.00 C ATOM 91 C ALA A 7 12.738 14.307 7.681 1.00 0.00 C ATOM 92 O ALA A 7 11.795 13.770 7.103 1.00 0.00 O ATOM 93 CB ALA A 7 14.814 12.960 8.048 1.00 0.00 C ATOM 94 H ALA A 7 15.777 15.313 7.801 1.00 0.00 H ATOM 95 HA ALA A 7 14.113 13.720 6.200 1.00 0.00 H ATOM 96 HB1 ALA A 7 14.050 12.344 8.499 1.00 0.00 H ATOM 97 HB2 ALA A 7 15.417 13.409 8.821 1.00 0.00 H ATOM 98 HB3 ALA A 7 15.439 12.351 7.412 1.00 0.00 H ATOM 99 N ARG A 8 12.581 15.139 8.700 1.00 0.00 N ATOM 100 CA ARG A 8 11.256 15.476 9.206 1.00 0.00 C ATOM 101 C ARG A 8 10.367 16.001 8.085 1.00 0.00 C ATOM 102 O ARG A 8 9.161 15.749 8.060 1.00 0.00 O ATOM 103 CB ARG A 8 11.365 16.542 10.289 1.00 0.00 C ATOM 104 CG ARG A 8 11.992 16.049 11.583 1.00 0.00 C ATOM 105 CD ARG A 8 11.995 17.139 12.647 1.00 0.00 C ATOM 106 NE ARG A 8 12.629 16.703 13.893 1.00 0.00 N ATOM 107 CZ ARG A 8 12.143 15.752 14.698 1.00 0.00 C ATOM 108 NH1 ARG A 8 10.993 15.142 14.417 1.00 0.00 N ATOM 109 NH2 ARG A 8 12.806 15.419 15.799 1.00 0.00 N ATOM 110 H ARG A 8 13.372 15.551 9.109 1.00 0.00 H ATOM 111 HA ARG A 8 10.813 14.584 9.618 1.00 0.00 H ATOM 112 HB2 ARG A 8 11.971 17.353 9.905 1.00 0.00 H ATOM 113 HB3 ARG A 8 10.377 16.916 10.504 1.00 0.00 H ATOM 114 HG2 ARG A 8 11.428 15.204 11.947 1.00 0.00 H ATOM 115 HG3 ARG A 8 13.010 15.747 11.386 1.00 0.00 H ATOM 116 HD2 ARG A 8 12.532 17.994 12.264 1.00 0.00 H ATOM 117 HD3 ARG A 8 10.973 17.423 12.854 1.00 0.00 H ATOM 118 HE ARG A 8 13.470 17.140 14.144 1.00 0.00 H ATOM 119 HH11 ARG A 8 10.478 15.392 13.598 1.00 0.00 H ATOM 120 HH12 ARG A 8 10.643 14.431 15.028 1.00 0.00 H ATOM 121 HH21 ARG A 8 13.664 15.881 16.024 1.00 0.00 H ATOM 122 HH22 ARG A 8 12.448 14.708 16.404 1.00 0.00 H ATOM 123 N LYS A 9 10.981 16.736 7.162 1.00 0.00 N ATOM 124 CA LYS A 9 10.259 17.313 6.027 1.00 0.00 C ATOM 125 C LYS A 9 9.893 16.239 5.005 1.00 0.00 C ATOM 126 O LYS A 9 8.741 16.141 4.581 1.00 0.00 O ATOM 127 CB LYS A 9 11.094 18.408 5.352 1.00 0.00 C ATOM 128 CG LYS A 9 11.477 19.551 6.280 1.00 0.00 C ATOM 129 CD LYS A 9 12.223 20.648 5.534 1.00 0.00 C ATOM 130 CE LYS A 9 12.657 21.769 6.467 1.00 0.00 C ATOM 131 NZ LYS A 9 13.637 21.301 7.489 1.00 0.00 N ATOM 132 H LYS A 9 11.950 16.888 7.250 1.00 0.00 H ATOM 133 HA LYS A 9 9.349 17.753 6.406 1.00 0.00 H ATOM 134 HB2 LYS A 9 12.002 17.966 4.969 1.00 0.00 H ATOM 135 HB3 LYS A 9 10.528 18.817 4.528 1.00 0.00 H ATOM 136 HG2 LYS A 9 10.580 19.970 6.711 1.00 0.00 H ATOM 137 HG3 LYS A 9 12.111 19.168 7.065 1.00 0.00 H ATOM 138 HD2 LYS A 9 13.099 20.221 5.069 1.00 0.00 H ATOM 139 HD3 LYS A 9 11.573 21.057 4.774 1.00 0.00 H ATOM 140 HE2 LYS A 9 13.111 22.552 5.879 1.00 0.00 H ATOM 141 HE3 LYS A 9 11.785 22.159 6.970 1.00 0.00 H ATOM 142 HZ1 LYS A 9 14.393 20.749 7.034 1.00 0.00 H ATOM 143 HZ2 LYS A 9 13.163 20.701 8.194 1.00 0.00 H ATOM 144 HZ3 LYS A 9 14.063 22.116 7.974 1.00 0.00 H ATOM 145 N ASP A 10 10.885 15.438 4.618 1.00 0.00 N ATOM 146 CA ASP A 10 10.682 14.365 3.645 1.00 0.00 C ATOM 147 C ASP A 10 9.777 13.262 4.206 1.00 0.00 C ATOM 148 O ASP A 10 9.087 12.579 3.448 1.00 0.00 O ATOM 149 CB ASP A 10 12.032 13.779 3.215 1.00 0.00 C ATOM 150 CG ASP A 10 12.989 14.850 2.714 1.00 0.00 C ATOM 151 OD1 ASP A 10 12.739 15.495 1.694 1.00 0.00 O ATOM 152 H ASP A 10 11.779 15.571 4.997 1.00 0.00 H ATOM 153 HA ASP A 10 10.201 14.796 2.779 1.00 0.00 H ATOM 154 HB2 ASP A 10 12.486 13.280 4.058 1.00 0.00 H ATOM 155 HB3 ASP A 10 11.871 13.064 2.421 1.00 0.00 H ATOM 156 N LYS A 11 9.771 13.102 5.535 1.00 0.00 N ATOM 157 CA LYS A 11 8.938 12.093 6.183 1.00 0.00 C ATOM 158 C LYS A 11 7.565 12.665 6.498 1.00 0.00 C ATOM 159 O LYS A 11 6.549 12.003 6.287 1.00 0.00 O ATOM 160 CB LYS A 11 9.603 11.556 7.455 1.00 0.00 C ATOM 161 CG LYS A 11 8.728 10.576 8.226 1.00 0.00 C ATOM 162 CD LYS A 11 7.802 11.293 9.200 1.00 0.00 C ATOM 163 CE LYS A 11 6.554 10.476 9.499 1.00 0.00 C ATOM 164 NZ LYS A 11 5.393 10.949 8.740 1.00 0.00 N ATOM 165 H LYS A 11 10.324 13.687 6.092 1.00 0.00 H ATOM 166 HA LYS A 11 8.815 11.278 5.485 1.00 0.00 H ATOM 167 HB2 LYS A 11 10.519 11.051 7.184 1.00 0.00 H ATOM 168 HB3 LYS A 11 9.838 12.386 8.105 1.00 0.00 H ATOM 169 HG2 LYS A 11 8.129 10.015 7.524 1.00 0.00 H ATOM 170 HG3 LYS A 11 9.364 9.901 8.779 1.00 0.00 H ATOM 171 HD2 LYS A 11 8.333 11.464 10.124 1.00 0.00 H ATOM 172 HD3 LYS A 11 7.508 12.239 8.774 1.00 0.00 H ATOM 173 HE2 LYS A 11 6.744 9.444 9.243 1.00 0.00 H ATOM 174 HE3 LYS A 11 6.336 10.550 10.554 1.00 0.00 H ATOM 175 HZ1 LYS A 11 5.235 11.917 8.717 1.00 0.00 H ATOM 176 N ARG A 12 7.541 13.909 6.985 1.00 0.00 N ATOM 177 CA ARG A 12 6.286 14.584 7.302 1.00 0.00 C ATOM 178 C ARG A 12 5.353 14.506 6.096 1.00 0.00 C ATOM 179 O ARG A 12 4.144 14.315 6.240 1.00 0.00 O ATOM 180 CB ARG A 12 6.548 16.049 7.675 1.00 0.00 C ATOM 181 CG ARG A 12 5.311 16.817 8.130 1.00 0.00 C ATOM 182 CD ARG A 12 4.833 16.372 9.508 1.00 0.00 C ATOM 183 NE ARG A 12 4.241 15.033 9.497 1.00 0.00 N ATOM 184 CZ ARG A 12 3.071 14.732 8.922 1.00 0.00 C ATOM 185 NH1 ARG A 12 2.351 15.672 8.312 1.00 0.00 N ATOM 186 NH2 ARG A 12 2.618 13.484 8.962 1.00 0.00 N ATOM 187 H ARG A 12 8.386 14.387 7.115 1.00 0.00 H ATOM 188 HA ARG A 12 5.831 14.074 8.137 1.00 0.00 H ATOM 189 HB2 ARG A 12 7.273 16.077 8.474 1.00 0.00 H ATOM 190 HB3 ARG A 12 6.959 16.555 6.814 1.00 0.00 H ATOM 191 HG2 ARG A 12 5.551 17.869 8.171 1.00 0.00 H ATOM 192 HG3 ARG A 12 4.518 16.657 7.415 1.00 0.00 H ATOM 193 HD2 ARG A 12 5.676 16.372 10.182 1.00 0.00 H ATOM 194 HD3 ARG A 12 4.095 17.077 9.862 1.00 0.00 H ATOM 195 HE ARG A 12 4.741 14.317 9.942 1.00 0.00 H ATOM 196 HH11 ARG A 12 2.679 16.615 8.280 1.00 0.00 H ATOM 197 HH12 ARG A 12 1.478 15.433 7.885 1.00 0.00 H ATOM 198 HH21 ARG A 12 3.149 12.773 9.423 1.00 0.00 H ATOM 199 HH22 ARG A 12 1.744 13.255 8.533 1.00 0.00 H ATOM 200 N LYS A 13 5.939 14.629 4.901 1.00 0.00 N ATOM 201 CA LYS A 13 5.171 14.547 3.664 1.00 0.00 C ATOM 202 C LYS A 13 4.929 13.094 3.296 1.00 0.00 C ATOM 203 O LYS A 13 3.829 12.718 2.892 1.00 0.00 O ATOM 204 CB LYS A 13 5.883 15.280 2.523 1.00 0.00 C ATOM 205 CG LYS A 13 6.123 16.757 2.800 1.00 0.00 C ATOM 206 CD LYS A 13 4.817 17.506 3.018 1.00 0.00 C ATOM 207 CE LYS A 13 5.061 18.970 3.352 1.00 0.00 C ATOM 208 NZ LYS A 13 5.859 19.137 4.601 1.00 0.00 N ATOM 209 H LYS A 13 6.918 14.757 4.855 1.00 0.00 H ATOM 210 HA LYS A 13 4.217 15.009 3.845 1.00 0.00 H ATOM 211 HB2 LYS A 13 6.839 14.809 2.349 1.00 0.00 H ATOM 212 HB3 LYS A 13 5.283 15.197 1.629 1.00 0.00 H ATOM 213 HG2 LYS A 13 6.732 16.853 3.686 1.00 0.00 H ATOM 214 HG3 LYS A 13 6.640 17.191 1.957 1.00 0.00 H ATOM 215 HD2 LYS A 13 4.226 17.447 2.116 1.00 0.00 H ATOM 216 HD3 LYS A 13 4.280 17.044 3.833 1.00 0.00 H ATOM 217 HE2 LYS A 13 5.594 19.429 2.533 1.00 0.00 H ATOM 218 HE3 LYS A 13 4.106 19.461 3.477 1.00 0.00 H ATOM 219 HZ1 LYS A 13 5.572 18.429 5.308 1.00 0.00 H ATOM 220 HZ2 LYS A 13 5.708 20.086 4.997 1.00 0.00 H ATOM 221 HZ3 LYS A 13 6.872 19.016 4.396 1.00 0.00 H ATOM 222 N LEU A 14 5.956 12.275 3.469 1.00 0.00 N ATOM 223 CA LEU A 14 5.842 10.853 3.187 1.00 0.00 C ATOM 224 C LEU A 14 4.646 10.272 3.941 1.00 0.00 C ATOM 225 O LEU A 14 3.996 9.338 3.466 1.00 0.00 O ATOM 226 CB LEU A 14 7.139 10.130 3.581 1.00 0.00 C ATOM 227 CG LEU A 14 7.201 8.633 3.250 1.00 0.00 C ATOM 228 CD1 LEU A 14 8.637 8.137 3.325 1.00 0.00 C ATOM 229 CD2 LEU A 14 6.318 7.829 4.196 1.00 0.00 C ATOM 230 H LEU A 14 6.801 12.631 3.817 1.00 0.00 H ATOM 231 HA LEU A 14 5.678 10.736 2.126 1.00 0.00 H ATOM 232 HB2 LEU A 14 7.961 10.618 3.079 1.00 0.00 H ATOM 233 HB3 LEU A 14 7.276 10.243 4.646 1.00 0.00 H ATOM 234 HG LEU A 14 6.845 8.478 2.242 1.00 0.00 H ATOM 235 HD11 LEU A 14 9.251 8.712 2.649 1.00 0.00 H ATOM 236 HD12 LEU A 14 8.673 7.094 3.047 1.00 0.00 H ATOM 237 HD13 LEU A 14 9.005 8.253 4.334 1.00 0.00 H ATOM 238 HD21 LEU A 14 6.040 8.442 5.040 1.00 0.00 H ATOM 239 HD22 LEU A 14 6.858 6.961 4.543 1.00 0.00 H ATOM 240 HD23 LEU A 14 5.427 7.512 3.673 1.00 0.00 H ATOM 241 N ASP A 15 4.349 10.846 5.114 1.00 0.00 N ATOM 242 CA ASP A 15 3.221 10.398 5.926 1.00 0.00 C ATOM 243 C ASP A 15 1.908 10.940 5.367 1.00 0.00 C ATOM 244 O ASP A 15 1.007 10.177 5.021 1.00 0.00 O ATOM 245 CB ASP A 15 3.385 10.838 7.386 1.00 0.00 C ATOM 246 CG ASP A 15 4.538 10.149 8.099 1.00 0.00 C ATOM 247 OD1 ASP A 15 4.643 8.922 8.090 1.00 0.00 O ATOM 248 H ASP A 15 4.891 11.605 5.428 1.00 0.00 H ATOM 249 HA ASP A 15 3.195 9.319 5.886 1.00 0.00 H ATOM 250 HB2 ASP A 15 3.561 11.903 7.412 1.00 0.00 H ATOM 251 HB3 ASP A 15 2.473 10.619 7.923 1.00 0.00 H HETATM 252 N NH2 A 16 1.802 12.265 5.276 1.00 0.00 N HETATM 253 HN1 NH2 A 16 2.559 12.813 5.571 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.969 12.638 4.918 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 5 ATOM 1 N PHE A 1 22.777 7.944 9.569 1.00 0.00 N ATOM 2 CA PHE A 1 22.582 8.990 10.567 1.00 0.00 C ATOM 3 C PHE A 1 22.934 10.367 9.998 1.00 0.00 C ATOM 4 O PHE A 1 23.709 11.119 10.595 1.00 0.00 O ATOM 5 CB PHE A 1 23.420 8.703 11.821 1.00 0.00 C ATOM 6 CG PHE A 1 22.962 7.502 12.605 1.00 0.00 C ATOM 7 CD1 PHE A 1 22.931 6.242 12.026 1.00 0.00 C ATOM 8 CD2 PHE A 1 22.569 7.635 13.928 1.00 0.00 C ATOM 9 CE1 PHE A 1 22.515 5.141 12.750 1.00 0.00 C ATOM 10 CE2 PHE A 1 22.152 6.537 14.656 1.00 0.00 C ATOM 11 CZ PHE A 1 22.125 5.289 14.067 1.00 0.00 C ATOM 12 H1 PHE A 1 22.000 7.444 9.242 1.00 0.00 H ATOM 13 HA PHE A 1 21.537 8.990 10.840 1.00 0.00 H ATOM 14 HB2 PHE A 1 24.445 8.534 11.527 1.00 0.00 H ATOM 15 HB3 PHE A 1 23.378 9.562 12.475 1.00 0.00 H ATOM 16 HD1 PHE A 1 23.236 6.123 10.997 1.00 0.00 H ATOM 17 HD2 PHE A 1 22.587 8.611 14.390 1.00 0.00 H ATOM 18 HE1 PHE A 1 22.495 4.165 12.287 1.00 0.00 H ATOM 19 HE2 PHE A 1 21.849 6.656 15.686 1.00 0.00 H ATOM 20 HZ PHE A 1 21.801 4.430 14.635 1.00 0.00 H ATOM 21 N GLY A 2 22.354 10.691 8.838 1.00 0.00 N ATOM 22 CA GLY A 2 22.606 11.975 8.201 1.00 0.00 C ATOM 23 C GLY A 2 21.952 13.130 8.939 1.00 0.00 C ATOM 24 O GLY A 2 22.104 13.262 10.156 1.00 0.00 O ATOM 25 H GLY A 2 21.745 10.051 8.413 1.00 0.00 H ATOM 26 HA2 GLY A 2 23.673 12.143 8.165 1.00 0.00 H ATOM 27 HA3 GLY A 2 22.224 11.944 7.191 1.00 0.00 H ATOM 28 N GLY A 3 21.216 13.967 8.205 1.00 0.00 N ATOM 29 CA GLY A 3 20.543 15.098 8.817 1.00 0.00 C ATOM 30 C GLY A 3 19.472 14.664 9.799 1.00 0.00 C ATOM 31 O GLY A 3 19.449 15.128 10.940 1.00 0.00 O ATOM 32 H GLY A 3 21.124 13.811 7.243 1.00 0.00 H ATOM 33 HA2 GLY A 3 21.273 15.700 9.338 1.00 0.00 H ATOM 34 HA3 GLY A 3 20.085 15.695 8.042 1.00 0.00 H ATOM 35 N PHE A 4 18.585 13.765 9.349 1.00 0.00 N ATOM 36 CA PHE A 4 17.491 13.239 10.177 1.00 0.00 C ATOM 37 C PHE A 4 16.352 14.253 10.359 1.00 0.00 C ATOM 38 O PHE A 4 15.185 13.864 10.430 1.00 0.00 O ATOM 39 CB PHE A 4 18.010 12.783 11.548 1.00 0.00 C ATOM 40 CG PHE A 4 16.984 12.040 12.362 1.00 0.00 C ATOM 41 CD1 PHE A 4 16.271 10.988 11.807 1.00 0.00 C ATOM 42 CD2 PHE A 4 16.730 12.396 13.677 1.00 0.00 C ATOM 43 CE1 PHE A 4 15.327 10.304 12.549 1.00 0.00 C ATOM 44 CE2 PHE A 4 15.787 11.715 14.423 1.00 0.00 C ATOM 45 CZ PHE A 4 15.084 10.668 13.858 1.00 0.00 C ATOM 46 H PHE A 4 18.672 13.440 8.428 1.00 0.00 H ATOM 47 HA PHE A 4 17.092 12.377 9.663 1.00 0.00 H ATOM 48 HB2 PHE A 4 18.858 12.130 11.407 1.00 0.00 H ATOM 49 HB3 PHE A 4 18.319 13.649 12.115 1.00 0.00 H ATOM 50 HD1 PHE A 4 16.461 10.701 10.783 1.00 0.00 H ATOM 51 HD2 PHE A 4 17.278 13.214 14.120 1.00 0.00 H ATOM 52 HE1 PHE A 4 14.779 9.487 12.104 1.00 0.00 H ATOM 53 HE2 PHE A 4 15.598 12.001 15.447 1.00 0.00 H ATOM 54 HZ PHE A 4 14.347 10.135 14.440 1.00 0.00 H ATOM 55 N THR A 5 16.686 15.544 10.437 1.00 0.00 N ATOM 56 CA THR A 5 15.677 16.587 10.612 1.00 0.00 C ATOM 57 C THR A 5 14.879 16.780 9.344 1.00 0.00 C ATOM 58 O THR A 5 13.655 16.929 9.374 1.00 0.00 O ATOM 59 CB THR A 5 16.300 17.928 11.056 1.00 0.00 C ATOM 60 OG1 THR A 5 17.057 17.742 12.259 1.00 0.00 O ATOM 61 CG2 THR A 5 15.225 18.979 11.294 1.00 0.00 C ATOM 62 H THR A 5 17.621 15.801 10.370 1.00 0.00 H ATOM 63 HA THR A 5 15.012 16.253 11.361 1.00 0.00 H ATOM 64 HB THR A 5 16.959 18.278 10.274 1.00 0.00 H ATOM 65 HG1 THR A 5 17.958 17.496 12.036 1.00 0.00 H ATOM 66 HG21 THR A 5 15.650 19.813 11.833 1.00 0.00 H ATOM 67 HG22 THR A 5 14.422 18.548 11.873 1.00 0.00 H ATOM 68 HG23 THR A 5 14.840 19.323 10.345 1.00 0.00 H ATOM 69 N LYS A 6 15.584 16.726 8.239 1.00 0.00 N ATOM 70 CA LYS A 6 14.973 16.841 6.924 1.00 0.00 C ATOM 71 C LYS A 6 13.982 15.688 6.748 1.00 0.00 C ATOM 72 O LYS A 6 12.984 15.812 6.041 1.00 0.00 O ATOM 73 CB LYS A 6 16.053 16.796 5.827 1.00 0.00 C ATOM 74 CG LYS A 6 15.659 17.458 4.504 1.00 0.00 C ATOM 75 CD LYS A 6 14.475 16.776 3.830 1.00 0.00 C ATOM 76 CE LYS A 6 14.758 15.309 3.524 1.00 0.00 C ATOM 77 NZ LYS A 6 13.588 14.461 3.758 1.00 0.00 N ATOM 78 H LYS A 6 16.541 16.568 8.316 1.00 0.00 H ATOM 79 HA LYS A 6 14.442 17.781 6.874 1.00 0.00 H ATOM 80 HB2 LYS A 6 16.938 17.293 6.196 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.296 15.763 5.626 1.00 0.00 H ATOM 82 HG2 LYS A 6 15.399 18.488 4.697 1.00 0.00 H ATOM 83 HG3 LYS A 6 16.508 17.425 3.836 1.00 0.00 H ATOM 84 HD2 LYS A 6 13.617 16.842 4.476 1.00 0.00 H ATOM 85 HD3 LYS A 6 14.264 17.289 2.903 1.00 0.00 H ATOM 86 HE2 LYS A 6 15.051 15.222 2.488 1.00 0.00 H ATOM 87 HE3 LYS A 6 15.567 14.971 4.154 1.00 0.00 H ATOM 88 HZ1 LYS A 6 13.644 13.815 4.492 1.00 0.00 H ATOM 89 N ALA A 7 14.262 14.562 7.422 1.00 0.00 N ATOM 90 CA ALA A 7 13.393 13.389 7.344 1.00 0.00 C ATOM 91 C ALA A 7 11.992 13.702 7.836 1.00 0.00 C ATOM 92 O ALA A 7 11.010 13.291 7.222 1.00 0.00 O ATOM 93 CB ALA A 7 13.988 12.217 8.113 1.00 0.00 C ATOM 94 H ALA A 7 15.067 14.530 7.996 1.00 0.00 H ATOM 95 HA ALA A 7 13.321 13.115 6.309 1.00 0.00 H ATOM 96 HB1 ALA A 7 13.716 12.294 9.155 1.00 0.00 H ATOM 97 HB2 ALA A 7 15.064 12.234 8.019 1.00 0.00 H ATOM 98 HB3 ALA A 7 13.606 11.291 7.709 1.00 0.00 H ATOM 99 N ARG A 8 11.907 14.455 8.922 1.00 0.00 N ATOM 100 CA ARG A 8 10.621 14.861 9.476 1.00 0.00 C ATOM 101 C ARG A 8 9.789 15.567 8.413 1.00 0.00 C ATOM 102 O ARG A 8 8.565 15.436 8.370 1.00 0.00 O ATOM 103 CB ARG A 8 10.847 15.806 10.649 1.00 0.00 C ATOM 104 CG ARG A 8 11.502 15.146 11.854 1.00 0.00 C ATOM 105 CD ARG A 8 11.925 16.169 12.898 1.00 0.00 C ATOM 106 NE ARG A 8 10.791 16.920 13.440 1.00 0.00 N ATOM 107 CZ ARG A 8 10.906 17.889 14.353 1.00 0.00 C ATOM 108 NH1 ARG A 8 12.101 18.236 14.825 1.00 0.00 N ATOM 109 NH2 ARG A 8 9.820 18.514 14.796 1.00 0.00 N ATOM 110 H ARG A 8 12.731 14.769 9.351 1.00 0.00 H ATOM 111 HA ARG A 8 10.096 13.979 9.809 1.00 0.00 H ATOM 112 HB2 ARG A 8 11.486 16.613 10.314 1.00 0.00 H ATOM 113 HB3 ARG A 8 9.897 16.215 10.952 1.00 0.00 H ATOM 114 HG2 ARG A 8 10.797 14.462 12.303 1.00 0.00 H ATOM 115 HG3 ARG A 8 12.373 14.601 11.524 1.00 0.00 H ATOM 116 HD2 ARG A 8 12.419 15.652 13.707 1.00 0.00 H ATOM 117 HD3 ARG A 8 12.618 16.861 12.442 1.00 0.00 H ATOM 118 HE ARG A 8 9.897 16.690 13.110 1.00 0.00 H ATOM 119 HH11 ARG A 8 12.925 17.772 14.498 1.00 0.00 H ATOM 120 HH12 ARG A 8 12.177 18.964 15.507 1.00 0.00 H ATOM 121 HH21 ARG A 8 8.918 18.260 14.446 1.00 0.00 H ATOM 122 HH22 ARG A 8 9.904 19.239 15.480 1.00 0.00 H ATOM 123 N LYS A 9 10.481 16.310 7.556 1.00 0.00 N ATOM 124 CA LYS A 9 9.836 17.049 6.472 1.00 0.00 C ATOM 125 C LYS A 9 9.412 16.102 5.351 1.00 0.00 C ATOM 126 O LYS A 9 8.272 16.147 4.884 1.00 0.00 O ATOM 127 CB LYS A 9 10.778 18.124 5.920 1.00 0.00 C ATOM 128 CG LYS A 9 11.215 19.147 6.959 1.00 0.00 C ATOM 129 CD LYS A 9 12.153 20.188 6.364 1.00 0.00 C ATOM 130 CE LYS A 9 11.475 20.995 5.267 1.00 0.00 C ATOM 131 NZ LYS A 9 12.377 22.035 4.699 1.00 0.00 N ATOM 132 H LYS A 9 11.459 16.352 7.653 1.00 0.00 H ATOM 133 HA LYS A 9 8.957 17.527 6.875 1.00 0.00 H ATOM 134 HB2 LYS A 9 11.661 17.644 5.525 1.00 0.00 H ATOM 135 HB3 LYS A 9 10.276 18.647 5.120 1.00 0.00 H ATOM 136 HG2 LYS A 9 10.340 19.648 7.346 1.00 0.00 H ATOM 137 HG3 LYS A 9 11.724 18.635 7.762 1.00 0.00 H ATOM 138 HD2 LYS A 9 12.471 20.860 7.147 1.00 0.00 H ATOM 139 HD3 LYS A 9 13.015 19.684 5.948 1.00 0.00 H ATOM 140 HE2 LYS A 9 11.174 20.323 4.477 1.00 0.00 H ATOM 141 HE3 LYS A 9 10.600 21.476 5.681 1.00 0.00 H ATOM 142 HZ1 LYS A 9 12.714 22.667 5.454 1.00 0.00 H ATOM 143 HZ2 LYS A 9 11.869 22.601 3.990 1.00 0.00 H ATOM 144 HZ3 LYS A 9 13.198 21.587 4.244 1.00 0.00 H ATOM 145 N ASP A 10 10.338 15.242 4.931 1.00 0.00 N ATOM 146 CA ASP A 10 10.071 14.275 3.870 1.00 0.00 C ATOM 147 C ASP A 10 9.014 13.255 4.300 1.00 0.00 C ATOM 148 O ASP A 10 8.242 12.774 3.472 1.00 0.00 O ATOM 149 CB ASP A 10 11.362 13.555 3.460 1.00 0.00 C ATOM 150 CG ASP A 10 12.462 14.519 3.046 1.00 0.00 C ATOM 151 OD1 ASP A 10 12.296 15.303 2.109 1.00 0.00 O ATOM 152 H ASP A 10 11.226 15.256 5.349 1.00 0.00 H ATOM 153 HA ASP A 10 9.694 14.822 3.018 1.00 0.00 H ATOM 154 HB2 ASP A 10 11.719 12.968 4.293 1.00 0.00 H ATOM 155 HB3 ASP A 10 11.151 12.899 2.628 1.00 0.00 H ATOM 156 N LYS A 11 8.977 12.929 5.597 1.00 0.00 N ATOM 157 CA LYS A 11 8.009 11.968 6.116 1.00 0.00 C ATOM 158 C LYS A 11 6.658 12.631 6.306 1.00 0.00 C ATOM 159 O LYS A 11 5.648 12.142 5.802 1.00 0.00 O ATOM 160 CB LYS A 11 8.489 11.370 7.445 1.00 0.00 C ATOM 161 CG LYS A 11 7.643 10.198 7.942 1.00 0.00 C ATOM 162 CD LYS A 11 6.808 10.558 9.171 1.00 0.00 C ATOM 163 CE LYS A 11 5.561 11.364 8.821 1.00 0.00 C ATOM 164 NZ LYS A 11 4.637 10.616 7.964 1.00 0.00 N ATOM 165 H LYS A 11 9.608 13.350 6.218 1.00 0.00 H ATOM 166 HA LYS A 11 7.907 11.177 5.391 1.00 0.00 H ATOM 167 HB2 LYS A 11 9.504 11.023 7.322 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.473 12.142 8.200 1.00 0.00 H ATOM 169 HG2 LYS A 11 6.978 9.889 7.150 1.00 0.00 H ATOM 170 HG3 LYS A 11 8.302 9.380 8.195 1.00 0.00 H ATOM 171 HD2 LYS A 11 6.503 9.646 9.660 1.00 0.00 H ATOM 172 HD3 LYS A 11 7.420 11.138 9.847 1.00 0.00 H ATOM 173 HE2 LYS A 11 5.051 11.621 9.737 1.00 0.00 H ATOM 174 HE3 LYS A 11 5.859 12.264 8.317 1.00 0.00 H ATOM 175 HZ1 LYS A 11 4.845 9.673 7.794 1.00 0.00 H ATOM 176 N ARG A 12 6.648 13.751 7.034 1.00 0.00 N ATOM 177 CA ARG A 12 5.411 14.482 7.290 1.00 0.00 C ATOM 178 C ARG A 12 4.665 14.740 5.986 1.00 0.00 C ATOM 179 O ARG A 12 3.440 14.857 5.981 1.00 0.00 O ATOM 180 CB ARG A 12 5.684 15.803 8.020 1.00 0.00 C ATOM 181 CG ARG A 12 6.470 16.815 7.203 1.00 0.00 C ATOM 182 CD ARG A 12 6.665 18.119 7.965 1.00 0.00 C ATOM 183 NE ARG A 12 5.394 18.724 8.373 1.00 0.00 N ATOM 184 CZ ARG A 12 4.476 19.201 7.524 1.00 0.00 C ATOM 185 NH1 ARG A 12 4.690 19.186 6.212 1.00 0.00 N ATOM 186 NH2 ARG A 12 3.341 19.706 7.995 1.00 0.00 N ATOM 187 H ARG A 12 7.491 14.088 7.404 1.00 0.00 H ATOM 188 HA ARG A 12 4.792 13.859 7.919 1.00 0.00 H ATOM 189 HB2 ARG A 12 4.740 16.249 8.292 1.00 0.00 H ATOM 190 HB3 ARG A 12 6.242 15.591 8.921 1.00 0.00 H ATOM 191 HG2 ARG A 12 7.437 16.399 6.970 1.00 0.00 H ATOM 192 HG3 ARG A 12 5.934 17.018 6.288 1.00 0.00 H ATOM 193 HD2 ARG A 12 7.254 17.918 8.847 1.00 0.00 H ATOM 194 HD3 ARG A 12 7.196 18.814 7.331 1.00 0.00 H ATOM 195 HE ARG A 12 5.208 18.769 9.334 1.00 0.00 H ATOM 196 HH11 ARG A 12 5.543 18.818 5.845 1.00 0.00 H ATOM 197 HH12 ARG A 12 3.994 19.543 5.589 1.00 0.00 H ATOM 198 HH21 ARG A 12 3.174 19.730 8.981 1.00 0.00 H ATOM 199 HH22 ARG A 12 2.652 20.064 7.364 1.00 0.00 H ATOM 200 N LYS A 13 5.409 14.815 4.878 1.00 0.00 N ATOM 201 CA LYS A 13 4.797 15.042 3.572 1.00 0.00 C ATOM 202 C LYS A 13 4.291 13.742 2.962 1.00 0.00 C ATOM 203 O LYS A 13 3.143 13.665 2.522 1.00 0.00 O ATOM 204 CB LYS A 13 5.774 15.731 2.614 1.00 0.00 C ATOM 205 CG LYS A 13 6.075 17.181 2.967 1.00 0.00 C ATOM 206 CD LYS A 13 4.844 18.063 2.811 1.00 0.00 C ATOM 207 CE LYS A 13 5.182 19.533 3.009 1.00 0.00 C ATOM 208 NZ LYS A 13 3.980 20.406 2.883 1.00 0.00 N ATOM 209 H LYS A 13 6.390 14.705 4.943 1.00 0.00 H ATOM 210 HA LYS A 13 3.948 15.676 3.729 1.00 0.00 H ATOM 211 HB2 LYS A 13 6.706 15.185 2.616 1.00 0.00 H ATOM 212 HB3 LYS A 13 5.358 15.707 1.617 1.00 0.00 H ATOM 213 HG2 LYS A 13 6.411 17.230 3.991 1.00 0.00 H ATOM 214 HG3 LYS A 13 6.853 17.546 2.313 1.00 0.00 H ATOM 215 HD2 LYS A 13 4.439 17.928 1.820 1.00 0.00 H ATOM 216 HD3 LYS A 13 4.109 17.770 3.546 1.00 0.00 H ATOM 217 HE2 LYS A 13 5.608 19.663 3.992 1.00 0.00 H ATOM 218 HE3 LYS A 13 5.907 19.825 2.263 1.00 0.00 H ATOM 219 HZ1 LYS A 13 3.629 20.392 1.904 1.00 0.00 H ATOM 220 HZ2 LYS A 13 4.221 21.384 3.139 1.00 0.00 H ATOM 221 HZ3 LYS A 13 3.226 20.070 3.515 1.00 0.00 H ATOM 222 N LEU A 14 5.142 12.720 2.948 1.00 0.00 N ATOM 223 CA LEU A 14 4.762 11.422 2.402 1.00 0.00 C ATOM 224 C LEU A 14 3.555 10.844 3.142 1.00 0.00 C ATOM 225 O LEU A 14 2.768 10.097 2.557 1.00 0.00 O ATOM 226 CB LEU A 14 5.939 10.439 2.456 1.00 0.00 C ATOM 227 CG LEU A 14 6.840 10.416 1.212 1.00 0.00 C ATOM 228 CD1 LEU A 14 6.060 9.936 -0.002 1.00 0.00 C ATOM 229 CD2 LEU A 14 7.446 11.789 0.946 1.00 0.00 C ATOM 230 H LEU A 14 6.041 12.838 3.322 1.00 0.00 H ATOM 231 HA LEU A 14 4.486 11.574 1.369 1.00 0.00 H ATOM 232 HB2 LEU A 14 6.550 10.690 3.311 1.00 0.00 H ATOM 233 HB3 LEU A 14 5.543 9.445 2.601 1.00 0.00 H ATOM 234 HG LEU A 14 7.651 9.721 1.380 1.00 0.00 H ATOM 235 HD11 LEU A 14 5.281 10.647 -0.235 1.00 0.00 H ATOM 236 HD12 LEU A 14 5.617 8.974 0.211 1.00 0.00 H ATOM 237 HD13 LEU A 14 6.727 9.845 -0.846 1.00 0.00 H ATOM 238 HD21 LEU A 14 7.376 12.015 -0.108 1.00 0.00 H ATOM 239 HD22 LEU A 14 8.483 11.788 1.244 1.00 0.00 H ATOM 240 HD23 LEU A 14 6.910 12.537 1.509 1.00 0.00 H ATOM 241 N ASP A 15 3.400 11.199 4.424 1.00 0.00 N ATOM 242 CA ASP A 15 2.265 10.705 5.211 1.00 0.00 C ATOM 243 C ASP A 15 1.158 11.754 5.348 1.00 0.00 C ATOM 244 O ASP A 15 -0.018 11.412 5.468 1.00 0.00 O ATOM 245 CB ASP A 15 2.697 10.168 6.589 1.00 0.00 C ATOM 246 CG ASP A 15 3.526 11.132 7.424 1.00 0.00 C ATOM 247 OD1 ASP A 15 3.163 12.295 7.604 1.00 0.00 O ATOM 248 H ASP A 15 4.046 11.822 4.836 1.00 0.00 H ATOM 249 HA ASP A 15 1.850 9.878 4.653 1.00 0.00 H ATOM 250 HB2 ASP A 15 1.814 9.918 7.155 1.00 0.00 H ATOM 251 HB3 ASP A 15 3.278 9.270 6.439 1.00 0.00 H HETATM 252 N NH2 A 16 1.525 13.032 5.328 1.00 0.00 N HETATM 253 HN1 NH2 A 16 2.477 13.242 5.230 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.826 13.714 5.412 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 6 ATOM 1 N PHE A 1 22.574 14.544 10.150 1.00 0.00 N ATOM 2 CA PHE A 1 22.398 13.416 9.241 1.00 0.00 C ATOM 3 C PHE A 1 20.950 13.313 8.753 1.00 0.00 C ATOM 4 O PHE A 1 20.017 13.701 9.460 1.00 0.00 O ATOM 5 CB PHE A 1 22.858 12.108 9.903 1.00 0.00 C ATOM 6 CG PHE A 1 22.280 11.858 11.271 1.00 0.00 C ATOM 7 CD1 PHE A 1 21.035 11.271 11.421 1.00 0.00 C ATOM 8 CD2 PHE A 1 22.997 12.197 12.409 1.00 0.00 C ATOM 9 CE1 PHE A 1 20.514 11.031 12.678 1.00 0.00 C ATOM 10 CE2 PHE A 1 22.481 11.959 13.668 1.00 0.00 C ATOM 11 CZ PHE A 1 21.238 11.375 13.802 1.00 0.00 C ATOM 12 H1 PHE A 1 21.946 14.666 10.893 1.00 0.00 H ATOM 13 HA PHE A 1 23.026 13.601 8.381 1.00 0.00 H ATOM 14 HB2 PHE A 1 22.573 11.280 9.272 1.00 0.00 H ATOM 15 HB3 PHE A 1 23.935 12.124 9.995 1.00 0.00 H ATOM 16 HD1 PHE A 1 20.468 11.000 10.543 1.00 0.00 H ATOM 17 HD2 PHE A 1 23.969 12.657 12.306 1.00 0.00 H ATOM 18 HE1 PHE A 1 19.544 10.573 12.782 1.00 0.00 H ATOM 19 HE2 PHE A 1 23.049 12.227 14.547 1.00 0.00 H ATOM 20 HZ PHE A 1 20.831 11.187 14.785 1.00 0.00 H ATOM 21 N GLY A 2 20.786 12.810 7.524 1.00 0.00 N ATOM 22 CA GLY A 2 19.467 12.675 6.913 1.00 0.00 C ATOM 23 C GLY A 2 18.399 12.135 7.851 1.00 0.00 C ATOM 24 O GLY A 2 17.278 12.646 7.867 1.00 0.00 O ATOM 25 H GLY A 2 21.579 12.540 7.014 1.00 0.00 H ATOM 26 HA2 GLY A 2 19.153 13.644 6.560 1.00 0.00 H ATOM 27 HA3 GLY A 2 19.548 12.011 6.064 1.00 0.00 H ATOM 28 N GLY A 3 18.738 11.105 8.628 1.00 0.00 N ATOM 29 CA GLY A 3 17.780 10.518 9.556 1.00 0.00 C ATOM 30 C GLY A 3 17.596 11.333 10.829 1.00 0.00 C ATOM 31 O GLY A 3 17.611 10.775 11.927 1.00 0.00 O ATOM 32 H GLY A 3 19.645 10.738 8.570 1.00 0.00 H ATOM 33 HA2 GLY A 3 16.825 10.432 9.059 1.00 0.00 H ATOM 34 HA3 GLY A 3 18.121 9.529 9.823 1.00 0.00 H ATOM 35 N PHE A 4 17.417 12.649 10.687 1.00 0.00 N ATOM 36 CA PHE A 4 17.230 13.533 11.837 1.00 0.00 C ATOM 37 C PHE A 4 16.664 14.884 11.399 1.00 0.00 C ATOM 38 O PHE A 4 15.558 15.256 11.797 1.00 0.00 O ATOM 39 CB PHE A 4 18.564 13.732 12.568 1.00 0.00 C ATOM 40 CG PHE A 4 18.500 14.697 13.720 1.00 0.00 C ATOM 41 CD1 PHE A 4 17.556 14.547 14.724 1.00 0.00 C ATOM 42 CD2 PHE A 4 19.391 15.755 13.797 1.00 0.00 C ATOM 43 CE1 PHE A 4 17.503 15.435 15.783 1.00 0.00 C ATOM 44 CE2 PHE A 4 19.343 16.645 14.853 1.00 0.00 C ATOM 45 CZ PHE A 4 18.397 16.485 15.847 1.00 0.00 C ATOM 46 H PHE A 4 17.408 13.036 9.788 1.00 0.00 H ATOM 47 HA PHE A 4 16.528 13.062 12.508 1.00 0.00 H ATOM 48 HB2 PHE A 4 18.895 12.782 12.956 1.00 0.00 H ATOM 49 HB3 PHE A 4 19.298 14.101 11.865 1.00 0.00 H ATOM 50 HD1 PHE A 4 16.856 13.726 14.675 1.00 0.00 H ATOM 51 HD2 PHE A 4 20.131 15.882 13.021 1.00 0.00 H ATOM 52 HE1 PHE A 4 16.762 15.308 16.558 1.00 0.00 H ATOM 53 HE2 PHE A 4 20.045 17.465 14.900 1.00 0.00 H ATOM 54 HZ PHE A 4 18.359 17.180 16.673 1.00 0.00 H ATOM 55 N THR A 5 17.419 15.607 10.569 1.00 0.00 N ATOM 56 CA THR A 5 16.976 16.907 10.072 1.00 0.00 C ATOM 57 C THR A 5 16.085 16.739 8.860 1.00 0.00 C ATOM 58 O THR A 5 14.990 17.297 8.780 1.00 0.00 O ATOM 59 CB THR A 5 18.167 17.829 9.728 1.00 0.00 C ATOM 60 OG1 THR A 5 18.987 18.023 10.888 1.00 0.00 O ATOM 61 CG2 THR A 5 17.684 19.180 9.217 1.00 0.00 C ATOM 62 H THR A 5 18.286 15.253 10.277 1.00 0.00 H ATOM 63 HA THR A 5 16.402 17.359 10.835 1.00 0.00 H ATOM 64 HB THR A 5 18.758 17.358 8.954 1.00 0.00 H ATOM 65 HG1 THR A 5 19.607 17.293 10.970 1.00 0.00 H ATOM 66 HG21 THR A 5 17.236 19.056 8.242 1.00 0.00 H ATOM 67 HG22 THR A 5 18.521 19.858 9.145 1.00 0.00 H ATOM 68 HG23 THR A 5 16.952 19.583 9.901 1.00 0.00 H ATOM 69 N LYS A 6 16.568 15.933 7.948 1.00 0.00 N ATOM 70 CA LYS A 6 15.849 15.610 6.725 1.00 0.00 C ATOM 71 C LYS A 6 14.760 14.560 6.999 1.00 0.00 C ATOM 72 O LYS A 6 13.965 14.237 6.114 1.00 0.00 O ATOM 73 CB LYS A 6 16.840 15.123 5.653 1.00 0.00 C ATOM 74 CG LYS A 6 16.193 14.443 4.456 1.00 0.00 C ATOM 75 CD LYS A 6 16.356 12.933 4.531 1.00 0.00 C ATOM 76 CE LYS A 6 15.418 12.212 3.576 1.00 0.00 C ATOM 77 NZ LYS A 6 14.109 11.961 4.181 1.00 0.00 N ATOM 78 H LYS A 6 17.432 15.521 8.122 1.00 0.00 H ATOM 79 HA LYS A 6 15.374 16.515 6.375 1.00 0.00 H ATOM 80 HB2 LYS A 6 17.402 15.971 5.293 1.00 0.00 H ATOM 81 HB3 LYS A 6 17.523 14.423 6.110 1.00 0.00 H ATOM 82 HG2 LYS A 6 15.142 14.686 4.434 1.00 0.00 H ATOM 83 HG3 LYS A 6 16.665 14.802 3.552 1.00 0.00 H ATOM 84 HD2 LYS A 6 17.374 12.679 4.278 1.00 0.00 H ATOM 85 HD3 LYS A 6 16.144 12.608 5.540 1.00 0.00 H ATOM 86 HE2 LYS A 6 15.285 12.821 2.693 1.00 0.00 H ATOM 87 HE3 LYS A 6 15.863 11.269 3.297 1.00 0.00 H ATOM 88 HZ1 LYS A 6 14.094 11.674 5.119 1.00 0.00 H ATOM 89 N ALA A 7 14.719 14.034 8.234 1.00 0.00 N ATOM 90 CA ALA A 7 13.723 13.030 8.602 1.00 0.00 C ATOM 91 C ALA A 7 12.320 13.616 8.605 1.00 0.00 C ATOM 92 O ALA A 7 11.410 13.064 7.984 1.00 0.00 O ATOM 93 CB ALA A 7 14.056 12.413 9.953 1.00 0.00 C ATOM 94 H ALA A 7 15.368 14.332 8.910 1.00 0.00 H ATOM 95 HA ALA A 7 13.757 12.260 7.858 1.00 0.00 H ATOM 96 HB1 ALA A 7 13.240 11.782 10.272 1.00 0.00 H ATOM 97 HB2 ALA A 7 14.207 13.198 10.680 1.00 0.00 H ATOM 98 HB3 ALA A 7 14.956 11.823 9.868 1.00 0.00 H ATOM 99 N ARG A 8 12.158 14.748 9.280 1.00 0.00 N ATOM 100 CA ARG A 8 10.872 15.429 9.331 1.00 0.00 C ATOM 101 C ARG A 8 10.434 15.792 7.928 1.00 0.00 C ATOM 102 O ARG A 8 9.246 15.871 7.625 1.00 0.00 O ATOM 103 CB ARG A 8 10.981 16.704 10.159 1.00 0.00 C ATOM 104 CG ARG A 8 10.249 16.647 11.490 1.00 0.00 C ATOM 105 CD ARG A 8 10.856 15.613 12.427 1.00 0.00 C ATOM 106 NE ARG A 8 10.173 15.578 13.721 1.00 0.00 N ATOM 107 CZ ARG A 8 10.172 16.586 14.601 1.00 0.00 C ATOM 108 NH1 ARG A 8 10.876 17.692 14.369 1.00 0.00 N ATOM 109 NH2 ARG A 8 9.476 16.481 15.728 1.00 0.00 N ATOM 110 H ARG A 8 12.929 15.149 9.736 1.00 0.00 H ATOM 111 HA ARG A 8 10.146 14.765 9.775 1.00 0.00 H ATOM 112 HB2 ARG A 8 12.026 16.895 10.351 1.00 0.00 H ATOM 113 HB3 ARG A 8 10.579 17.523 9.580 1.00 0.00 H ATOM 114 HG2 ARG A 8 10.302 17.618 11.959 1.00 0.00 H ATOM 115 HG3 ARG A 8 9.214 16.391 11.309 1.00 0.00 H ATOM 116 HD2 ARG A 8 10.780 14.640 11.965 1.00 0.00 H ATOM 117 HD3 ARG A 8 11.897 15.856 12.584 1.00 0.00 H ATOM 118 HE ARG A 8 9.672 14.765 13.941 1.00 0.00 H ATOM 119 HH11 ARG A 8 11.417 17.777 13.533 1.00 0.00 H ATOM 120 HH12 ARG A 8 10.864 18.440 15.032 1.00 0.00 H ATOM 121 HH21 ARG A 8 8.956 15.648 15.919 1.00 0.00 H ATOM 122 HH22 ARG A 8 9.471 17.234 16.385 1.00 0.00 H ATOM 123 N LYS A 9 11.420 16.020 7.081 1.00 0.00 N ATOM 124 CA LYS A 9 11.167 16.393 5.695 1.00 0.00 C ATOM 125 C LYS A 9 10.524 15.240 4.931 1.00 0.00 C ATOM 126 O LYS A 9 9.481 15.409 4.297 1.00 0.00 O ATOM 127 CB LYS A 9 12.470 16.817 5.007 1.00 0.00 C ATOM 128 CG LYS A 9 12.426 18.218 4.416 1.00 0.00 C ATOM 129 CD LYS A 9 11.350 18.347 3.348 1.00 0.00 C ATOM 130 CE LYS A 9 11.337 19.738 2.731 1.00 0.00 C ATOM 131 NZ LYS A 9 12.616 20.056 2.034 1.00 0.00 N ATOM 132 H LYS A 9 12.347 15.934 7.404 1.00 0.00 H ATOM 133 HA LYS A 9 10.485 17.229 5.699 1.00 0.00 H ATOM 134 HB2 LYS A 9 13.272 16.781 5.729 1.00 0.00 H ATOM 135 HB3 LYS A 9 12.686 16.121 4.209 1.00 0.00 H ATOM 136 HG2 LYS A 9 12.219 18.925 5.207 1.00 0.00 H ATOM 137 HG3 LYS A 9 13.387 18.441 3.976 1.00 0.00 H ATOM 138 HD2 LYS A 9 11.539 17.622 2.571 1.00 0.00 H ATOM 139 HD3 LYS A 9 10.387 18.154 3.797 1.00 0.00 H ATOM 140 HE2 LYS A 9 10.528 19.794 2.020 1.00 0.00 H ATOM 141 HE3 LYS A 9 11.175 20.464 3.515 1.00 0.00 H ATOM 142 HZ1 LYS A 9 13.360 20.269 2.730 1.00 0.00 H ATOM 143 HZ2 LYS A 9 12.490 20.882 1.416 1.00 0.00 H ATOM 144 HZ3 LYS A 9 12.919 19.248 1.454 1.00 0.00 H ATOM 145 N ASP A 10 11.156 14.069 4.996 1.00 0.00 N ATOM 146 CA ASP A 10 10.657 12.879 4.309 1.00 0.00 C ATOM 147 C ASP A 10 9.352 12.363 4.919 1.00 0.00 C ATOM 148 O ASP A 10 8.480 11.878 4.195 1.00 0.00 O ATOM 149 CB ASP A 10 11.703 11.759 4.336 1.00 0.00 C ATOM 150 CG ASP A 10 12.952 12.083 3.533 1.00 0.00 C ATOM 151 OD1 ASP A 10 12.876 12.418 2.349 1.00 0.00 O ATOM 152 H ASP A 10 11.984 14.005 5.518 1.00 0.00 H ATOM 153 HA ASP A 10 10.471 13.151 3.282 1.00 0.00 H ATOM 154 HB2 ASP A 10 11.997 11.579 5.360 1.00 0.00 H ATOM 155 HB3 ASP A 10 11.262 10.860 3.933 1.00 0.00 H ATOM 156 N LYS A 11 9.223 12.451 6.247 1.00 0.00 N ATOM 157 CA LYS A 11 8.023 11.967 6.928 1.00 0.00 C ATOM 158 C LYS A 11 6.856 12.923 6.710 1.00 0.00 C ATOM 159 O LYS A 11 5.812 12.525 6.194 1.00 0.00 O ATOM 160 CB LYS A 11 8.277 11.783 8.432 1.00 0.00 C ATOM 161 CG LYS A 11 7.429 10.684 9.074 1.00 0.00 C ATOM 162 CD LYS A 11 5.951 10.820 8.729 1.00 0.00 C ATOM 163 CE LYS A 11 5.331 12.057 9.362 1.00 0.00 C ATOM 164 NZ LYS A 11 4.327 12.685 8.498 1.00 0.00 N ATOM 165 H LYS A 11 9.948 12.840 6.776 1.00 0.00 H ATOM 166 HA LYS A 11 7.767 11.012 6.499 1.00 0.00 H ATOM 167 HB2 LYS A 11 9.317 11.536 8.580 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.063 12.713 8.938 1.00 0.00 H ATOM 169 HG2 LYS A 11 7.780 9.723 8.726 1.00 0.00 H ATOM 170 HG3 LYS A 11 7.544 10.741 10.147 1.00 0.00 H ATOM 171 HD2 LYS A 11 5.846 10.885 7.658 1.00 0.00 H ATOM 172 HD3 LYS A 11 5.428 9.945 9.088 1.00 0.00 H ATOM 173 HE2 LYS A 11 4.861 11.771 10.291 1.00 0.00 H ATOM 174 HE3 LYS A 11 6.115 12.772 9.565 1.00 0.00 H ATOM 175 HZ1 LYS A 11 4.376 13.654 8.397 1.00 0.00 H ATOM 176 N ARG A 12 7.040 14.186 7.097 1.00 0.00 N ATOM 177 CA ARG A 12 5.996 15.194 6.936 1.00 0.00 C ATOM 178 C ARG A 12 5.519 15.228 5.492 1.00 0.00 C ATOM 179 O ARG A 12 4.363 15.546 5.213 1.00 0.00 O ATOM 180 CB ARG A 12 6.496 16.576 7.365 1.00 0.00 C ATOM 181 CG ARG A 12 5.376 17.575 7.611 1.00 0.00 C ATOM 182 CD ARG A 12 5.908 18.885 8.174 1.00 0.00 C ATOM 183 NE ARG A 12 4.835 19.754 8.660 1.00 0.00 N ATOM 184 CZ ARG A 12 4.082 19.491 9.736 1.00 0.00 C ATOM 185 NH1 ARG A 12 4.298 18.397 10.465 1.00 0.00 N ATOM 186 NH2 ARG A 12 3.116 20.332 10.089 1.00 0.00 N ATOM 187 H ARG A 12 7.897 14.442 7.496 1.00 0.00 H ATOM 188 HA ARG A 12 5.168 14.913 7.565 1.00 0.00 H ATOM 189 HB2 ARG A 12 7.065 16.474 8.278 1.00 0.00 H ATOM 190 HB3 ARG A 12 7.139 16.971 6.592 1.00 0.00 H ATOM 191 HG2 ARG A 12 4.874 17.775 6.675 1.00 0.00 H ATOM 192 HG3 ARG A 12 4.674 17.149 8.313 1.00 0.00 H ATOM 193 HD2 ARG A 12 6.576 18.665 8.993 1.00 0.00 H ATOM 194 HD3 ARG A 12 6.452 19.402 7.397 1.00 0.00 H ATOM 195 HE ARG A 12 4.658 20.575 8.155 1.00 0.00 H ATOM 196 HH11 ARG A 12 5.028 17.761 10.215 1.00 0.00 H ATOM 197 HH12 ARG A 12 3.730 18.211 11.267 1.00 0.00 H ATOM 198 HH21 ARG A 12 2.951 21.160 9.553 1.00 0.00 H ATOM 199 HH22 ARG A 12 2.553 20.139 10.893 1.00 0.00 H ATOM 200 N LYS A 13 6.418 14.884 4.574 1.00 0.00 N ATOM 201 CA LYS A 13 6.075 14.868 3.157 1.00 0.00 C ATOM 202 C LYS A 13 5.162 13.691 2.833 1.00 0.00 C ATOM 203 O LYS A 13 4.115 13.866 2.207 1.00 0.00 O ATOM 204 CB LYS A 13 7.340 14.817 2.290 1.00 0.00 C ATOM 205 CG LYS A 13 7.074 14.948 0.797 1.00 0.00 C ATOM 206 CD LYS A 13 6.414 16.277 0.458 1.00 0.00 C ATOM 207 CE LYS A 13 6.192 16.430 -1.040 1.00 0.00 C ATOM 208 NZ LYS A 13 5.303 15.366 -1.591 1.00 0.00 N ATOM 209 H LYS A 13 7.328 14.628 4.859 1.00 0.00 H ATOM 210 HA LYS A 13 5.538 15.774 2.948 1.00 0.00 H ATOM 211 HB2 LYS A 13 7.996 15.621 2.586 1.00 0.00 H ATOM 212 HB3 LYS A 13 7.841 13.876 2.462 1.00 0.00 H ATOM 213 HG2 LYS A 13 8.012 14.881 0.267 1.00 0.00 H ATOM 214 HG3 LYS A 13 6.425 14.144 0.484 1.00 0.00 H ATOM 215 HD2 LYS A 13 5.459 16.332 0.960 1.00 0.00 H ATOM 216 HD3 LYS A 13 7.049 17.080 0.802 1.00 0.00 H ATOM 217 HE2 LYS A 13 5.740 17.392 -1.226 1.00 0.00 H ATOM 218 HE3 LYS A 13 7.149 16.381 -1.539 1.00 0.00 H ATOM 219 HZ1 LYS A 13 4.423 15.312 -1.038 1.00 0.00 H ATOM 220 HZ2 LYS A 13 5.781 14.444 -1.551 1.00 0.00 H ATOM 221 HZ3 LYS A 13 5.066 15.577 -2.581 1.00 0.00 H ATOM 222 N LEU A 14 5.558 12.496 3.269 1.00 0.00 N ATOM 223 CA LEU A 14 4.764 11.294 3.029 1.00 0.00 C ATOM 224 C LEU A 14 3.466 11.296 3.849 1.00 0.00 C ATOM 225 O LEU A 14 2.584 10.468 3.609 1.00 0.00 O ATOM 226 CB LEU A 14 5.587 10.028 3.318 1.00 0.00 C ATOM 227 CG LEU A 14 6.116 9.874 4.750 1.00 0.00 C ATOM 228 CD1 LEU A 14 4.978 9.626 5.729 1.00 0.00 C ATOM 229 CD2 LEU A 14 7.134 8.745 4.817 1.00 0.00 C ATOM 230 H LEU A 14 6.399 12.422 3.767 1.00 0.00 H ATOM 231 HA LEU A 14 4.498 11.294 1.982 1.00 0.00 H ATOM 232 HB2 LEU A 14 4.971 9.170 3.095 1.00 0.00 H ATOM 233 HB3 LEU A 14 6.434 10.020 2.647 1.00 0.00 H ATOM 234 HG LEU A 14 6.611 10.787 5.041 1.00 0.00 H ATOM 235 HD11 LEU A 14 5.360 9.124 6.605 1.00 0.00 H ATOM 236 HD12 LEU A 14 4.226 9.010 5.260 1.00 0.00 H ATOM 237 HD13 LEU A 14 4.541 10.569 6.018 1.00 0.00 H ATOM 238 HD21 LEU A 14 7.804 8.913 5.648 1.00 0.00 H ATOM 239 HD22 LEU A 14 7.701 8.717 3.898 1.00 0.00 H ATOM 240 HD23 LEU A 14 6.621 7.805 4.952 1.00 0.00 H ATOM 241 N ASP A 15 3.339 12.228 4.807 1.00 0.00 N ATOM 242 CA ASP A 15 2.128 12.309 5.629 1.00 0.00 C ATOM 243 C ASP A 15 1.063 13.154 4.933 1.00 0.00 C ATOM 244 O ASP A 15 -0.075 12.718 4.761 1.00 0.00 O ATOM 245 CB ASP A 15 2.417 12.892 7.022 1.00 0.00 C ATOM 246 CG ASP A 15 3.354 12.031 7.859 1.00 0.00 C ATOM 247 OD1 ASP A 15 3.188 10.813 7.942 1.00 0.00 O ATOM 248 H ASP A 15 4.065 12.880 4.952 1.00 0.00 H ATOM 249 HA ASP A 15 1.746 11.306 5.745 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.868 13.865 6.906 1.00 0.00 H ATOM 251 HB3 ASP A 15 1.485 12.998 7.558 1.00 0.00 H HETATM 252 N NH2 A 16 1.431 14.370 4.535 1.00 0.00 N HETATM 253 HN1 NH2 A 16 2.354 14.655 4.704 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.764 14.932 4.089 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 7 ATOM 1 N PHE A 1 18.140 12.093 5.980 1.00 0.00 N ATOM 2 CA PHE A 1 19.200 11.724 6.912 1.00 0.00 C ATOM 3 C PHE A 1 18.647 10.897 8.071 1.00 0.00 C ATOM 4 O PHE A 1 17.592 11.213 8.626 1.00 0.00 O ATOM 5 CB PHE A 1 19.908 12.971 7.458 1.00 0.00 C ATOM 6 CG PHE A 1 20.638 13.773 6.413 1.00 0.00 C ATOM 7 CD1 PHE A 1 19.958 14.336 5.344 1.00 0.00 C ATOM 8 CD2 PHE A 1 22.009 13.962 6.502 1.00 0.00 C ATOM 9 CE1 PHE A 1 20.630 15.071 4.386 1.00 0.00 C ATOM 10 CE2 PHE A 1 22.685 14.696 5.546 1.00 0.00 C ATOM 11 CZ PHE A 1 21.995 15.251 4.487 1.00 0.00 C ATOM 12 H1 PHE A 1 17.724 11.398 5.428 1.00 0.00 H ATOM 13 HA PHE A 1 19.917 11.125 6.372 1.00 0.00 H ATOM 14 HB2 PHE A 1 19.176 13.619 7.918 1.00 0.00 H ATOM 15 HB3 PHE A 1 20.627 12.667 8.205 1.00 0.00 H ATOM 16 HD1 PHE A 1 18.890 14.198 5.263 1.00 0.00 H ATOM 17 HD2 PHE A 1 22.551 13.528 7.329 1.00 0.00 H ATOM 18 HE1 PHE A 1 20.088 15.504 3.558 1.00 0.00 H ATOM 19 HE2 PHE A 1 23.754 14.835 5.628 1.00 0.00 H ATOM 20 HZ PHE A 1 22.522 15.826 3.740 1.00 0.00 H ATOM 21 N GLY A 2 19.374 9.840 8.434 1.00 0.00 N ATOM 22 CA GLY A 2 18.958 8.977 9.530 1.00 0.00 C ATOM 23 C GLY A 2 18.894 9.705 10.864 1.00 0.00 C ATOM 24 O GLY A 2 18.040 9.401 11.697 1.00 0.00 O ATOM 25 H GLY A 2 20.208 9.645 7.956 1.00 0.00 H ATOM 26 HA2 GLY A 2 17.979 8.577 9.305 1.00 0.00 H ATOM 27 HA3 GLY A 2 19.656 8.158 9.613 1.00 0.00 H ATOM 28 N GLY A 3 19.807 10.663 11.065 1.00 0.00 N ATOM 29 CA GLY A 3 19.850 11.425 12.306 1.00 0.00 C ATOM 30 C GLY A 3 18.561 12.178 12.594 1.00 0.00 C ATOM 31 O GLY A 3 17.609 11.603 13.127 1.00 0.00 O ATOM 32 H GLY A 3 20.464 10.852 10.362 1.00 0.00 H ATOM 33 HA2 GLY A 3 20.044 10.747 13.123 1.00 0.00 H ATOM 34 HA3 GLY A 3 20.662 12.136 12.247 1.00 0.00 H ATOM 35 N PHE A 4 18.531 13.469 12.254 1.00 0.00 N ATOM 36 CA PHE A 4 17.350 14.297 12.495 1.00 0.00 C ATOM 37 C PHE A 4 17.458 15.644 11.767 1.00 0.00 C ATOM 38 O PHE A 4 17.278 16.706 12.370 1.00 0.00 O ATOM 39 CB PHE A 4 17.163 14.512 14.006 1.00 0.00 C ATOM 40 CG PHE A 4 15.933 15.300 14.369 1.00 0.00 C ATOM 41 CD1 PHE A 4 14.712 15.015 13.780 1.00 0.00 C ATOM 42 CD2 PHE A 4 16.002 16.327 15.297 1.00 0.00 C ATOM 43 CE1 PHE A 4 13.583 15.740 14.109 1.00 0.00 C ATOM 44 CE2 PHE A 4 14.876 17.056 15.630 1.00 0.00 C ATOM 45 CZ PHE A 4 13.665 16.762 15.035 1.00 0.00 C ATOM 46 H PHE A 4 19.323 13.875 11.840 1.00 0.00 H ATOM 47 HA PHE A 4 16.492 13.766 12.110 1.00 0.00 H ATOM 48 HB2 PHE A 4 17.092 13.550 14.491 1.00 0.00 H ATOM 49 HB3 PHE A 4 18.023 15.039 14.394 1.00 0.00 H ATOM 50 HD1 PHE A 4 14.646 14.217 13.057 1.00 0.00 H ATOM 51 HD2 PHE A 4 16.949 16.558 15.763 1.00 0.00 H ATOM 52 HE1 PHE A 4 12.637 15.508 13.643 1.00 0.00 H ATOM 53 HE2 PHE A 4 14.942 17.854 16.354 1.00 0.00 H ATOM 54 HZ PHE A 4 12.783 17.329 15.292 1.00 0.00 H ATOM 55 N THR A 5 17.748 15.597 10.465 1.00 0.00 N ATOM 56 CA THR A 5 17.869 16.802 9.664 1.00 0.00 C ATOM 57 C THR A 5 16.550 17.093 8.960 1.00 0.00 C ATOM 58 O THR A 5 15.491 17.079 9.592 1.00 0.00 O ATOM 59 CB THR A 5 19.050 16.688 8.662 1.00 0.00 C ATOM 60 OG1 THR A 5 20.175 16.062 9.296 1.00 0.00 O ATOM 61 CG2 THR A 5 19.471 18.064 8.154 1.00 0.00 C ATOM 62 H THR A 5 17.873 14.731 10.028 1.00 0.00 H ATOM 63 HA THR A 5 18.063 17.613 10.313 1.00 0.00 H ATOM 64 HB THR A 5 18.739 16.086 7.820 1.00 0.00 H ATOM 65 HG1 THR A 5 20.406 16.544 10.094 1.00 0.00 H ATOM 66 HG21 THR A 5 19.623 18.022 7.085 1.00 0.00 H ATOM 67 HG22 THR A 5 20.390 18.362 8.636 1.00 0.00 H ATOM 68 HG23 THR A 5 18.697 18.784 8.379 1.00 0.00 H ATOM 69 N LYS A 6 16.606 17.331 7.663 1.00 0.00 N ATOM 70 CA LYS A 6 15.405 17.595 6.878 1.00 0.00 C ATOM 71 C LYS A 6 14.728 16.273 6.492 1.00 0.00 C ATOM 72 O LYS A 6 13.986 16.206 5.510 1.00 0.00 O ATOM 73 CB LYS A 6 15.763 18.391 5.614 1.00 0.00 C ATOM 74 CG LYS A 6 14.554 18.800 4.783 1.00 0.00 C ATOM 75 CD LYS A 6 14.835 18.674 3.293 1.00 0.00 C ATOM 76 CE LYS A 6 13.565 18.373 2.510 1.00 0.00 C ATOM 77 NZ LYS A 6 12.956 17.104 2.919 1.00 0.00 N ATOM 78 H LYS A 6 17.468 17.306 7.224 1.00 0.00 H ATOM 79 HA LYS A 6 14.727 18.176 7.485 1.00 0.00 H ATOM 80 HB2 LYS A 6 16.291 19.287 5.905 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.410 17.788 4.996 1.00 0.00 H ATOM 82 HG2 LYS A 6 13.717 18.170 5.038 1.00 0.00 H ATOM 83 HG3 LYS A 6 14.310 19.828 5.006 1.00 0.00 H ATOM 84 HD2 LYS A 6 15.254 19.603 2.936 1.00 0.00 H ATOM 85 HD3 LYS A 6 15.543 17.873 3.136 1.00 0.00 H ATOM 86 HE2 LYS A 6 12.857 19.172 2.675 1.00 0.00 H ATOM 87 HE3 LYS A 6 13.810 18.322 1.459 1.00 0.00 H ATOM 88 HZ1 LYS A 6 13.512 16.478 3.429 1.00 0.00 H ATOM 89 N ALA A 7 14.990 15.213 7.261 1.00 0.00 N ATOM 90 CA ALA A 7 14.401 13.911 6.964 1.00 0.00 C ATOM 91 C ALA A 7 12.999 13.783 7.532 1.00 0.00 C ATOM 92 O ALA A 7 12.064 13.430 6.815 1.00 0.00 O ATOM 93 CB ALA A 7 15.298 12.788 7.464 1.00 0.00 C ATOM 94 H ALA A 7 15.597 15.308 8.036 1.00 0.00 H ATOM 95 HA ALA A 7 14.327 13.835 5.898 1.00 0.00 H ATOM 96 HB1 ALA A 7 15.076 11.881 6.922 1.00 0.00 H ATOM 97 HB2 ALA A 7 15.124 12.630 8.518 1.00 0.00 H ATOM 98 HB3 ALA A 7 16.332 13.057 7.306 1.00 0.00 H ATOM 99 N ARG A 8 12.859 14.087 8.812 1.00 0.00 N ATOM 100 CA ARG A 8 11.569 14.026 9.482 1.00 0.00 C ATOM 101 C ARG A 8 10.579 14.971 8.825 1.00 0.00 C ATOM 102 O ARG A 8 9.368 14.749 8.842 1.00 0.00 O ATOM 103 CB ARG A 8 11.734 14.426 10.940 1.00 0.00 C ATOM 104 CG ARG A 8 12.567 13.451 11.759 1.00 0.00 C ATOM 105 CD ARG A 8 11.971 12.051 11.751 1.00 0.00 C ATOM 106 NE ARG A 8 12.766 11.108 12.540 1.00 0.00 N ATOM 107 CZ ARG A 8 14.003 10.709 12.220 1.00 0.00 C ATOM 108 NH1 ARG A 8 14.581 11.121 11.093 1.00 0.00 N ATOM 109 NH2 ARG A 8 14.659 9.881 13.027 1.00 0.00 N ATOM 110 H ARG A 8 13.647 14.374 9.321 1.00 0.00 H ATOM 111 HA ARG A 8 11.196 13.017 9.420 1.00 0.00 H ATOM 112 HB2 ARG A 8 12.218 15.394 10.970 1.00 0.00 H ATOM 113 HB3 ARG A 8 10.758 14.509 11.387 1.00 0.00 H ATOM 114 HG2 ARG A 8 13.563 13.410 11.346 1.00 0.00 H ATOM 115 HG3 ARG A 8 12.615 13.805 12.779 1.00 0.00 H ATOM 116 HD2 ARG A 8 10.974 12.096 12.162 1.00 0.00 H ATOM 117 HD3 ARG A 8 11.922 11.700 10.730 1.00 0.00 H ATOM 118 HE ARG A 8 12.363 10.763 13.364 1.00 0.00 H ATOM 119 HH11 ARG A 8 14.094 11.733 10.472 1.00 0.00 H ATOM 120 HH12 ARG A 8 15.507 10.816 10.866 1.00 0.00 H ATOM 121 HH21 ARG A 8 14.228 9.559 13.870 1.00 0.00 H ATOM 122 HH22 ARG A 8 15.583 9.580 12.793 1.00 0.00 H ATOM 123 N LYS A 9 11.120 16.036 8.266 1.00 0.00 N ATOM 124 CA LYS A 9 10.307 17.057 7.610 1.00 0.00 C ATOM 125 C LYS A 9 9.682 16.512 6.329 1.00 0.00 C ATOM 126 O LYS A 9 8.459 16.499 6.181 1.00 0.00 O ATOM 127 CB LYS A 9 11.164 18.294 7.302 1.00 0.00 C ATOM 128 CG LYS A 9 10.369 19.585 7.127 1.00 0.00 C ATOM 129 CD LYS A 9 9.451 19.548 5.913 1.00 0.00 C ATOM 130 CE LYS A 9 10.234 19.413 4.615 1.00 0.00 C ATOM 131 NZ LYS A 9 9.337 19.366 3.427 1.00 0.00 N ATOM 132 H LYS A 9 12.098 16.138 8.304 1.00 0.00 H ATOM 133 HA LYS A 9 9.516 17.338 8.290 1.00 0.00 H ATOM 134 HB2 LYS A 9 11.864 18.439 8.111 1.00 0.00 H ATOM 135 HB3 LYS A 9 11.717 18.113 6.392 1.00 0.00 H ATOM 136 HG2 LYS A 9 9.768 19.744 8.009 1.00 0.00 H ATOM 137 HG3 LYS A 9 11.064 20.405 7.015 1.00 0.00 H ATOM 138 HD2 LYS A 9 8.779 18.710 6.005 1.00 0.00 H ATOM 139 HD3 LYS A 9 8.880 20.465 5.882 1.00 0.00 H ATOM 140 HE2 LYS A 9 10.897 20.260 4.520 1.00 0.00 H ATOM 141 HE3 LYS A 9 10.816 18.504 4.652 1.00 0.00 H ATOM 142 HZ1 LYS A 9 8.788 20.247 3.357 1.00 0.00 H ATOM 143 HZ2 LYS A 9 8.677 18.566 3.508 1.00 0.00 H ATOM 144 HZ3 LYS A 9 9.899 19.251 2.559 1.00 0.00 H ATOM 145 N ASP A 10 10.532 16.059 5.409 1.00 0.00 N ATOM 146 CA ASP A 10 10.073 15.510 4.134 1.00 0.00 C ATOM 147 C ASP A 10 9.390 14.148 4.303 1.00 0.00 C ATOM 148 O ASP A 10 8.548 13.777 3.488 1.00 0.00 O ATOM 149 CB ASP A 10 11.239 15.400 3.144 1.00 0.00 C ATOM 150 CG ASP A 10 11.699 16.758 2.637 1.00 0.00 C ATOM 151 OD1 ASP A 10 10.933 17.483 2.001 1.00 0.00 O ATOM 152 H ASP A 10 11.495 16.095 5.594 1.00 0.00 H ATOM 153 HA ASP A 10 9.348 16.202 3.731 1.00 0.00 H ATOM 154 HB2 ASP A 10 12.072 14.916 3.631 1.00 0.00 H ATOM 155 HB3 ASP A 10 10.928 14.806 2.297 1.00 0.00 H ATOM 156 N LYS A 11 9.750 13.407 5.355 1.00 0.00 N ATOM 157 CA LYS A 11 9.158 12.092 5.605 1.00 0.00 C ATOM 158 C LYS A 11 7.790 12.230 6.264 1.00 0.00 C ATOM 159 O LYS A 11 6.770 11.888 5.670 1.00 0.00 O ATOM 160 CB LYS A 11 10.090 11.245 6.487 1.00 0.00 C ATOM 161 CG LYS A 11 9.468 9.958 7.031 1.00 0.00 C ATOM 162 CD LYS A 11 9.412 8.833 5.997 1.00 0.00 C ATOM 163 CE LYS A 11 8.418 9.107 4.874 1.00 0.00 C ATOM 164 NZ LYS A 11 7.068 9.384 5.370 1.00 0.00 N ATOM 165 H LYS A 11 10.421 13.752 5.981 1.00 0.00 H ATOM 166 HA LYS A 11 9.035 11.602 4.654 1.00 0.00 H ATOM 167 HB2 LYS A 11 10.961 10.976 5.908 1.00 0.00 H ATOM 168 HB3 LYS A 11 10.406 11.846 7.328 1.00 0.00 H ATOM 169 HG2 LYS A 11 10.056 9.620 7.870 1.00 0.00 H ATOM 170 HG3 LYS A 11 8.464 10.174 7.366 1.00 0.00 H ATOM 171 HD2 LYS A 11 10.393 8.713 5.564 1.00 0.00 H ATOM 172 HD3 LYS A 11 9.128 7.919 6.498 1.00 0.00 H ATOM 173 HE2 LYS A 11 8.761 9.957 4.306 1.00 0.00 H ATOM 174 HE3 LYS A 11 8.381 8.241 4.229 1.00 0.00 H ATOM 175 HZ1 LYS A 11 6.988 9.840 6.233 1.00 0.00 H ATOM 176 N ARG A 12 7.780 12.739 7.493 1.00 0.00 N ATOM 177 CA ARG A 12 6.540 12.922 8.243 1.00 0.00 C ATOM 178 C ARG A 12 5.500 13.656 7.396 1.00 0.00 C ATOM 179 O ARG A 12 4.301 13.400 7.513 1.00 0.00 O ATOM 180 CB ARG A 12 6.815 13.698 9.540 1.00 0.00 C ATOM 181 CG ARG A 12 5.865 13.366 10.688 1.00 0.00 C ATOM 182 CD ARG A 12 4.422 13.736 10.370 1.00 0.00 C ATOM 183 NE ARG A 12 3.532 13.531 11.516 1.00 0.00 N ATOM 184 CZ ARG A 12 3.221 12.334 12.028 1.00 0.00 C ATOM 185 NH1 ARG A 12 3.681 11.215 11.472 1.00 0.00 N ATOM 186 NH2 ARG A 12 2.432 12.258 13.096 1.00 0.00 N ATOM 187 H ARG A 12 8.629 13.000 7.904 1.00 0.00 H ATOM 188 HA ARG A 12 6.157 11.943 8.493 1.00 0.00 H ATOM 189 HB2 ARG A 12 7.821 13.480 9.866 1.00 0.00 H ATOM 190 HB3 ARG A 12 6.738 14.755 9.333 1.00 0.00 H ATOM 191 HG2 ARG A 12 5.915 12.307 10.885 1.00 0.00 H ATOM 192 HG3 ARG A 12 6.179 13.910 11.567 1.00 0.00 H ATOM 193 HD2 ARG A 12 4.384 14.775 10.079 1.00 0.00 H ATOM 194 HD3 ARG A 12 4.080 13.122 9.552 1.00 0.00 H ATOM 195 HE ARG A 12 3.154 14.332 11.937 1.00 0.00 H ATOM 196 HH11 ARG A 12 4.265 11.259 10.662 1.00 0.00 H ATOM 197 HH12 ARG A 12 3.442 10.327 11.866 1.00 0.00 H ATOM 198 HH21 ARG A 12 2.073 13.092 13.514 1.00 0.00 H ATOM 199 HH22 ARG A 12 2.198 11.365 13.482 1.00 0.00 H ATOM 200 N LYS A 13 5.964 14.573 6.545 1.00 0.00 N ATOM 201 CA LYS A 13 5.054 15.341 5.695 1.00 0.00 C ATOM 202 C LYS A 13 4.613 14.565 4.458 1.00 0.00 C ATOM 203 O LYS A 13 3.416 14.467 4.182 1.00 0.00 O ATOM 204 CB LYS A 13 5.692 16.673 5.289 1.00 0.00 C ATOM 205 CG LYS A 13 4.784 17.563 4.451 1.00 0.00 C ATOM 206 CD LYS A 13 3.502 17.917 5.191 1.00 0.00 C ATOM 207 CE LYS A 13 3.785 18.690 6.470 1.00 0.00 C ATOM 208 NZ LYS A 13 2.538 18.996 7.224 1.00 0.00 N ATOM 209 H LYS A 13 6.936 14.738 6.492 1.00 0.00 H ATOM 210 HA LYS A 13 4.177 15.540 6.279 1.00 0.00 H ATOM 211 HB2 LYS A 13 5.965 17.215 6.182 1.00 0.00 H ATOM 212 HB3 LYS A 13 6.586 16.470 4.717 1.00 0.00 H ATOM 213 HG2 LYS A 13 5.311 18.474 4.212 1.00 0.00 H ATOM 214 HG3 LYS A 13 4.531 17.043 3.539 1.00 0.00 H ATOM 215 HD2 LYS A 13 2.883 18.523 4.547 1.00 0.00 H ATOM 216 HD3 LYS A 13 2.979 17.005 5.440 1.00 0.00 H ATOM 217 HE2 LYS A 13 4.436 18.099 7.097 1.00 0.00 H ATOM 218 HE3 LYS A 13 4.278 19.616 6.214 1.00 0.00 H ATOM 219 HZ1 LYS A 13 2.768 19.488 8.111 1.00 0.00 H ATOM 220 HZ2 LYS A 13 2.031 18.117 7.450 1.00 0.00 H ATOM 221 HZ3 LYS A 13 1.915 19.604 6.653 1.00 0.00 H ATOM 222 N LEU A 14 5.571 14.023 3.714 1.00 0.00 N ATOM 223 CA LEU A 14 5.258 13.264 2.506 1.00 0.00 C ATOM 224 C LEU A 14 4.447 12.004 2.826 1.00 0.00 C ATOM 225 O LEU A 14 3.779 11.455 1.947 1.00 0.00 O ATOM 226 CB LEU A 14 6.544 12.882 1.763 1.00 0.00 C ATOM 227 CG LEU A 14 6.338 12.170 0.423 1.00 0.00 C ATOM 228 CD1 LEU A 14 5.635 13.086 -0.569 1.00 0.00 C ATOM 229 CD2 LEU A 14 7.669 11.692 -0.137 1.00 0.00 C ATOM 230 H LEU A 14 6.508 14.137 3.980 1.00 0.00 H ATOM 231 HA LEU A 14 4.665 13.900 1.866 1.00 0.00 H ATOM 232 HB2 LEU A 14 7.110 13.785 1.584 1.00 0.00 H ATOM 233 HB3 LEU A 14 7.125 12.235 2.403 1.00 0.00 H ATOM 234 HG LEU A 14 5.710 11.305 0.577 1.00 0.00 H ATOM 235 HD11 LEU A 14 5.617 12.619 -1.542 1.00 0.00 H ATOM 236 HD12 LEU A 14 6.165 14.026 -0.630 1.00 0.00 H ATOM 237 HD13 LEU A 14 4.623 13.266 -0.238 1.00 0.00 H ATOM 238 HD21 LEU A 14 8.276 12.545 -0.404 1.00 0.00 H ATOM 239 HD22 LEU A 14 7.494 11.087 -1.014 1.00 0.00 H ATOM 240 HD23 LEU A 14 8.183 11.103 0.608 1.00 0.00 H ATOM 241 N ASP A 15 4.509 11.543 4.080 1.00 0.00 N ATOM 242 CA ASP A 15 3.776 10.341 4.485 1.00 0.00 C ATOM 243 C ASP A 15 2.461 10.694 5.176 1.00 0.00 C ATOM 244 O ASP A 15 1.391 10.254 4.755 1.00 0.00 O ATOM 245 CB ASP A 15 4.645 9.455 5.387 1.00 0.00 C ATOM 246 CG ASP A 15 5.953 9.067 4.714 1.00 0.00 C ATOM 247 OD1 ASP A 15 5.955 8.501 3.619 1.00 0.00 O ATOM 248 H ASP A 15 5.052 12.026 4.748 1.00 0.00 H ATOM 249 HA ASP A 15 3.545 9.789 3.585 1.00 0.00 H ATOM 250 HB2 ASP A 15 4.872 9.988 6.298 1.00 0.00 H ATOM 251 HB3 ASP A 15 4.102 8.552 5.627 1.00 0.00 H HETATM 252 N NH2 A 16 2.536 11.488 6.240 1.00 0.00 N HETATM 253 HN1 NH2 A 16 3.420 11.803 6.523 1.00 0.00 H HETATM 254 HN2 NH2 A 16 1.704 11.726 6.699 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 8 ATOM 1 N PHE A 1 21.946 16.826 8.264 1.00 0.00 N ATOM 2 CA PHE A 1 22.302 15.959 9.382 1.00 0.00 C ATOM 3 C PHE A 1 22.082 14.483 9.018 1.00 0.00 C ATOM 4 O PHE A 1 21.953 14.143 7.839 1.00 0.00 O ATOM 5 CB PHE A 1 21.487 16.341 10.630 1.00 0.00 C ATOM 6 CG PHE A 1 21.801 17.710 11.180 1.00 0.00 C ATOM 7 CD1 PHE A 1 21.666 18.846 10.394 1.00 0.00 C ATOM 8 CD2 PHE A 1 22.225 17.857 12.491 1.00 0.00 C ATOM 9 CE1 PHE A 1 21.948 20.098 10.906 1.00 0.00 C ATOM 10 CE2 PHE A 1 22.508 19.107 13.008 1.00 0.00 C ATOM 11 CZ PHE A 1 22.370 20.228 12.214 1.00 0.00 C ATOM 12 H1 PHE A 1 21.124 16.647 7.763 1.00 0.00 H ATOM 13 HA PHE A 1 23.352 16.109 9.592 1.00 0.00 H ATOM 14 HB2 PHE A 1 20.438 16.321 10.382 1.00 0.00 H ATOM 15 HB3 PHE A 1 21.678 15.620 11.411 1.00 0.00 H ATOM 16 HD1 PHE A 1 21.336 18.747 9.371 1.00 0.00 H ATOM 17 HD2 PHE A 1 22.336 16.981 13.112 1.00 0.00 H ATOM 18 HE1 PHE A 1 21.839 20.973 10.283 1.00 0.00 H ATOM 19 HE2 PHE A 1 22.837 19.206 14.031 1.00 0.00 H ATOM 20 HZ PHE A 1 22.590 21.206 12.617 1.00 0.00 H ATOM 21 N GLY A 2 22.052 13.609 10.029 1.00 0.00 N ATOM 22 CA GLY A 2 21.862 12.187 9.788 1.00 0.00 C ATOM 23 C GLY A 2 20.412 11.801 9.547 1.00 0.00 C ATOM 24 O GLY A 2 19.743 12.369 8.683 1.00 0.00 O ATOM 25 H GLY A 2 22.170 13.930 10.946 1.00 0.00 H ATOM 26 HA2 GLY A 2 22.442 11.902 8.923 1.00 0.00 H ATOM 27 HA3 GLY A 2 22.229 11.640 10.644 1.00 0.00 H ATOM 28 N GLY A 3 19.941 10.818 10.316 1.00 0.00 N ATOM 29 CA GLY A 3 18.574 10.336 10.194 1.00 0.00 C ATOM 30 C GLY A 3 17.571 11.211 10.920 1.00 0.00 C ATOM 31 O GLY A 3 16.895 10.750 11.842 1.00 0.00 O ATOM 32 H GLY A 3 20.532 10.413 10.977 1.00 0.00 H ATOM 33 HA2 GLY A 3 18.309 10.298 9.147 1.00 0.00 H ATOM 34 HA3 GLY A 3 18.522 9.336 10.601 1.00 0.00 H ATOM 35 N PHE A 4 17.474 12.473 10.508 1.00 0.00 N ATOM 36 CA PHE A 4 16.546 13.415 11.127 1.00 0.00 C ATOM 37 C PHE A 4 16.158 14.528 10.158 1.00 0.00 C ATOM 38 O PHE A 4 14.982 14.877 10.052 1.00 0.00 O ATOM 39 CB PHE A 4 17.157 14.027 12.391 1.00 0.00 C ATOM 40 CG PHE A 4 16.258 15.031 13.061 1.00 0.00 C ATOM 41 CD1 PHE A 4 14.950 14.703 13.388 1.00 0.00 C ATOM 42 CD2 PHE A 4 16.719 16.303 13.359 1.00 0.00 C ATOM 43 CE1 PHE A 4 14.122 15.624 13.998 1.00 0.00 C ATOM 44 CE2 PHE A 4 15.894 17.229 13.968 1.00 0.00 C ATOM 45 CZ PHE A 4 14.593 16.889 14.289 1.00 0.00 C ATOM 46 H PHE A 4 18.041 12.777 9.769 1.00 0.00 H ATOM 47 HA PHE A 4 15.656 12.867 11.400 1.00 0.00 H ATOM 48 HB2 PHE A 4 17.366 13.240 13.101 1.00 0.00 H ATOM 49 HB3 PHE A 4 18.079 14.527 12.132 1.00 0.00 H ATOM 50 HD1 PHE A 4 14.580 13.714 13.161 1.00 0.00 H ATOM 51 HD2 PHE A 4 17.734 16.570 13.107 1.00 0.00 H ATOM 52 HE1 PHE A 4 13.106 15.355 14.248 1.00 0.00 H ATOM 53 HE2 PHE A 4 16.265 18.217 14.195 1.00 0.00 H ATOM 54 HZ PHE A 4 13.947 17.611 14.767 1.00 0.00 H ATOM 55 N THR A 5 17.150 15.088 9.458 1.00 0.00 N ATOM 56 CA THR A 5 16.889 16.169 8.503 1.00 0.00 C ATOM 57 C THR A 5 16.063 15.691 7.333 1.00 0.00 C ATOM 58 O THR A 5 14.983 16.216 7.055 1.00 0.00 O ATOM 59 CB THR A 5 18.186 16.828 7.985 1.00 0.00 C ATOM 60 OG1 THR A 5 19.134 15.824 7.600 1.00 0.00 O ATOM 61 CG2 THR A 5 18.801 17.739 9.037 1.00 0.00 C ATOM 62 H THR A 5 18.070 14.768 9.588 1.00 0.00 H ATOM 63 HA THR A 5 16.320 16.895 9.009 1.00 0.00 H ATOM 64 HB THR A 5 17.944 17.426 7.118 1.00 0.00 H ATOM 65 HG1 THR A 5 19.031 15.627 6.665 1.00 0.00 H ATOM 66 HG21 THR A 5 18.217 18.645 9.114 1.00 0.00 H ATOM 67 HG22 THR A 5 19.810 17.986 8.748 1.00 0.00 H ATOM 68 HG23 THR A 5 18.813 17.235 9.993 1.00 0.00 H ATOM 69 N LYS A 6 16.568 14.672 6.685 1.00 0.00 N ATOM 70 CA LYS A 6 15.884 14.057 5.555 1.00 0.00 C ATOM 71 C LYS A 6 14.629 13.326 6.035 1.00 0.00 C ATOM 72 O LYS A 6 13.718 13.064 5.249 1.00 0.00 O ATOM 73 CB LYS A 6 16.819 13.088 4.812 1.00 0.00 C ATOM 74 CG LYS A 6 16.112 12.207 3.786 1.00 0.00 C ATOM 75 CD LYS A 6 15.421 13.028 2.702 1.00 0.00 C ATOM 76 CE LYS A 6 14.338 12.226 1.989 1.00 0.00 C ATOM 77 NZ LYS A 6 13.208 11.921 2.872 1.00 0.00 N ATOM 78 H LYS A 6 17.415 14.307 6.998 1.00 0.00 H ATOM 79 HA LYS A 6 15.586 14.846 4.880 1.00 0.00 H ATOM 80 HB2 LYS A 6 17.578 13.660 4.299 1.00 0.00 H ATOM 81 HB3 LYS A 6 17.297 12.445 5.537 1.00 0.00 H ATOM 82 HG2 LYS A 6 16.844 11.565 3.318 1.00 0.00 H ATOM 83 HG3 LYS A 6 15.377 11.601 4.293 1.00 0.00 H ATOM 84 HD2 LYS A 6 14.969 13.898 3.154 1.00 0.00 H ATOM 85 HD3 LYS A 6 16.159 13.341 1.978 1.00 0.00 H ATOM 86 HE2 LYS A 6 13.978 12.803 1.149 1.00 0.00 H ATOM 87 HE3 LYS A 6 14.766 11.300 1.631 1.00 0.00 H ATOM 88 HZ1 LYS A 6 13.415 11.592 3.771 1.00 0.00 H ATOM 89 N ALA A 7 14.582 13.005 7.333 1.00 0.00 N ATOM 90 CA ALA A 7 13.429 12.305 7.894 1.00 0.00 C ATOM 91 C ALA A 7 12.263 13.246 8.109 1.00 0.00 C ATOM 92 O ALA A 7 11.141 12.950 7.706 1.00 0.00 O ATOM 93 CB ALA A 7 13.799 11.591 9.187 1.00 0.00 C ATOM 94 H ALA A 7 15.332 13.255 7.925 1.00 0.00 H ATOM 95 HA ALA A 7 13.127 11.570 7.175 1.00 0.00 H ATOM 96 HB1 ALA A 7 13.198 10.700 9.290 1.00 0.00 H ATOM 97 HB2 ALA A 7 13.616 12.247 10.025 1.00 0.00 H ATOM 98 HB3 ALA A 7 14.844 11.319 9.163 1.00 0.00 H ATOM 99 N ARG A 8 12.537 14.389 8.716 1.00 0.00 N ATOM 100 CA ARG A 8 11.510 15.395 8.953 1.00 0.00 C ATOM 101 C ARG A 8 10.901 15.848 7.633 1.00 0.00 C ATOM 102 O ARG A 8 9.731 16.231 7.570 1.00 0.00 O ATOM 103 CB ARG A 8 12.127 16.604 9.649 1.00 0.00 C ATOM 104 CG ARG A 8 11.544 16.909 11.021 1.00 0.00 C ATOM 105 CD ARG A 8 10.076 17.306 10.941 1.00 0.00 C ATOM 106 NE ARG A 8 9.618 17.958 12.171 1.00 0.00 N ATOM 107 CZ ARG A 8 9.542 17.357 13.366 1.00 0.00 C ATOM 108 NH1 ARG A 8 9.812 16.059 13.494 1.00 0.00 N ATOM 109 NH2 ARG A 8 9.174 18.057 14.436 1.00 0.00 N ATOM 110 H ARG A 8 13.460 14.573 8.993 1.00 0.00 H ATOM 111 HA ARG A 8 10.742 14.964 9.573 1.00 0.00 H ATOM 112 HB2 ARG A 8 13.186 16.429 9.760 1.00 0.00 H ATOM 113 HB3 ARG A 8 11.984 17.468 9.016 1.00 0.00 H ATOM 114 HG2 ARG A 8 11.633 16.030 11.640 1.00 0.00 H ATOM 115 HG3 ARG A 8 12.102 17.721 11.464 1.00 0.00 H ATOM 116 HD2 ARG A 8 9.943 17.986 10.112 1.00 0.00 H ATOM 117 HD3 ARG A 8 9.485 16.417 10.774 1.00 0.00 H ATOM 118 HE ARG A 8 9.373 18.905 12.109 1.00 0.00 H ATOM 119 HH11 ARG A 8 10.074 15.518 12.695 1.00 0.00 H ATOM 120 HH12 ARG A 8 9.751 15.624 14.393 1.00 0.00 H ATOM 121 HH21 ARG A 8 8.952 19.029 14.348 1.00 0.00 H ATOM 122 HH22 ARG A 8 9.123 17.613 15.332 1.00 0.00 H ATOM 123 N LYS A 9 11.723 15.813 6.588 1.00 0.00 N ATOM 124 CA LYS A 9 11.298 16.235 5.256 1.00 0.00 C ATOM 125 C LYS A 9 10.335 15.223 4.638 1.00 0.00 C ATOM 126 O LYS A 9 9.211 15.567 4.268 1.00 0.00 O ATOM 127 CB LYS A 9 12.518 16.409 4.348 1.00 0.00 C ATOM 128 CG LYS A 9 12.333 17.451 3.256 1.00 0.00 C ATOM 129 CD LYS A 9 12.257 18.855 3.838 1.00 0.00 C ATOM 130 CE LYS A 9 12.155 19.910 2.749 1.00 0.00 C ATOM 131 NZ LYS A 9 12.099 21.288 3.314 1.00 0.00 N ATOM 132 H LYS A 9 12.649 15.497 6.723 1.00 0.00 H ATOM 133 HA LYS A 9 10.793 17.183 5.354 1.00 0.00 H ATOM 134 HB2 LYS A 9 13.364 16.701 4.953 1.00 0.00 H ATOM 135 HB3 LYS A 9 12.736 15.462 3.876 1.00 0.00 H ATOM 136 HG2 LYS A 9 13.170 17.398 2.576 1.00 0.00 H ATOM 137 HG3 LYS A 9 11.418 17.242 2.720 1.00 0.00 H ATOM 138 HD2 LYS A 9 11.387 18.924 4.473 1.00 0.00 H ATOM 139 HD3 LYS A 9 13.147 19.038 4.422 1.00 0.00 H ATOM 140 HE2 LYS A 9 13.018 19.829 2.105 1.00 0.00 H ATOM 141 HE3 LYS A 9 11.259 19.729 2.173 1.00 0.00 H ATOM 142 HZ1 LYS A 9 11.965 21.982 2.551 1.00 0.00 H ATOM 143 HZ2 LYS A 9 12.985 21.506 3.814 1.00 0.00 H ATOM 144 HZ3 LYS A 9 11.307 21.368 3.984 1.00 0.00 H ATOM 145 N ASP A 10 10.793 13.976 4.527 1.00 0.00 N ATOM 146 CA ASP A 10 9.994 12.898 3.946 1.00 0.00 C ATOM 147 C ASP A 10 8.861 12.443 4.876 1.00 0.00 C ATOM 148 O ASP A 10 7.867 11.888 4.407 1.00 0.00 O ATOM 149 CB ASP A 10 10.894 11.710 3.583 1.00 0.00 C ATOM 150 CG ASP A 10 11.928 12.072 2.525 1.00 0.00 C ATOM 151 OD1 ASP A 10 11.576 12.483 1.418 1.00 0.00 O ATOM 152 H ASP A 10 11.702 13.776 4.840 1.00 0.00 H ATOM 153 HA ASP A 10 9.551 13.280 3.038 1.00 0.00 H ATOM 154 HB2 ASP A 10 11.413 11.376 4.469 1.00 0.00 H ATOM 155 HB3 ASP A 10 10.282 10.905 3.203 1.00 0.00 H ATOM 156 N LYS A 11 9.003 12.672 6.189 1.00 0.00 N ATOM 157 CA LYS A 11 7.972 12.268 7.148 1.00 0.00 C ATOM 158 C LYS A 11 6.776 13.206 7.058 1.00 0.00 C ATOM 159 O LYS A 11 5.662 12.774 6.762 1.00 0.00 O ATOM 160 CB LYS A 11 8.542 12.247 8.578 1.00 0.00 C ATOM 161 CG LYS A 11 7.624 11.618 9.630 1.00 0.00 C ATOM 162 CD LYS A 11 6.438 12.514 9.974 1.00 0.00 C ATOM 163 CE LYS A 11 5.109 11.854 9.628 1.00 0.00 C ATOM 164 NZ LYS A 11 4.211 12.771 8.927 1.00 0.00 N ATOM 165 H LYS A 11 9.809 13.125 6.518 1.00 0.00 H ATOM 166 HA LYS A 11 7.649 11.274 6.884 1.00 0.00 H ATOM 167 HB2 LYS A 11 9.468 11.692 8.571 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.750 13.264 8.879 1.00 0.00 H ATOM 169 HG2 LYS A 11 7.252 10.677 9.251 1.00 0.00 H ATOM 170 HG3 LYS A 11 8.198 11.440 10.527 1.00 0.00 H ATOM 171 HD2 LYS A 11 6.457 12.721 11.034 1.00 0.00 H ATOM 172 HD3 LYS A 11 6.526 13.439 9.425 1.00 0.00 H ATOM 173 HE2 LYS A 11 5.297 10.996 8.998 1.00 0.00 H ATOM 174 HE3 LYS A 11 4.634 11.529 10.543 1.00 0.00 H ATOM 175 HZ1 LYS A 11 4.507 13.698 8.821 1.00 0.00 H ATOM 176 N ARG A 12 7.021 14.495 7.295 1.00 0.00 N ATOM 177 CA ARG A 12 5.965 15.504 7.230 1.00 0.00 C ATOM 178 C ARG A 12 5.321 15.542 5.846 1.00 0.00 C ATOM 179 O ARG A 12 4.136 15.855 5.722 1.00 0.00 O ATOM 180 CB ARG A 12 6.503 16.893 7.591 1.00 0.00 C ATOM 181 CG ARG A 12 7.043 16.991 9.011 1.00 0.00 C ATOM 182 CD ARG A 12 7.391 18.426 9.387 1.00 0.00 C ATOM 183 NE ARG A 12 6.210 19.293 9.414 1.00 0.00 N ATOM 184 CZ ARG A 12 6.236 20.587 9.750 1.00 0.00 C ATOM 185 NH1 ARG A 12 7.377 21.173 10.107 1.00 0.00 N ATOM 186 NH2 ARG A 12 5.110 21.296 9.737 1.00 0.00 N ATOM 187 H ARG A 12 7.936 14.774 7.509 1.00 0.00 H ATOM 188 HA ARG A 12 5.209 15.229 7.950 1.00 0.00 H ATOM 189 HB2 ARG A 12 7.299 17.148 6.906 1.00 0.00 H ATOM 190 HB3 ARG A 12 5.704 17.612 7.484 1.00 0.00 H ATOM 191 HG2 ARG A 12 6.294 16.624 9.695 1.00 0.00 H ATOM 192 HG3 ARG A 12 7.933 16.382 9.089 1.00 0.00 H ATOM 193 HD2 ARG A 12 7.846 18.425 10.365 1.00 0.00 H ATOM 194 HD3 ARG A 12 8.094 18.814 8.665 1.00 0.00 H ATOM 195 HE ARG A 12 5.351 18.891 9.167 1.00 0.00 H ATOM 196 HH11 ARG A 12 8.229 20.648 10.126 1.00 0.00 H ATOM 197 HH12 ARG A 12 7.384 22.142 10.358 1.00 0.00 H ATOM 198 HH21 ARG A 12 4.248 20.861 9.474 1.00 0.00 H ATOM 199 HH22 ARG A 12 5.125 22.264 9.989 1.00 0.00 H ATOM 200 N LYS A 13 6.102 15.230 4.806 1.00 0.00 N ATOM 201 CA LYS A 13 5.578 15.244 3.438 1.00 0.00 C ATOM 202 C LYS A 13 4.568 14.120 3.232 1.00 0.00 C ATOM 203 O LYS A 13 3.476 14.349 2.708 1.00 0.00 O ATOM 204 CB LYS A 13 6.715 15.135 2.415 1.00 0.00 C ATOM 205 CG LYS A 13 6.450 15.882 1.116 1.00 0.00 C ATOM 206 CD LYS A 13 6.351 17.383 1.355 1.00 0.00 C ATOM 207 CE LYS A 13 6.332 18.164 0.049 1.00 0.00 C ATOM 208 NZ LYS A 13 6.343 19.637 0.282 1.00 0.00 N ATOM 209 H LYS A 13 7.045 14.990 4.961 1.00 0.00 H ATOM 210 HA LYS A 13 5.067 16.179 3.301 1.00 0.00 H ATOM 211 HB2 LYS A 13 7.615 15.535 2.854 1.00 0.00 H ATOM 212 HB3 LYS A 13 6.874 14.092 2.179 1.00 0.00 H ATOM 213 HG2 LYS A 13 7.260 15.689 0.428 1.00 0.00 H ATOM 214 HG3 LYS A 13 5.521 15.532 0.691 1.00 0.00 H ATOM 215 HD2 LYS A 13 5.439 17.589 1.897 1.00 0.00 H ATOM 216 HD3 LYS A 13 7.200 17.700 1.943 1.00 0.00 H ATOM 217 HE2 LYS A 13 7.204 17.894 -0.529 1.00 0.00 H ATOM 218 HE3 LYS A 13 5.441 17.903 -0.501 1.00 0.00 H ATOM 219 HZ1 LYS A 13 5.753 19.873 1.107 1.00 0.00 H ATOM 220 HZ2 LYS A 13 5.969 20.135 -0.551 1.00 0.00 H ATOM 221 HZ3 LYS A 13 7.315 19.963 0.460 1.00 0.00 H ATOM 222 N LEU A 14 4.924 12.913 3.669 1.00 0.00 N ATOM 223 CA LEU A 14 4.030 11.765 3.553 1.00 0.00 C ATOM 224 C LEU A 14 2.805 11.924 4.463 1.00 0.00 C ATOM 225 O LEU A 14 1.806 11.224 4.288 1.00 0.00 O ATOM 226 CB LEU A 14 4.772 10.460 3.875 1.00 0.00 C ATOM 227 CG LEU A 14 5.464 9.777 2.684 1.00 0.00 C ATOM 228 CD1 LEU A 14 4.445 9.392 1.621 1.00 0.00 C ATOM 229 CD2 LEU A 14 6.545 10.670 2.086 1.00 0.00 C ATOM 230 H LEU A 14 5.799 12.797 4.095 1.00 0.00 H ATOM 231 HA LEU A 14 3.688 11.724 2.529 1.00 0.00 H ATOM 232 HB2 LEU A 14 5.522 10.674 4.623 1.00 0.00 H ATOM 233 HB3 LEU A 14 4.062 9.763 4.295 1.00 0.00 H ATOM 234 HG LEU A 14 5.936 8.869 3.030 1.00 0.00 H ATOM 235 HD11 LEU A 14 4.138 10.275 1.079 1.00 0.00 H ATOM 236 HD12 LEU A 14 3.585 8.941 2.092 1.00 0.00 H ATOM 237 HD13 LEU A 14 4.891 8.686 0.935 1.00 0.00 H ATOM 238 HD21 LEU A 14 7.492 10.453 2.558 1.00 0.00 H ATOM 239 HD22 LEU A 14 6.291 11.707 2.248 1.00 0.00 H ATOM 240 HD23 LEU A 14 6.621 10.481 1.025 1.00 0.00 H ATOM 241 N ASP A 15 2.876 12.858 5.425 1.00 0.00 N ATOM 242 CA ASP A 15 1.753 13.100 6.335 1.00 0.00 C ATOM 243 C ASP A 15 0.819 14.167 5.767 1.00 0.00 C ATOM 244 O ASP A 15 -0.389 13.956 5.665 1.00 0.00 O ATOM 245 CB ASP A 15 2.241 13.516 7.731 1.00 0.00 C ATOM 246 CG ASP A 15 3.026 12.418 8.429 1.00 0.00 C ATOM 247 OD1 ASP A 15 2.570 11.277 8.522 1.00 0.00 O ATOM 248 H ASP A 15 3.690 13.405 5.511 1.00 0.00 H ATOM 249 HA ASP A 15 1.200 12.176 6.422 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.878 14.384 7.639 1.00 0.00 H ATOM 251 HB3 ASP A 15 1.387 13.767 8.343 1.00 0.00 H HETATM 252 N NH2 A 16 1.378 15.314 5.388 1.00 0.00 N HETATM 253 HN1 NH2 A 16 2.347 15.417 5.497 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.798 16.010 5.014 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 9 ATOM 1 N PHE A 1 23.794 15.959 13.437 1.00 0.00 N ATOM 2 CA PHE A 1 23.711 14.626 14.021 1.00 0.00 C ATOM 3 C PHE A 1 22.599 13.804 13.368 1.00 0.00 C ATOM 4 O PHE A 1 22.797 12.630 13.047 1.00 0.00 O ATOM 5 CB PHE A 1 23.471 14.722 15.532 1.00 0.00 C ATOM 6 CG PHE A 1 23.393 13.387 16.221 1.00 0.00 C ATOM 7 CD1 PHE A 1 24.370 12.425 16.013 1.00 0.00 C ATOM 8 CD2 PHE A 1 22.342 13.095 17.074 1.00 0.00 C ATOM 9 CE1 PHE A 1 24.298 11.198 16.642 1.00 0.00 C ATOM 10 CE2 PHE A 1 22.264 11.870 17.706 1.00 0.00 C ATOM 11 CZ PHE A 1 23.244 10.920 17.491 1.00 0.00 C ATOM 12 H1 PHE A 1 24.171 16.066 12.540 1.00 0.00 H ATOM 13 HA PHE A 1 24.655 14.131 13.847 1.00 0.00 H ATOM 14 HB2 PHE A 1 24.277 15.280 15.983 1.00 0.00 H ATOM 15 HB3 PHE A 1 22.540 15.242 15.707 1.00 0.00 H ATOM 16 HD1 PHE A 1 25.195 12.642 15.351 1.00 0.00 H ATOM 17 HD2 PHE A 1 21.575 13.836 17.242 1.00 0.00 H ATOM 18 HE1 PHE A 1 25.066 10.458 16.472 1.00 0.00 H ATOM 19 HE2 PHE A 1 21.440 11.655 18.369 1.00 0.00 H ATOM 20 HZ PHE A 1 23.186 9.961 17.984 1.00 0.00 H ATOM 21 N GLY A 2 21.427 14.424 13.186 1.00 0.00 N ATOM 22 CA GLY A 2 20.298 13.731 12.586 1.00 0.00 C ATOM 23 C GLY A 2 20.567 13.265 11.166 1.00 0.00 C ATOM 24 O GLY A 2 20.865 14.073 10.284 1.00 0.00 O ATOM 25 H GLY A 2 21.329 15.358 13.468 1.00 0.00 H ATOM 26 HA2 GLY A 2 20.059 12.871 13.193 1.00 0.00 H ATOM 27 HA3 GLY A 2 19.448 14.397 12.577 1.00 0.00 H ATOM 28 N GLY A 3 20.446 11.957 10.952 1.00 0.00 N ATOM 29 CA GLY A 3 20.663 11.385 9.636 1.00 0.00 C ATOM 30 C GLY A 3 19.458 11.556 8.727 1.00 0.00 C ATOM 31 O GLY A 3 19.607 11.697 7.512 1.00 0.00 O ATOM 32 H GLY A 3 20.195 11.372 11.695 1.00 0.00 H ATOM 33 HA2 GLY A 3 21.516 11.868 9.183 1.00 0.00 H ATOM 34 HA3 GLY A 3 20.873 10.332 9.744 1.00 0.00 H ATOM 35 N PHE A 4 18.260 11.542 9.320 1.00 0.00 N ATOM 36 CA PHE A 4 17.017 11.696 8.566 1.00 0.00 C ATOM 37 C PHE A 4 16.733 13.171 8.268 1.00 0.00 C ATOM 38 O PHE A 4 15.672 13.690 8.623 1.00 0.00 O ATOM 39 CB PHE A 4 15.841 11.084 9.338 1.00 0.00 C ATOM 40 CG PHE A 4 16.052 9.653 9.751 1.00 0.00 C ATOM 41 CD1 PHE A 4 15.687 8.612 8.914 1.00 0.00 C ATOM 42 CD2 PHE A 4 16.620 9.353 10.979 1.00 0.00 C ATOM 43 CE1 PHE A 4 15.883 7.297 9.295 1.00 0.00 C ATOM 44 CE2 PHE A 4 16.817 8.041 11.365 1.00 0.00 C ATOM 45 CZ PHE A 4 16.448 7.013 10.523 1.00 0.00 C ATOM 46 H PHE A 4 18.213 11.427 10.291 1.00 0.00 H ATOM 47 HA PHE A 4 17.134 11.171 7.631 1.00 0.00 H ATOM 48 HB2 PHE A 4 15.668 11.663 10.232 1.00 0.00 H ATOM 49 HB3 PHE A 4 14.959 11.122 8.719 1.00 0.00 H ATOM 50 HD1 PHE A 4 15.245 8.834 7.954 1.00 0.00 H ATOM 51 HD2 PHE A 4 16.907 10.157 11.641 1.00 0.00 H ATOM 52 HE1 PHE A 4 15.594 6.494 8.633 1.00 0.00 H ATOM 53 HE2 PHE A 4 17.261 7.822 12.325 1.00 0.00 H ATOM 54 HZ PHE A 4 16.600 5.986 10.823 1.00 0.00 H ATOM 55 N THR A 5 17.686 13.847 7.623 1.00 0.00 N ATOM 56 CA THR A 5 17.528 15.262 7.291 1.00 0.00 C ATOM 57 C THR A 5 16.425 15.467 6.275 1.00 0.00 C ATOM 58 O THR A 5 15.438 16.162 6.527 1.00 0.00 O ATOM 59 CB THR A 5 18.845 15.877 6.761 1.00 0.00 C ATOM 60 OG1 THR A 5 19.880 15.741 7.745 1.00 0.00 O ATOM 61 CG2 THR A 5 18.670 17.349 6.405 1.00 0.00 C ATOM 62 H THR A 5 18.511 13.386 7.370 1.00 0.00 H ATOM 63 HA THR A 5 17.250 15.763 8.172 1.00 0.00 H ATOM 64 HB THR A 5 19.137 15.341 5.870 1.00 0.00 H ATOM 65 HG1 THR A 5 19.620 16.197 8.549 1.00 0.00 H ATOM 66 HG21 THR A 5 19.638 17.792 6.219 1.00 0.00 H ATOM 67 HG22 THR A 5 18.192 17.865 7.224 1.00 0.00 H ATOM 68 HG23 THR A 5 18.059 17.435 5.519 1.00 0.00 H ATOM 69 N LYS A 6 16.601 14.829 5.149 1.00 0.00 N ATOM 70 CA LYS A 6 15.631 14.879 4.060 1.00 0.00 C ATOM 71 C LYS A 6 14.361 14.099 4.414 1.00 0.00 C ATOM 72 O LYS A 6 13.355 14.192 3.707 1.00 0.00 O ATOM 73 CB LYS A 6 16.262 14.339 2.766 1.00 0.00 C ATOM 74 CG LYS A 6 15.252 13.967 1.688 1.00 0.00 C ATOM 75 CD LYS A 6 14.841 12.503 1.791 1.00 0.00 C ATOM 76 CE LYS A 6 13.511 12.239 1.104 1.00 0.00 C ATOM 77 NZ LYS A 6 12.443 11.965 2.067 1.00 0.00 N ATOM 78 H LYS A 6 17.406 14.289 5.058 1.00 0.00 H ATOM 79 HA LYS A 6 15.360 15.914 3.909 1.00 0.00 H ATOM 80 HB2 LYS A 6 16.920 15.092 2.362 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.841 13.459 3.005 1.00 0.00 H ATOM 82 HG2 LYS A 6 14.374 14.586 1.801 1.00 0.00 H ATOM 83 HG3 LYS A 6 15.694 14.141 0.718 1.00 0.00 H ATOM 84 HD2 LYS A 6 15.600 11.895 1.322 1.00 0.00 H ATOM 85 HD3 LYS A 6 14.758 12.235 2.833 1.00 0.00 H ATOM 86 HE2 LYS A 6 13.243 13.107 0.520 1.00 0.00 H ATOM 87 HE3 LYS A 6 13.620 11.386 0.451 1.00 0.00 H ATOM 88 HZ1 LYS A 6 12.703 11.826 3.002 1.00 0.00 H ATOM 89 N ALA A 7 14.403 13.330 5.507 1.00 0.00 N ATOM 90 CA ALA A 7 13.244 12.543 5.919 1.00 0.00 C ATOM 91 C ALA A 7 12.110 13.416 6.430 1.00 0.00 C ATOM 92 O ALA A 7 10.945 13.059 6.277 1.00 0.00 O ATOM 93 CB ALA A 7 13.630 11.489 6.946 1.00 0.00 C ATOM 94 H ALA A 7 15.228 13.293 6.046 1.00 0.00 H ATOM 95 HA ALA A 7 12.887 12.037 5.039 1.00 0.00 H ATOM 96 HB1 ALA A 7 13.478 11.882 7.940 1.00 0.00 H ATOM 97 HB2 ALA A 7 14.669 11.224 6.818 1.00 0.00 H ATOM 98 HB3 ALA A 7 13.016 10.609 6.808 1.00 0.00 H ATOM 99 N ARG A 8 12.438 14.564 7.017 1.00 0.00 N ATOM 100 CA ARG A 8 11.408 15.476 7.508 1.00 0.00 C ATOM 101 C ARG A 8 10.443 15.845 6.387 1.00 0.00 C ATOM 102 O ARG A 8 9.241 15.994 6.612 1.00 0.00 O ATOM 103 CB ARG A 8 12.033 16.744 8.076 1.00 0.00 C ATOM 104 CG ARG A 8 12.377 16.649 9.556 1.00 0.00 C ATOM 105 CD ARG A 8 13.581 15.750 9.809 1.00 0.00 C ATOM 106 NE ARG A 8 14.826 16.364 9.353 1.00 0.00 N ATOM 107 CZ ARG A 8 15.370 17.457 9.898 1.00 0.00 C ATOM 108 NH1 ARG A 8 14.822 18.028 10.969 1.00 0.00 N ATOM 109 NH2 ARG A 8 16.477 17.972 9.377 1.00 0.00 N ATOM 110 H ARG A 8 13.382 14.812 7.103 1.00 0.00 H ATOM 111 HA ARG A 8 10.857 14.968 8.286 1.00 0.00 H ATOM 112 HB2 ARG A 8 12.939 16.953 7.525 1.00 0.00 H ATOM 113 HB3 ARG A 8 11.341 17.560 7.935 1.00 0.00 H ATOM 114 HG2 ARG A 8 12.597 17.640 9.924 1.00 0.00 H ATOM 115 HG3 ARG A 8 11.525 16.251 10.086 1.00 0.00 H ATOM 116 HD2 ARG A 8 13.653 15.553 10.869 1.00 0.00 H ATOM 117 HD3 ARG A 8 13.436 14.818 9.281 1.00 0.00 H ATOM 118 HE ARG A 8 15.273 15.954 8.584 1.00 0.00 H ATOM 119 HH11 ARG A 8 13.996 17.641 11.376 1.00 0.00 H ATOM 120 HH12 ARG A 8 15.239 18.845 11.369 1.00 0.00 H ATOM 121 HH21 ARG A 8 16.900 17.544 8.581 1.00 0.00 H ATOM 122 HH22 ARG A 8 16.887 18.791 9.780 1.00 0.00 H ATOM 123 N LYS A 9 10.983 15.978 5.177 1.00 0.00 N ATOM 124 CA LYS A 9 10.169 16.316 4.007 1.00 0.00 C ATOM 125 C LYS A 9 9.296 15.133 3.599 1.00 0.00 C ATOM 126 O LYS A 9 8.096 15.284 3.373 1.00 0.00 O ATOM 127 CB LYS A 9 11.048 16.742 2.829 1.00 0.00 C ATOM 128 CG LYS A 9 11.721 18.090 3.023 1.00 0.00 C ATOM 129 CD LYS A 9 12.474 18.514 1.773 1.00 0.00 C ATOM 130 CE LYS A 9 12.953 19.955 1.865 1.00 0.00 C ATOM 131 NZ LYS A 9 11.821 20.925 1.849 1.00 0.00 N ATOM 132 H LYS A 9 11.953 15.828 5.069 1.00 0.00 H ATOM 133 HA LYS A 9 9.528 17.142 4.280 1.00 0.00 H ATOM 134 HB2 LYS A 9 11.818 15.998 2.681 1.00 0.00 H ATOM 135 HB3 LYS A 9 10.436 16.794 1.939 1.00 0.00 H ATOM 136 HG2 LYS A 9 10.968 18.830 3.251 1.00 0.00 H ATOM 137 HG3 LYS A 9 12.418 18.016 3.845 1.00 0.00 H ATOM 138 HD2 LYS A 9 13.331 17.870 1.645 1.00 0.00 H ATOM 139 HD3 LYS A 9 11.818 18.417 0.920 1.00 0.00 H ATOM 140 HE2 LYS A 9 13.506 20.079 2.784 1.00 0.00 H ATOM 141 HE3 LYS A 9 13.601 20.157 1.025 1.00 0.00 H ATOM 142 HZ1 LYS A 9 11.104 20.631 1.154 1.00 0.00 H ATOM 143 HZ2 LYS A 9 12.167 21.872 1.592 1.00 0.00 H ATOM 144 HZ3 LYS A 9 11.379 20.973 2.790 1.00 0.00 H ATOM 145 N ASP A 10 9.912 13.955 3.516 1.00 0.00 N ATOM 146 CA ASP A 10 9.201 12.731 3.143 1.00 0.00 C ATOM 147 C ASP A 10 8.195 12.312 4.219 1.00 0.00 C ATOM 148 O ASP A 10 7.129 11.783 3.900 1.00 0.00 O ATOM 149 CB ASP A 10 10.196 11.594 2.889 1.00 0.00 C ATOM 150 CG ASP A 10 11.152 11.893 1.747 1.00 0.00 C ATOM 151 OD1 ASP A 10 10.733 12.052 0.599 1.00 0.00 O ATOM 152 H ASP A 10 10.871 13.906 3.716 1.00 0.00 H ATOM 153 HA ASP A 10 8.663 12.931 2.229 1.00 0.00 H ATOM 154 HB2 ASP A 10 10.777 11.427 3.784 1.00 0.00 H ATOM 155 HB3 ASP A 10 9.648 10.693 2.649 1.00 0.00 H ATOM 156 N LYS A 11 8.538 12.552 5.489 1.00 0.00 N ATOM 157 CA LYS A 11 7.662 12.198 6.605 1.00 0.00 C ATOM 158 C LYS A 11 6.617 13.286 6.804 1.00 0.00 C ATOM 159 O LYS A 11 5.420 13.008 6.823 1.00 0.00 O ATOM 160 CB LYS A 11 8.473 12.009 7.899 1.00 0.00 C ATOM 161 CG LYS A 11 7.867 11.003 8.876 1.00 0.00 C ATOM 162 CD LYS A 11 6.388 11.264 9.125 1.00 0.00 C ATOM 163 CE LYS A 11 6.158 12.574 9.869 1.00 0.00 C ATOM 164 NZ LYS A 11 4.929 13.242 9.437 1.00 0.00 N ATOM 165 H LYS A 11 9.395 12.983 5.679 1.00 0.00 H ATOM 166 HA LYS A 11 7.164 11.274 6.359 1.00 0.00 H ATOM 167 HB2 LYS A 11 9.466 11.671 7.642 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.547 12.964 8.402 1.00 0.00 H ATOM 169 HG2 LYS A 11 7.982 10.009 8.470 1.00 0.00 H ATOM 170 HG3 LYS A 11 8.397 11.069 9.816 1.00 0.00 H ATOM 171 HD2 LYS A 11 5.877 11.308 8.176 1.00 0.00 H ATOM 172 HD3 LYS A 11 5.986 10.452 9.713 1.00 0.00 H ATOM 173 HE2 LYS A 11 6.089 12.364 10.927 1.00 0.00 H ATOM 174 HE3 LYS A 11 6.998 13.229 9.688 1.00 0.00 H ATOM 175 HZ1 LYS A 11 5.003 14.179 9.162 1.00 0.00 H ATOM 176 N ARG A 12 7.088 14.529 6.928 1.00 0.00 N ATOM 177 CA ARG A 12 6.206 15.682 7.106 1.00 0.00 C ATOM 178 C ARG A 12 5.078 15.661 6.082 1.00 0.00 C ATOM 179 O ARG A 12 3.953 16.075 6.374 1.00 0.00 O ATOM 180 CB ARG A 12 7.009 16.982 6.991 1.00 0.00 C ATOM 181 CG ARG A 12 7.470 17.546 8.329 1.00 0.00 C ATOM 182 CD ARG A 12 6.400 18.437 8.945 1.00 0.00 C ATOM 183 NE ARG A 12 6.125 19.605 8.105 1.00 0.00 N ATOM 184 CZ ARG A 12 5.177 20.513 8.353 1.00 0.00 C ATOM 185 NH1 ARG A 12 4.388 20.403 9.419 1.00 0.00 N ATOM 186 NH2 ARG A 12 5.018 21.539 7.523 1.00 0.00 N ATOM 187 H ARG A 12 8.054 14.675 6.882 1.00 0.00 H ATOM 188 HA ARG A 12 5.776 15.620 8.095 1.00 0.00 H ATOM 189 HB2 ARG A 12 7.883 16.798 6.384 1.00 0.00 H ATOM 190 HB3 ARG A 12 6.396 17.726 6.505 1.00 0.00 H ATOM 191 HG2 ARG A 12 7.677 16.729 9.005 1.00 0.00 H ATOM 192 HG3 ARG A 12 8.367 18.128 8.176 1.00 0.00 H ATOM 193 HD2 ARG A 12 5.491 17.864 9.059 1.00 0.00 H ATOM 194 HD3 ARG A 12 6.740 18.774 9.913 1.00 0.00 H ATOM 195 HE ARG A 12 6.684 19.724 7.306 1.00 0.00 H ATOM 196 HH11 ARG A 12 4.498 19.636 10.051 1.00 0.00 H ATOM 197 HH12 ARG A 12 3.679 21.090 9.589 1.00 0.00 H ATOM 198 HH21 ARG A 12 5.608 21.629 6.721 1.00 0.00 H ATOM 199 HH22 ARG A 12 4.309 22.222 7.701 1.00 0.00 H ATOM 200 N LYS A 13 5.382 15.159 4.885 1.00 0.00 N ATOM 201 CA LYS A 13 4.383 15.066 3.824 1.00 0.00 C ATOM 202 C LYS A 13 3.501 13.839 4.017 1.00 0.00 C ATOM 203 O LYS A 13 2.277 13.922 3.896 1.00 0.00 O ATOM 204 CB LYS A 13 5.048 15.036 2.445 1.00 0.00 C ATOM 205 CG LYS A 13 5.680 16.361 2.038 1.00 0.00 C ATOM 206 CD LYS A 13 4.649 17.480 1.912 1.00 0.00 C ATOM 207 CE LYS A 13 3.776 17.328 0.670 1.00 0.00 C ATOM 208 NZ LYS A 13 2.844 16.166 0.761 1.00 0.00 N ATOM 209 H LYS A 13 6.299 14.829 4.720 1.00 0.00 H ATOM 210 HA LYS A 13 3.758 15.938 3.896 1.00 0.00 H ATOM 211 HB2 LYS A 13 5.820 14.281 2.451 1.00 0.00 H ATOM 212 HB3 LYS A 13 4.308 14.771 1.708 1.00 0.00 H ATOM 213 HG2 LYS A 13 6.409 16.643 2.783 1.00 0.00 H ATOM 214 HG3 LYS A 13 6.173 16.230 1.085 1.00 0.00 H ATOM 215 HD2 LYS A 13 4.014 17.469 2.785 1.00 0.00 H ATOM 216 HD3 LYS A 13 5.169 18.427 1.860 1.00 0.00 H ATOM 217 HE2 LYS A 13 3.195 18.230 0.544 1.00 0.00 H ATOM 218 HE3 LYS A 13 4.418 17.195 -0.188 1.00 0.00 H ATOM 219 HZ1 LYS A 13 1.935 16.401 0.314 1.00 0.00 H ATOM 220 HZ2 LYS A 13 2.671 15.919 1.757 1.00 0.00 H ATOM 221 HZ3 LYS A 13 3.253 15.341 0.276 1.00 0.00 H ATOM 222 N LEU A 14 4.128 12.707 4.338 1.00 0.00 N ATOM 223 CA LEU A 14 3.402 11.462 4.573 1.00 0.00 C ATOM 224 C LEU A 14 2.411 11.638 5.733 1.00 0.00 C ATOM 225 O LEU A 14 1.421 10.914 5.826 1.00 0.00 O ATOM 226 CB LEU A 14 4.391 10.323 4.875 1.00 0.00 C ATOM 227 CG LEU A 14 3.926 8.906 4.501 1.00 0.00 C ATOM 228 CD1 LEU A 14 2.705 8.493 5.308 1.00 0.00 C ATOM 229 CD2 LEU A 14 3.637 8.813 3.009 1.00 0.00 C ATOM 230 H LEU A 14 5.104 12.714 4.433 1.00 0.00 H ATOM 231 HA LEU A 14 2.851 11.223 3.676 1.00 0.00 H ATOM 232 HB2 LEU A 14 5.307 10.525 4.340 1.00 0.00 H ATOM 233 HB3 LEU A 14 4.607 10.337 5.932 1.00 0.00 H ATOM 234 HG LEU A 14 4.719 8.208 4.727 1.00 0.00 H ATOM 235 HD11 LEU A 14 1.814 8.882 4.837 1.00 0.00 H ATOM 236 HD12 LEU A 14 2.784 8.887 6.310 1.00 0.00 H ATOM 237 HD13 LEU A 14 2.648 7.416 5.348 1.00 0.00 H ATOM 238 HD21 LEU A 14 3.597 7.775 2.715 1.00 0.00 H ATOM 239 HD22 LEU A 14 4.420 9.313 2.458 1.00 0.00 H ATOM 240 HD23 LEU A 14 2.689 9.285 2.795 1.00 0.00 H ATOM 241 N ASP A 15 2.680 12.616 6.610 1.00 0.00 N ATOM 242 CA ASP A 15 1.804 12.885 7.750 1.00 0.00 C ATOM 243 C ASP A 15 0.643 13.787 7.337 1.00 0.00 C ATOM 244 O ASP A 15 -0.523 13.422 7.485 1.00 0.00 O ATOM 245 CB ASP A 15 2.583 13.525 8.907 1.00 0.00 C ATOM 246 CG ASP A 15 3.731 12.657 9.392 1.00 0.00 C ATOM 247 OD1 ASP A 15 3.540 11.484 9.719 1.00 0.00 O ATOM 248 H ASP A 15 3.478 13.177 6.478 1.00 0.00 H ATOM 249 HA ASP A 15 1.402 11.939 8.083 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.986 14.471 8.579 1.00 0.00 H ATOM 251 HB3 ASP A 15 1.910 13.693 9.735 1.00 0.00 H HETATM 252 N NH2 A 16 0.961 14.968 6.812 1.00 0.00 N HETATM 253 HN1 NH2 A 16 1.911 15.196 6.721 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.232 15.561 6.535 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 10 ATOM 1 N PHE A 1 25.793 14.781 12.653 1.00 0.00 N ATOM 2 CA PHE A 1 25.372 13.505 12.084 1.00 0.00 C ATOM 3 C PHE A 1 24.063 13.651 11.308 1.00 0.00 C ATOM 4 O PHE A 1 23.167 14.395 11.714 1.00 0.00 O ATOM 5 CB PHE A 1 25.234 12.444 13.186 1.00 0.00 C ATOM 6 CG PHE A 1 24.329 12.843 14.325 1.00 0.00 C ATOM 7 CD1 PHE A 1 22.951 12.867 14.169 1.00 0.00 C ATOM 8 CD2 PHE A 1 24.865 13.198 15.553 1.00 0.00 C ATOM 9 CE1 PHE A 1 22.127 13.236 15.217 1.00 0.00 C ATOM 10 CE2 PHE A 1 24.046 13.568 16.603 1.00 0.00 C ATOM 11 CZ PHE A 1 22.675 13.587 16.435 1.00 0.00 C ATOM 12 H1 PHE A 1 25.163 15.291 13.205 1.00 0.00 H ATOM 13 HA PHE A 1 26.144 13.189 11.397 1.00 0.00 H ATOM 14 HB2 PHE A 1 24.835 11.540 12.752 1.00 0.00 H ATOM 15 HB3 PHE A 1 26.211 12.235 13.596 1.00 0.00 H ATOM 16 HD1 PHE A 1 22.520 12.591 13.219 1.00 0.00 H ATOM 17 HD2 PHE A 1 25.936 13.184 15.687 1.00 0.00 H ATOM 18 HE1 PHE A 1 21.055 13.251 15.083 1.00 0.00 H ATOM 19 HE2 PHE A 1 24.478 13.843 17.555 1.00 0.00 H ATOM 20 HZ PHE A 1 22.034 13.876 17.255 1.00 0.00 H ATOM 21 N GLY A 2 23.967 12.937 10.183 1.00 0.00 N ATOM 22 CA GLY A 2 22.773 12.989 9.351 1.00 0.00 C ATOM 23 C GLY A 2 21.619 12.193 9.935 1.00 0.00 C ATOM 24 O GLY A 2 21.270 11.131 9.416 1.00 0.00 O ATOM 25 H GLY A 2 24.719 12.368 9.913 1.00 0.00 H ATOM 26 HA2 GLY A 2 22.467 14.019 9.244 1.00 0.00 H ATOM 27 HA3 GLY A 2 23.011 12.592 8.375 1.00 0.00 H ATOM 28 N GLY A 3 21.032 12.704 11.019 1.00 0.00 N ATOM 29 CA GLY A 3 19.919 12.028 11.670 1.00 0.00 C ATOM 30 C GLY A 3 18.592 12.232 10.956 1.00 0.00 C ATOM 31 O GLY A 3 17.636 12.717 11.563 1.00 0.00 O ATOM 32 H GLY A 3 21.362 13.552 11.385 1.00 0.00 H ATOM 33 HA2 GLY A 3 20.131 10.970 11.710 1.00 0.00 H ATOM 34 HA3 GLY A 3 19.831 12.402 12.679 1.00 0.00 H ATOM 35 N PHE A 4 18.533 11.857 9.670 1.00 0.00 N ATOM 36 CA PHE A 4 17.315 11.990 8.860 1.00 0.00 C ATOM 37 C PHE A 4 16.614 13.334 9.091 1.00 0.00 C ATOM 38 O PHE A 4 15.468 13.390 9.538 1.00 0.00 O ATOM 39 CB PHE A 4 16.365 10.801 9.103 1.00 0.00 C ATOM 40 CG PHE A 4 16.127 10.462 10.551 1.00 0.00 C ATOM 41 CD1 PHE A 4 15.171 11.137 11.298 1.00 0.00 C ATOM 42 CD2 PHE A 4 16.867 9.465 11.167 1.00 0.00 C ATOM 43 CE1 PHE A 4 14.961 10.822 12.627 1.00 0.00 C ATOM 44 CE2 PHE A 4 16.660 9.146 12.495 1.00 0.00 C ATOM 45 CZ PHE A 4 15.706 9.825 13.226 1.00 0.00 C ATOM 46 H PHE A 4 19.333 11.475 9.252 1.00 0.00 H ATOM 47 HA PHE A 4 17.628 11.961 7.826 1.00 0.00 H ATOM 48 HB2 PHE A 4 15.408 11.025 8.661 1.00 0.00 H ATOM 49 HB3 PHE A 4 16.776 9.925 8.621 1.00 0.00 H ATOM 50 HD1 PHE A 4 14.586 11.914 10.832 1.00 0.00 H ATOM 51 HD2 PHE A 4 17.615 8.933 10.596 1.00 0.00 H ATOM 52 HE1 PHE A 4 14.214 11.354 13.197 1.00 0.00 H ATOM 53 HE2 PHE A 4 17.245 8.366 12.961 1.00 0.00 H ATOM 54 HZ PHE A 4 15.542 9.576 14.264 1.00 0.00 H ATOM 55 N THR A 5 17.320 14.416 8.767 1.00 0.00 N ATOM 56 CA THR A 5 16.785 15.768 8.922 1.00 0.00 C ATOM 57 C THR A 5 15.835 16.122 7.793 1.00 0.00 C ATOM 58 O THR A 5 14.899 16.902 7.964 1.00 0.00 O ATOM 59 CB THR A 5 17.905 16.821 9.014 1.00 0.00 C ATOM 60 OG1 THR A 5 18.707 16.796 7.826 1.00 0.00 O ATOM 61 CG2 THR A 5 18.784 16.563 10.230 1.00 0.00 C ATOM 62 H THR A 5 18.219 14.302 8.404 1.00 0.00 H ATOM 63 HA THR A 5 16.230 15.782 9.825 1.00 0.00 H ATOM 64 HB THR A 5 17.454 17.798 9.115 1.00 0.00 H ATOM 65 HG1 THR A 5 18.407 17.480 7.221 1.00 0.00 H ATOM 66 HG21 THR A 5 19.407 17.425 10.413 1.00 0.00 H ATOM 67 HG22 THR A 5 19.408 15.700 10.047 1.00 0.00 H ATOM 68 HG23 THR A 5 18.160 16.379 11.093 1.00 0.00 H ATOM 69 N LYS A 6 16.075 15.511 6.655 1.00 0.00 N ATOM 70 CA LYS A 6 15.238 15.700 5.477 1.00 0.00 C ATOM 71 C LYS A 6 13.950 14.888 5.635 1.00 0.00 C ATOM 72 O LYS A 6 12.976 15.108 4.913 1.00 0.00 O ATOM 73 CB LYS A 6 15.998 15.272 4.207 1.00 0.00 C ATOM 74 CG LYS A 6 15.790 13.812 3.812 1.00 0.00 C ATOM 75 CD LYS A 6 14.536 13.650 2.967 1.00 0.00 C ATOM 76 CE LYS A 6 13.731 12.418 3.357 1.00 0.00 C ATOM 77 NZ LYS A 6 12.395 12.450 2.764 1.00 0.00 N ATOM 78 H LYS A 6 16.822 14.890 6.617 1.00 0.00 H ATOM 79 HA LYS A 6 14.981 16.746 5.406 1.00 0.00 H ATOM 80 HB2 LYS A 6 15.672 15.891 3.385 1.00 0.00 H ATOM 81 HB3 LYS A 6 17.054 15.432 4.365 1.00 0.00 H ATOM 82 HG2 LYS A 6 16.644 13.477 3.242 1.00 0.00 H ATOM 83 HG3 LYS A 6 15.693 13.215 4.707 1.00 0.00 H ATOM 84 HD2 LYS A 6 13.916 14.524 3.088 1.00 0.00 H ATOM 85 HD3 LYS A 6 14.828 13.561 1.930 1.00 0.00 H ATOM 86 HE2 LYS A 6 14.251 11.537 3.010 1.00 0.00 H ATOM 87 HE3 LYS A 6 13.640 12.385 4.432 1.00 0.00 H ATOM 88 HZ1 LYS A 6 12.323 12.769 1.839 1.00 0.00 H ATOM 89 N ALA A 7 13.960 13.939 6.585 1.00 0.00 N ATOM 90 CA ALA A 7 12.804 13.081 6.832 1.00 0.00 C ATOM 91 C ALA A 7 11.548 13.880 7.124 1.00 0.00 C ATOM 92 O ALA A 7 10.458 13.470 6.747 1.00 0.00 O ATOM 93 CB ALA A 7 13.087 12.100 7.961 1.00 0.00 C ATOM 94 H ALA A 7 14.771 13.812 7.130 1.00 0.00 H ATOM 95 HA ALA A 7 12.633 12.519 5.935 1.00 0.00 H ATOM 96 HB1 ALA A 7 14.130 11.829 7.948 1.00 0.00 H ATOM 97 HB2 ALA A 7 12.484 11.214 7.826 1.00 0.00 H ATOM 98 HB3 ALA A 7 12.845 12.558 8.908 1.00 0.00 H ATOM 99 N ARG A 8 11.702 15.022 7.776 1.00 0.00 N ATOM 100 CA ARG A 8 10.562 15.876 8.091 1.00 0.00 C ATOM 101 C ARG A 8 9.808 16.244 6.823 1.00 0.00 C ATOM 102 O ARG A 8 8.589 16.411 6.829 1.00 0.00 O ATOM 103 CB ARG A 8 11.022 17.163 8.770 1.00 0.00 C ATOM 104 CG ARG A 8 11.543 16.992 10.194 1.00 0.00 C ATOM 105 CD ARG A 8 12.876 16.260 10.221 1.00 0.00 C ATOM 106 NE ARG A 8 13.605 16.455 11.475 1.00 0.00 N ATOM 107 CZ ARG A 8 14.153 17.617 11.854 1.00 0.00 C ATOM 108 NH1 ARG A 8 14.025 18.709 11.101 1.00 0.00 N ATOM 109 NH2 ARG A 8 14.835 17.686 12.992 1.00 0.00 N ATOM 110 H ARG A 8 12.603 15.303 8.039 1.00 0.00 H ATOM 111 HA ARG A 8 9.902 15.332 8.747 1.00 0.00 H ATOM 112 HB2 ARG A 8 11.815 17.593 8.172 1.00 0.00 H ATOM 113 HB3 ARG A 8 10.193 17.852 8.789 1.00 0.00 H ATOM 114 HG2 ARG A 8 11.668 17.965 10.642 1.00 0.00 H ATOM 115 HG3 ARG A 8 10.820 16.424 10.762 1.00 0.00 H ATOM 116 HD2 ARG A 8 12.695 15.205 10.086 1.00 0.00 H ATOM 117 HD3 ARG A 8 13.481 16.624 9.408 1.00 0.00 H ATOM 118 HE ARG A 8 13.708 15.676 12.061 1.00 0.00 H ATOM 119 HH11 ARG A 8 13.518 18.671 10.241 1.00 0.00 H ATOM 120 HH12 ARG A 8 14.441 19.571 11.396 1.00 0.00 H ATOM 121 HH21 ARG A 8 14.940 16.872 13.563 1.00 0.00 H ATOM 122 HH22 ARG A 8 15.249 18.551 13.275 1.00 0.00 H ATOM 123 N LYS A 9 10.557 16.383 5.743 1.00 0.00 N ATOM 124 CA LYS A 9 9.981 16.754 4.453 1.00 0.00 C ATOM 125 C LYS A 9 9.129 15.617 3.888 1.00 0.00 C ATOM 126 O LYS A 9 7.935 15.794 3.633 1.00 0.00 O ATOM 127 CB LYS A 9 11.094 17.130 3.463 1.00 0.00 C ATOM 128 CG LYS A 9 10.665 18.119 2.386 1.00 0.00 C ATOM 129 CD LYS A 9 9.542 17.571 1.517 1.00 0.00 C ATOM 130 CE LYS A 9 9.108 18.578 0.461 1.00 0.00 C ATOM 131 NZ LYS A 9 10.201 18.897 -0.502 1.00 0.00 N ATOM 132 H LYS A 9 11.526 16.238 5.820 1.00 0.00 H ATOM 133 HA LYS A 9 9.349 17.614 4.612 1.00 0.00 H ATOM 134 HB2 LYS A 9 11.915 17.567 4.012 1.00 0.00 H ATOM 135 HB3 LYS A 9 11.442 16.231 2.974 1.00 0.00 H ATOM 136 HG2 LYS A 9 10.324 19.027 2.862 1.00 0.00 H ATOM 137 HG3 LYS A 9 11.516 18.341 1.758 1.00 0.00 H ATOM 138 HD2 LYS A 9 9.884 16.673 1.026 1.00 0.00 H ATOM 139 HD3 LYS A 9 8.696 17.339 2.147 1.00 0.00 H ATOM 140 HE2 LYS A 9 8.271 18.169 -0.084 1.00 0.00 H ATOM 141 HE3 LYS A 9 8.801 19.488 0.957 1.00 0.00 H ATOM 142 HZ1 LYS A 9 9.800 19.251 -1.394 1.00 0.00 H ATOM 143 HZ2 LYS A 9 10.764 18.046 -0.703 1.00 0.00 H ATOM 144 HZ3 LYS A 9 10.828 19.626 -0.104 1.00 0.00 H ATOM 145 N ASP A 10 9.746 14.449 3.694 1.00 0.00 N ATOM 146 CA ASP A 10 9.030 13.283 3.153 1.00 0.00 C ATOM 147 C ASP A 10 8.062 12.665 4.170 1.00 0.00 C ATOM 148 O ASP A 10 7.052 12.080 3.778 1.00 0.00 O ATOM 149 CB ASP A 10 9.996 12.217 2.603 1.00 0.00 C ATOM 150 CG ASP A 10 11.279 12.089 3.402 1.00 0.00 C ATOM 151 OD1 ASP A 10 11.261 11.688 4.565 1.00 0.00 O ATOM 152 H ASP A 10 10.701 14.372 3.920 1.00 0.00 H ATOM 153 HA ASP A 10 8.437 13.648 2.327 1.00 0.00 H ATOM 154 HB2 ASP A 10 9.498 11.259 2.610 1.00 0.00 H ATOM 155 HB3 ASP A 10 10.252 12.471 1.583 1.00 0.00 H ATOM 156 N LYS A 11 8.354 12.806 5.468 1.00 0.00 N ATOM 157 CA LYS A 11 7.477 12.268 6.507 1.00 0.00 C ATOM 158 C LYS A 11 6.328 13.228 6.774 1.00 0.00 C ATOM 159 O LYS A 11 5.162 12.833 6.749 1.00 0.00 O ATOM 160 CB LYS A 11 8.248 11.995 7.805 1.00 0.00 C ATOM 161 CG LYS A 11 7.347 11.633 8.978 1.00 0.00 C ATOM 162 CD LYS A 11 6.498 10.404 8.683 1.00 0.00 C ATOM 163 CE LYS A 11 5.241 10.379 9.541 1.00 0.00 C ATOM 164 NZ LYS A 11 4.310 11.450 9.176 1.00 0.00 N ATOM 165 H LYS A 11 9.159 13.299 5.734 1.00 0.00 H ATOM 166 HA LYS A 11 7.069 11.338 6.141 1.00 0.00 H ATOM 167 HB2 LYS A 11 8.936 11.179 7.640 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.808 12.880 8.070 1.00 0.00 H ATOM 169 HG2 LYS A 11 7.964 11.431 9.842 1.00 0.00 H ATOM 170 HG3 LYS A 11 6.697 12.469 9.188 1.00 0.00 H ATOM 171 HD2 LYS A 11 6.211 10.415 7.641 1.00 0.00 H ATOM 172 HD3 LYS A 11 7.080 9.518 8.888 1.00 0.00 H ATOM 173 HE2 LYS A 11 4.750 9.426 9.410 1.00 0.00 H ATOM 174 HE3 LYS A 11 5.525 10.497 10.576 1.00 0.00 H ATOM 175 HZ1 LYS A 11 4.676 12.354 9.081 1.00 0.00 H ATOM 176 N ARG A 12 6.665 14.497 7.009 1.00 0.00 N ATOM 177 CA ARG A 12 5.658 15.521 7.259 1.00 0.00 C ATOM 178 C ARG A 12 4.626 15.520 6.134 1.00 0.00 C ATOM 179 O ARG A 12 3.444 15.774 6.366 1.00 0.00 O ATOM 180 CB ARG A 12 6.319 16.901 7.401 1.00 0.00 C ATOM 181 CG ARG A 12 5.348 18.034 7.715 1.00 0.00 C ATOM 182 CD ARG A 12 4.694 18.595 6.457 1.00 0.00 C ATOM 183 NE ARG A 12 3.700 19.626 6.766 1.00 0.00 N ATOM 184 CZ ARG A 12 3.985 20.811 7.319 1.00 0.00 C ATOM 185 NH1 ARG A 12 5.245 21.153 7.584 1.00 0.00 N ATOM 186 NH2 ARG A 12 3.004 21.664 7.593 1.00 0.00 N ATOM 187 H ARG A 12 7.612 14.749 7.000 1.00 0.00 H ATOM 188 HA ARG A 12 5.159 15.273 8.184 1.00 0.00 H ATOM 189 HB2 ARG A 12 7.044 16.855 8.200 1.00 0.00 H ATOM 190 HB3 ARG A 12 6.829 17.138 6.480 1.00 0.00 H ATOM 191 HG2 ARG A 12 4.575 17.660 8.369 1.00 0.00 H ATOM 192 HG3 ARG A 12 5.887 18.825 8.213 1.00 0.00 H ATOM 193 HD2 ARG A 12 5.461 19.026 5.831 1.00 0.00 H ATOM 194 HD3 ARG A 12 4.210 17.791 5.926 1.00 0.00 H ATOM 195 HE ARG A 12 2.764 19.419 6.562 1.00 0.00 H ATOM 196 HH11 ARG A 12 5.993 20.526 7.369 1.00 0.00 H ATOM 197 HH12 ARG A 12 5.444 22.041 7.999 1.00 0.00 H ATOM 198 HH21 ARG A 12 2.056 21.420 7.385 1.00 0.00 H ATOM 199 HH22 ARG A 12 3.211 22.550 8.007 1.00 0.00 H ATOM 200 N LYS A 13 5.079 15.208 4.914 1.00 0.00 N ATOM 201 CA LYS A 13 4.183 15.150 3.761 1.00 0.00 C ATOM 202 C LYS A 13 3.375 13.855 3.760 1.00 0.00 C ATOM 203 O LYS A 13 2.161 13.877 3.547 1.00 0.00 O ATOM 204 CB LYS A 13 4.971 15.288 2.452 1.00 0.00 C ATOM 205 CG LYS A 13 4.118 15.155 1.196 1.00 0.00 C ATOM 206 CD LYS A 13 3.054 16.240 1.116 1.00 0.00 C ATOM 207 CE LYS A 13 2.167 16.065 -0.109 1.00 0.00 C ATOM 208 NZ LYS A 13 1.134 17.135 -0.207 1.00 0.00 N ATOM 209 H LYS A 13 6.036 14.998 4.792 1.00 0.00 H ATOM 210 HA LYS A 13 3.496 15.970 3.850 1.00 0.00 H ATOM 211 HB2 LYS A 13 5.450 16.256 2.434 1.00 0.00 H ATOM 212 HB3 LYS A 13 5.732 14.521 2.424 1.00 0.00 H ATOM 213 HG2 LYS A 13 4.758 15.231 0.331 1.00 0.00 H ATOM 214 HG3 LYS A 13 3.635 14.189 1.202 1.00 0.00 H ATOM 215 HD2 LYS A 13 2.438 16.195 2.001 1.00 0.00 H ATOM 216 HD3 LYS A 13 3.540 17.203 1.061 1.00 0.00 H ATOM 217 HE2 LYS A 13 2.786 16.092 -0.993 1.00 0.00 H ATOM 218 HE3 LYS A 13 1.674 15.105 -0.046 1.00 0.00 H ATOM 219 HZ1 LYS A 13 0.907 17.504 0.739 1.00 0.00 H ATOM 220 HZ2 LYS A 13 0.266 16.755 -0.636 1.00 0.00 H ATOM 221 HZ3 LYS A 13 1.485 17.916 -0.797 1.00 0.00 H ATOM 222 N LEU A 14 4.049 12.733 4.009 1.00 0.00 N ATOM 223 CA LEU A 14 3.383 11.432 4.047 1.00 0.00 C ATOM 224 C LEU A 14 2.299 11.404 5.131 1.00 0.00 C ATOM 225 O LEU A 14 1.351 10.623 5.046 1.00 0.00 O ATOM 226 CB LEU A 14 4.401 10.312 4.307 1.00 0.00 C ATOM 227 CG LEU A 14 4.263 9.075 3.411 1.00 0.00 C ATOM 228 CD1 LEU A 14 2.854 8.504 3.485 1.00 0.00 C ATOM 229 CD2 LEU A 14 4.629 9.416 1.973 1.00 0.00 C ATOM 230 H LEU A 14 5.014 12.781 4.178 1.00 0.00 H ATOM 231 HA LEU A 14 2.919 11.269 3.086 1.00 0.00 H ATOM 232 HB2 LEU A 14 5.392 10.716 4.172 1.00 0.00 H ATOM 233 HB3 LEU A 14 4.299 9.994 5.334 1.00 0.00 H ATOM 234 HG LEU A 14 4.947 8.313 3.756 1.00 0.00 H ATOM 235 HD11 LEU A 14 2.555 8.417 4.519 1.00 0.00 H ATOM 236 HD12 LEU A 14 2.837 7.528 3.022 1.00 0.00 H ATOM 237 HD13 LEU A 14 2.172 9.161 2.967 1.00 0.00 H ATOM 238 HD21 LEU A 14 4.676 8.509 1.389 1.00 0.00 H ATOM 239 HD22 LEU A 14 5.592 9.907 1.954 1.00 0.00 H ATOM 240 HD23 LEU A 14 3.881 10.074 1.557 1.00 0.00 H ATOM 241 N ASP A 15 2.446 12.261 6.150 1.00 0.00 N ATOM 242 CA ASP A 15 1.477 12.325 7.246 1.00 0.00 C ATOM 243 C ASP A 15 0.462 13.447 7.032 1.00 0.00 C ATOM 244 O ASP A 15 -0.746 13.222 7.096 1.00 0.00 O ATOM 245 CB ASP A 15 2.194 12.492 8.592 1.00 0.00 C ATOM 246 CG ASP A 15 3.006 11.262 8.968 1.00 0.00 C ATOM 247 OD1 ASP A 15 2.465 10.160 9.067 1.00 0.00 O ATOM 248 H ASP A 15 3.221 12.871 6.159 1.00 0.00 H ATOM 249 HA ASP A 15 0.943 11.387 7.257 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.861 13.340 8.537 1.00 0.00 H ATOM 251 HB3 ASP A 15 1.459 12.667 9.366 1.00 0.00 H HETATM 252 N NH2 A 16 0.948 14.659 6.779 1.00 0.00 N HETATM 253 HN1 NH2 A 16 1.921 14.772 6.742 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.312 15.392 6.639 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 11 ATOM 1 N PHE A 1 25.756 14.723 9.439 1.00 0.00 N ATOM 2 CA PHE A 1 24.892 14.140 8.417 1.00 0.00 C ATOM 3 C PHE A 1 23.888 13.156 9.026 1.00 0.00 C ATOM 4 O PHE A 1 23.684 12.055 8.506 1.00 0.00 O ATOM 5 CB PHE A 1 25.738 13.460 7.326 1.00 0.00 C ATOM 6 CG PHE A 1 26.861 12.597 7.848 1.00 0.00 C ATOM 7 CD1 PHE A 1 26.623 11.595 8.779 1.00 0.00 C ATOM 8 CD2 PHE A 1 28.160 12.792 7.401 1.00 0.00 C ATOM 9 CE1 PHE A 1 27.655 10.809 9.252 1.00 0.00 C ATOM 10 CE2 PHE A 1 29.196 12.008 7.872 1.00 0.00 C ATOM 11 CZ PHE A 1 28.943 11.015 8.798 1.00 0.00 C ATOM 12 H1 PHE A 1 25.500 15.572 9.856 1.00 0.00 H ATOM 13 HA PHE A 1 24.338 14.951 7.966 1.00 0.00 H ATOM 14 HB2 PHE A 1 25.096 12.835 6.725 1.00 0.00 H ATOM 15 HB3 PHE A 1 26.171 14.224 6.696 1.00 0.00 H ATOM 16 HD1 PHE A 1 25.619 11.430 9.135 1.00 0.00 H ATOM 17 HD2 PHE A 1 28.361 13.569 6.677 1.00 0.00 H ATOM 18 HE1 PHE A 1 27.455 10.034 9.976 1.00 0.00 H ATOM 19 HE2 PHE A 1 30.202 12.171 7.516 1.00 0.00 H ATOM 20 HZ PHE A 1 29.751 10.401 9.167 1.00 0.00 H ATOM 21 N GLY A 2 23.253 13.570 10.128 1.00 0.00 N ATOM 22 CA GLY A 2 22.272 12.727 10.793 1.00 0.00 C ATOM 23 C GLY A 2 21.157 12.280 9.864 1.00 0.00 C ATOM 24 O GLY A 2 20.631 13.079 9.085 1.00 0.00 O ATOM 25 H GLY A 2 23.451 14.460 10.488 1.00 0.00 H ATOM 26 HA2 GLY A 2 22.772 11.854 11.184 1.00 0.00 H ATOM 27 HA3 GLY A 2 21.838 13.278 11.614 1.00 0.00 H ATOM 28 N GLY A 3 20.802 10.998 9.946 1.00 0.00 N ATOM 29 CA GLY A 3 19.749 10.449 9.105 1.00 0.00 C ATOM 30 C GLY A 3 18.354 10.709 9.648 1.00 0.00 C ATOM 31 O GLY A 3 17.517 9.805 9.672 1.00 0.00 O ATOM 32 H GLY A 3 21.259 10.417 10.584 1.00 0.00 H ATOM 33 HA2 GLY A 3 19.826 10.888 8.120 1.00 0.00 H ATOM 34 HA3 GLY A 3 19.896 9.382 9.020 1.00 0.00 H ATOM 35 N PHE A 4 18.102 11.945 10.084 1.00 0.00 N ATOM 36 CA PHE A 4 16.798 12.323 10.629 1.00 0.00 C ATOM 37 C PHE A 4 16.463 13.791 10.339 1.00 0.00 C ATOM 38 O PHE A 4 15.545 14.350 10.943 1.00 0.00 O ATOM 39 CB PHE A 4 16.768 12.066 12.143 1.00 0.00 C ATOM 40 CG PHE A 4 17.901 12.712 12.901 1.00 0.00 C ATOM 41 CD1 PHE A 4 18.082 14.088 12.882 1.00 0.00 C ATOM 42 CD2 PHE A 4 18.784 11.938 13.635 1.00 0.00 C ATOM 43 CE1 PHE A 4 19.121 14.675 13.577 1.00 0.00 C ATOM 44 CE2 PHE A 4 19.825 12.520 14.332 1.00 0.00 C ATOM 45 CZ PHE A 4 19.994 13.890 14.303 1.00 0.00 C ATOM 46 H PHE A 4 18.810 12.618 10.041 1.00 0.00 H ATOM 47 HA PHE A 4 16.053 11.702 10.157 1.00 0.00 H ATOM 48 HB2 PHE A 4 15.842 12.449 12.545 1.00 0.00 H ATOM 49 HB3 PHE A 4 16.814 11.001 12.319 1.00 0.00 H ATOM 50 HD1 PHE A 4 17.399 14.704 12.317 1.00 0.00 H ATOM 51 HD2 PHE A 4 18.655 10.865 13.658 1.00 0.00 H ATOM 52 HE1 PHE A 4 19.251 15.747 13.554 1.00 0.00 H ATOM 53 HE2 PHE A 4 20.505 11.904 14.900 1.00 0.00 H ATOM 54 HZ PHE A 4 20.809 14.346 14.846 1.00 0.00 H ATOM 55 N THR A 5 17.196 14.410 9.407 1.00 0.00 N ATOM 56 CA THR A 5 16.951 15.804 9.050 1.00 0.00 C ATOM 57 C THR A 5 15.914 15.905 7.957 1.00 0.00 C ATOM 58 O THR A 5 14.876 16.550 8.115 1.00 0.00 O ATOM 59 CB THR A 5 18.247 16.522 8.608 1.00 0.00 C ATOM 60 OG1 THR A 5 19.231 16.447 9.649 1.00 0.00 O ATOM 61 CG2 THR A 5 17.978 17.982 8.264 1.00 0.00 C ATOM 62 H THR A 5 17.909 13.918 8.947 1.00 0.00 H ATOM 63 HA THR A 5 16.566 16.289 9.902 1.00 0.00 H ATOM 64 HB THR A 5 18.629 16.026 7.728 1.00 0.00 H ATOM 65 HG1 THR A 5 18.863 16.791 10.467 1.00 0.00 H ATOM 66 HG21 THR A 5 17.459 18.040 7.318 1.00 0.00 H ATOM 67 HG22 THR A 5 18.917 18.514 8.192 1.00 0.00 H ATOM 68 HG23 THR A 5 17.370 18.428 9.036 1.00 0.00 H ATOM 69 N LYS A 6 16.200 15.229 6.871 1.00 0.00 N ATOM 70 CA LYS A 6 15.299 15.180 5.726 1.00 0.00 C ATOM 71 C LYS A 6 14.002 14.459 6.107 1.00 0.00 C ATOM 72 O LYS A 6 12.991 14.577 5.412 1.00 0.00 O ATOM 73 CB LYS A 6 15.958 14.462 4.542 1.00 0.00 C ATOM 74 CG LYS A 6 15.061 14.379 3.315 1.00 0.00 C ATOM 75 CD LYS A 6 15.292 13.097 2.531 1.00 0.00 C ATOM 76 CE LYS A 6 13.991 12.576 1.936 1.00 0.00 C ATOM 77 NZ LYS A 6 12.975 12.337 2.968 1.00 0.00 N ATOM 78 H LYS A 6 17.033 14.728 6.855 1.00 0.00 H ATOM 79 HA LYS A 6 15.066 16.194 5.441 1.00 0.00 H ATOM 80 HB2 LYS A 6 16.858 14.993 4.269 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.219 13.458 4.841 1.00 0.00 H ATOM 82 HG2 LYS A 6 14.030 14.414 3.627 1.00 0.00 H ATOM 83 HG3 LYS A 6 15.271 15.222 2.674 1.00 0.00 H ATOM 84 HD2 LYS A 6 15.988 13.295 1.731 1.00 0.00 H ATOM 85 HD3 LYS A 6 15.701 12.347 3.193 1.00 0.00 H ATOM 86 HE2 LYS A 6 13.614 13.304 1.234 1.00 0.00 H ATOM 87 HE3 LYS A 6 14.192 11.649 1.419 1.00 0.00 H ATOM 88 HZ1 LYS A 6 13.283 12.257 3.895 1.00 0.00 H ATOM 89 N ALA A 7 14.039 13.706 7.213 1.00 0.00 N ATOM 90 CA ALA A 7 12.869 12.963 7.668 1.00 0.00 C ATOM 91 C ALA A 7 11.697 13.879 7.959 1.00 0.00 C ATOM 92 O ALA A 7 10.552 13.520 7.700 1.00 0.00 O ATOM 93 CB ALA A 7 13.206 12.108 8.881 1.00 0.00 C ATOM 94 H ALA A 7 14.872 13.651 7.734 1.00 0.00 H ATOM 95 HA ALA A 7 12.580 12.312 6.865 1.00 0.00 H ATOM 96 HB1 ALA A 7 14.032 11.453 8.643 1.00 0.00 H ATOM 97 HB2 ALA A 7 12.345 11.516 9.154 1.00 0.00 H ATOM 98 HB3 ALA A 7 13.480 12.747 9.708 1.00 0.00 H ATOM 99 N ARG A 8 11.980 15.066 8.476 1.00 0.00 N ATOM 100 CA ARG A 8 10.930 16.030 8.768 1.00 0.00 C ATOM 101 C ARG A 8 10.153 16.350 7.498 1.00 0.00 C ATOM 102 O ARG A 8 8.943 16.562 7.532 1.00 0.00 O ATOM 103 CB ARG A 8 11.536 17.317 9.326 1.00 0.00 C ATOM 104 CG ARG A 8 10.732 17.938 10.458 1.00 0.00 C ATOM 105 CD ARG A 8 9.281 18.168 10.063 1.00 0.00 C ATOM 106 NE ARG A 8 8.472 18.635 11.190 1.00 0.00 N ATOM 107 CZ ARG A 8 8.206 17.904 12.280 1.00 0.00 C ATOM 108 NH1 ARG A 8 8.651 16.652 12.386 1.00 0.00 N ATOM 109 NH2 ARG A 8 7.478 18.423 13.263 1.00 0.00 N ATOM 110 H ARG A 8 12.915 15.305 8.650 1.00 0.00 H ATOM 111 HA ARG A 8 10.259 15.594 9.491 1.00 0.00 H ATOM 112 HB2 ARG A 8 12.528 17.101 9.691 1.00 0.00 H ATOM 113 HB3 ARG A 8 11.608 18.038 8.523 1.00 0.00 H ATOM 114 HG2 ARG A 8 10.762 17.277 11.310 1.00 0.00 H ATOM 115 HG3 ARG A 8 11.178 18.886 10.722 1.00 0.00 H ATOM 116 HD2 ARG A 8 9.248 18.907 9.276 1.00 0.00 H ATOM 117 HD3 ARG A 8 8.870 17.238 9.699 1.00 0.00 H ATOM 118 HE ARG A 8 8.113 19.545 11.137 1.00 0.00 H ATOM 119 HH11 ARG A 8 9.188 16.245 11.648 1.00 0.00 H ATOM 120 HH12 ARG A 8 8.450 16.118 13.207 1.00 0.00 H ATOM 121 HH21 ARG A 8 7.131 19.357 13.188 1.00 0.00 H ATOM 122 HH22 ARG A 8 7.276 17.879 14.078 1.00 0.00 H ATOM 123 N LYS A 9 10.870 16.371 6.379 1.00 0.00 N ATOM 124 CA LYS A 9 10.260 16.656 5.081 1.00 0.00 C ATOM 125 C LYS A 9 9.554 15.422 4.525 1.00 0.00 C ATOM 126 O LYS A 9 8.413 15.501 4.073 1.00 0.00 O ATOM 127 CB LYS A 9 11.309 17.160 4.081 1.00 0.00 C ATOM 128 CG LYS A 9 11.679 18.629 4.253 1.00 0.00 C ATOM 129 CD LYS A 9 12.323 18.910 5.605 1.00 0.00 C ATOM 130 CE LYS A 9 13.659 18.197 5.760 1.00 0.00 C ATOM 131 NZ LYS A 9 14.649 18.629 4.733 1.00 0.00 N ATOM 132 H LYS A 9 11.834 16.175 6.430 1.00 0.00 H ATOM 133 HA LYS A 9 9.524 17.433 5.232 1.00 0.00 H ATOM 134 HB2 LYS A 9 12.207 16.572 4.194 1.00 0.00 H ATOM 135 HB3 LYS A 9 10.927 17.024 3.079 1.00 0.00 H ATOM 136 HG2 LYS A 9 12.374 18.907 3.475 1.00 0.00 H ATOM 137 HG3 LYS A 9 10.783 19.226 4.162 1.00 0.00 H ATOM 138 HD2 LYS A 9 12.485 19.974 5.698 1.00 0.00 H ATOM 139 HD3 LYS A 9 11.656 18.580 6.386 1.00 0.00 H ATOM 140 HE2 LYS A 9 14.057 18.415 6.741 1.00 0.00 H ATOM 141 HE3 LYS A 9 13.498 17.134 5.667 1.00 0.00 H ATOM 142 HZ1 LYS A 9 15.610 18.369 5.032 1.00 0.00 H ATOM 143 HZ2 LYS A 9 14.606 19.660 4.604 1.00 0.00 H ATOM 144 HZ3 LYS A 9 14.444 18.168 3.823 1.00 0.00 H ATOM 145 N ASP A 10 10.237 14.282 4.563 1.00 0.00 N ATOM 146 CA ASP A 10 9.673 13.032 4.061 1.00 0.00 C ATOM 147 C ASP A 10 8.532 12.511 4.946 1.00 0.00 C ATOM 148 O ASP A 10 7.662 11.789 4.463 1.00 0.00 O ATOM 149 CB ASP A 10 10.768 11.966 3.916 1.00 0.00 C ATOM 150 CG ASP A 10 11.671 12.218 2.716 1.00 0.00 C ATOM 151 OD1 ASP A 10 11.200 12.296 1.580 1.00 0.00 O ATOM 152 H ASP A 10 11.145 14.279 4.936 1.00 0.00 H ATOM 153 HA ASP A 10 9.269 13.237 3.081 1.00 0.00 H ATOM 154 HB2 ASP A 10 11.379 11.964 4.806 1.00 0.00 H ATOM 155 HB3 ASP A 10 10.307 10.996 3.800 1.00 0.00 H ATOM 156 N LYS A 11 8.524 12.869 6.237 1.00 0.00 N ATOM 157 CA LYS A 11 7.468 12.405 7.137 1.00 0.00 C ATOM 158 C LYS A 11 6.257 13.329 7.067 1.00 0.00 C ATOM 159 O LYS A 11 5.155 12.885 6.750 1.00 0.00 O ATOM 160 CB LYS A 11 7.974 12.304 8.585 1.00 0.00 C ATOM 161 CG LYS A 11 7.317 11.186 9.394 1.00 0.00 C ATOM 162 CD LYS A 11 5.798 11.202 9.275 1.00 0.00 C ATOM 163 CE LYS A 11 5.184 12.432 9.929 1.00 0.00 C ATOM 164 NZ LYS A 11 4.055 12.957 9.159 1.00 0.00 N ATOM 165 H LYS A 11 9.229 13.458 6.587 1.00 0.00 H ATOM 166 HA LYS A 11 7.167 11.424 6.804 1.00 0.00 H ATOM 167 HB2 LYS A 11 9.038 12.124 8.568 1.00 0.00 H ATOM 168 HB3 LYS A 11 7.785 13.241 9.087 1.00 0.00 H ATOM 169 HG2 LYS A 11 7.683 10.236 9.035 1.00 0.00 H ATOM 170 HG3 LYS A 11 7.588 11.305 10.433 1.00 0.00 H ATOM 171 HD2 LYS A 11 5.530 11.191 8.230 1.00 0.00 H ATOM 172 HD3 LYS A 11 5.404 10.317 9.754 1.00 0.00 H ATOM 173 HE2 LYS A 11 4.838 12.163 10.916 1.00 0.00 H ATOM 174 HE3 LYS A 11 5.940 13.198 10.009 1.00 0.00 H ATOM 175 HZ1 LYS A 11 4.087 13.901 8.905 1.00 0.00 H ATOM 176 N ARG A 12 6.476 14.617 7.347 1.00 0.00 N ATOM 177 CA ARG A 12 5.402 15.613 7.310 1.00 0.00 C ATOM 178 C ARG A 12 4.626 15.502 6.000 1.00 0.00 C ATOM 179 O ARG A 12 3.396 15.603 5.983 1.00 0.00 O ATOM 180 CB ARG A 12 5.980 17.028 7.470 1.00 0.00 C ATOM 181 CG ARG A 12 5.017 18.032 8.094 1.00 0.00 C ATOM 182 CD ARG A 12 3.801 18.291 7.218 1.00 0.00 C ATOM 183 NE ARG A 12 2.908 19.292 7.802 1.00 0.00 N ATOM 184 CZ ARG A 12 3.209 20.587 7.940 1.00 0.00 C ATOM 185 NH1 ARG A 12 4.368 21.068 7.493 1.00 0.00 N ATOM 186 NH2 ARG A 12 2.339 21.407 8.521 1.00 0.00 N ATOM 187 H ARG A 12 7.383 14.905 7.577 1.00 0.00 H ATOM 188 HA ARG A 12 4.732 15.412 8.131 1.00 0.00 H ATOM 189 HB2 ARG A 12 6.858 16.974 8.094 1.00 0.00 H ATOM 190 HB3 ARG A 12 6.267 17.397 6.496 1.00 0.00 H ATOM 191 HG2 ARG A 12 4.681 17.645 9.044 1.00 0.00 H ATOM 192 HG3 ARG A 12 5.541 18.963 8.252 1.00 0.00 H ATOM 193 HD2 ARG A 12 4.135 18.640 6.253 1.00 0.00 H ATOM 194 HD3 ARG A 12 3.257 17.368 7.098 1.00 0.00 H ATOM 195 HE ARG A 12 2.036 18.978 8.124 1.00 0.00 H ATOM 196 HH11 ARG A 12 5.025 20.462 7.046 1.00 0.00 H ATOM 197 HH12 ARG A 12 4.580 22.039 7.602 1.00 0.00 H ATOM 198 HH21 ARG A 12 1.464 21.054 8.852 1.00 0.00 H ATOM 199 HH22 ARG A 12 2.558 22.377 8.625 1.00 0.00 H ATOM 200 N LYS A 13 5.353 15.270 4.907 1.00 0.00 N ATOM 201 CA LYS A 13 4.727 15.126 3.594 1.00 0.00 C ATOM 202 C LYS A 13 3.980 13.802 3.475 1.00 0.00 C ATOM 203 O LYS A 13 2.828 13.777 3.040 1.00 0.00 O ATOM 204 CB LYS A 13 5.766 15.266 2.475 1.00 0.00 C ATOM 205 CG LYS A 13 6.054 16.710 2.075 1.00 0.00 C ATOM 206 CD LYS A 13 6.369 17.592 3.277 1.00 0.00 C ATOM 207 CE LYS A 13 6.685 19.022 2.858 1.00 0.00 C ATOM 208 NZ LYS A 13 7.928 19.107 2.036 1.00 0.00 N ATOM 209 H LYS A 13 6.333 15.178 4.991 1.00 0.00 H ATOM 210 HA LYS A 13 4.006 15.919 3.501 1.00 0.00 H ATOM 211 HB2 LYS A 13 6.691 14.814 2.801 1.00 0.00 H ATOM 212 HB3 LYS A 13 5.409 14.740 1.603 1.00 0.00 H ATOM 213 HG2 LYS A 13 6.901 16.722 1.406 1.00 0.00 H ATOM 214 HG3 LYS A 13 5.188 17.108 1.565 1.00 0.00 H ATOM 215 HD2 LYS A 13 5.514 17.603 3.936 1.00 0.00 H ATOM 216 HD3 LYS A 13 7.220 17.184 3.798 1.00 0.00 H ATOM 217 HE2 LYS A 13 5.858 19.405 2.281 1.00 0.00 H ATOM 218 HE3 LYS A 13 6.811 19.623 3.747 1.00 0.00 H ATOM 219 HZ1 LYS A 13 8.291 20.081 2.038 1.00 0.00 H ATOM 220 HZ2 LYS A 13 7.728 18.827 1.055 1.00 0.00 H ATOM 221 HZ3 LYS A 13 8.658 18.475 2.423 1.00 0.00 H ATOM 222 N LEU A 14 4.625 12.708 3.881 1.00 0.00 N ATOM 223 CA LEU A 14 3.991 11.391 3.831 1.00 0.00 C ATOM 224 C LEU A 14 2.791 11.304 4.788 1.00 0.00 C ATOM 225 O LEU A 14 1.967 10.397 4.661 1.00 0.00 O ATOM 226 CB LEU A 14 5.002 10.277 4.140 1.00 0.00 C ATOM 227 CG LEU A 14 5.748 9.707 2.924 1.00 0.00 C ATOM 228 CD1 LEU A 14 6.482 10.799 2.155 1.00 0.00 C ATOM 229 CD2 LEU A 14 6.719 8.621 3.364 1.00 0.00 C ATOM 230 H LEU A 14 5.538 12.789 4.234 1.00 0.00 H ATOM 231 HA LEU A 14 3.627 11.252 2.823 1.00 0.00 H ATOM 232 HB2 LEU A 14 5.731 10.665 4.836 1.00 0.00 H ATOM 233 HB3 LEU A 14 4.473 9.466 4.618 1.00 0.00 H ATOM 234 HG LEU A 14 5.031 9.256 2.252 1.00 0.00 H ATOM 235 HD11 LEU A 14 6.260 10.708 1.101 1.00 0.00 H ATOM 236 HD12 LEU A 14 7.546 10.695 2.308 1.00 0.00 H ATOM 237 HD13 LEU A 14 6.162 11.768 2.505 1.00 0.00 H ATOM 238 HD21 LEU A 14 6.188 7.873 3.934 1.00 0.00 H ATOM 239 HD22 LEU A 14 7.494 9.058 3.977 1.00 0.00 H ATOM 240 HD23 LEU A 14 7.166 8.162 2.494 1.00 0.00 H ATOM 241 N ASP A 15 2.683 12.253 5.733 1.00 0.00 N ATOM 242 CA ASP A 15 1.563 12.262 6.681 1.00 0.00 C ATOM 243 C ASP A 15 0.341 12.936 6.062 1.00 0.00 C ATOM 244 O ASP A 15 -0.727 12.331 5.957 1.00 0.00 O ATOM 245 CB ASP A 15 1.936 12.974 7.990 1.00 0.00 C ATOM 246 CG ASP A 15 2.998 12.235 8.786 1.00 0.00 C ATOM 247 OD1 ASP A 15 2.862 11.042 9.065 1.00 0.00 O ATOM 248 H ASP A 15 3.359 12.968 5.781 1.00 0.00 H ATOM 249 HA ASP A 15 1.313 11.235 6.901 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.310 13.960 7.760 1.00 0.00 H ATOM 251 HB3 ASP A 15 1.052 13.066 8.605 1.00 0.00 H HETATM 252 N NH2 A 16 0.497 14.192 5.652 1.00 0.00 N HETATM 253 HN1 NH2 A 16 1.375 14.612 5.766 1.00 0.00 H HETATM 254 HN2 NH2 A 16 -0.274 14.647 5.253 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 12 ATOM 1 N PHE A 1 19.877 9.587 9.608 1.00 0.00 N ATOM 2 CA PHE A 1 21.316 9.706 9.391 1.00 0.00 C ATOM 3 C PHE A 1 21.916 10.795 10.297 1.00 0.00 C ATOM 4 O PHE A 1 21.383 11.060 11.377 1.00 0.00 O ATOM 5 CB PHE A 1 21.593 9.971 7.900 1.00 0.00 C ATOM 6 CG PHE A 1 20.839 11.142 7.326 1.00 0.00 C ATOM 7 CD1 PHE A 1 21.314 12.435 7.474 1.00 0.00 C ATOM 8 CD2 PHE A 1 19.649 10.945 6.643 1.00 0.00 C ATOM 9 CE1 PHE A 1 20.618 13.509 6.951 1.00 0.00 C ATOM 10 CE2 PHE A 1 18.949 12.014 6.118 1.00 0.00 C ATOM 11 CZ PHE A 1 19.434 13.298 6.272 1.00 0.00 C ATOM 12 H1 PHE A 1 19.550 9.083 10.383 1.00 0.00 H ATOM 13 HA PHE A 1 21.760 8.759 9.661 1.00 0.00 H ATOM 14 HB2 PHE A 1 22.646 10.158 7.763 1.00 0.00 H ATOM 15 HB3 PHE A 1 21.318 9.093 7.334 1.00 0.00 H ATOM 16 HD1 PHE A 1 22.240 12.601 8.002 1.00 0.00 H ATOM 17 HD2 PHE A 1 19.269 9.941 6.522 1.00 0.00 H ATOM 18 HE1 PHE A 1 20.999 14.512 7.074 1.00 0.00 H ATOM 19 HE2 PHE A 1 18.024 11.846 5.587 1.00 0.00 H ATOM 20 HZ PHE A 1 18.888 14.135 5.863 1.00 0.00 H ATOM 21 N GLY A 2 23.028 11.412 9.873 1.00 0.00 N ATOM 22 CA GLY A 2 23.668 12.443 10.682 1.00 0.00 C ATOM 23 C GLY A 2 22.727 13.574 11.063 1.00 0.00 C ATOM 24 O GLY A 2 22.458 13.788 12.246 1.00 0.00 O ATOM 25 H GLY A 2 23.424 11.158 9.015 1.00 0.00 H ATOM 26 HA2 GLY A 2 24.046 11.989 11.585 1.00 0.00 H ATOM 27 HA3 GLY A 2 24.498 12.854 10.126 1.00 0.00 H ATOM 28 N GLY A 3 22.222 14.294 10.061 1.00 0.00 N ATOM 29 CA GLY A 3 21.308 15.395 10.316 1.00 0.00 C ATOM 30 C GLY A 3 19.958 14.927 10.834 1.00 0.00 C ATOM 31 O GLY A 3 19.432 15.486 11.798 1.00 0.00 O ATOM 32 H GLY A 3 22.472 14.075 9.140 1.00 0.00 H ATOM 33 HA2 GLY A 3 21.752 16.054 11.047 1.00 0.00 H ATOM 34 HA3 GLY A 3 21.158 15.944 9.398 1.00 0.00 H ATOM 35 N PHE A 4 19.399 13.899 10.187 1.00 0.00 N ATOM 36 CA PHE A 4 18.100 13.340 10.570 1.00 0.00 C ATOM 37 C PHE A 4 16.992 14.406 10.516 1.00 0.00 C ATOM 38 O PHE A 4 15.999 14.324 11.242 1.00 0.00 O ATOM 39 CB PHE A 4 18.191 12.722 11.975 1.00 0.00 C ATOM 40 CG PHE A 4 16.944 12.002 12.413 1.00 0.00 C ATOM 41 CD1 PHE A 4 16.309 11.105 11.568 1.00 0.00 C ATOM 42 CD2 PHE A 4 16.409 12.225 13.672 1.00 0.00 C ATOM 43 CE1 PHE A 4 15.164 10.445 11.971 1.00 0.00 C ATOM 44 CE2 PHE A 4 15.264 11.567 14.079 1.00 0.00 C ATOM 45 CZ PHE A 4 14.641 10.677 13.228 1.00 0.00 C ATOM 46 H PHE A 4 19.874 13.504 9.428 1.00 0.00 H ATOM 47 HA PHE A 4 17.860 12.561 9.863 1.00 0.00 H ATOM 48 HB2 PHE A 4 19.004 12.013 11.994 1.00 0.00 H ATOM 49 HB3 PHE A 4 18.391 13.506 12.692 1.00 0.00 H ATOM 50 HD1 PHE A 4 16.717 10.923 10.585 1.00 0.00 H ATOM 51 HD2 PHE A 4 16.895 12.921 14.339 1.00 0.00 H ATOM 52 HE1 PHE A 4 14.678 9.749 11.303 1.00 0.00 H ATOM 53 HE2 PHE A 4 14.857 11.750 15.063 1.00 0.00 H ATOM 54 HZ PHE A 4 13.746 10.161 13.544 1.00 0.00 H ATOM 55 N THR A 5 17.162 15.398 9.637 1.00 0.00 N ATOM 56 CA THR A 5 16.173 16.462 9.478 1.00 0.00 C ATOM 57 C THR A 5 15.260 16.194 8.298 1.00 0.00 C ATOM 58 O THR A 5 14.057 16.459 8.345 1.00 0.00 O ATOM 59 CB THR A 5 16.828 17.856 9.341 1.00 0.00 C ATOM 60 OG1 THR A 5 15.819 18.867 9.228 1.00 0.00 O ATOM 61 CG2 THR A 5 17.750 17.919 8.129 1.00 0.00 C ATOM 62 H THR A 5 17.961 15.404 9.073 1.00 0.00 H ATOM 63 HA THR A 5 15.572 16.456 10.349 1.00 0.00 H ATOM 64 HB THR A 5 17.416 18.046 10.228 1.00 0.00 H ATOM 65 HG1 THR A 5 15.547 19.148 10.105 1.00 0.00 H ATOM 66 HG21 THR A 5 18.239 18.881 8.099 1.00 0.00 H ATOM 67 HG22 THR A 5 17.170 17.781 7.228 1.00 0.00 H ATOM 68 HG23 THR A 5 18.494 17.140 8.201 1.00 0.00 H ATOM 69 N LYS A 6 15.851 15.645 7.260 1.00 0.00 N ATOM 70 CA LYS A 6 15.128 15.290 6.045 1.00 0.00 C ATOM 71 C LYS A 6 14.025 14.279 6.350 1.00 0.00 C ATOM 72 O LYS A 6 13.043 14.193 5.617 1.00 0.00 O ATOM 73 CB LYS A 6 16.089 14.713 4.996 1.00 0.00 C ATOM 74 CG LYS A 6 15.391 14.002 3.842 1.00 0.00 C ATOM 75 CD LYS A 6 14.526 14.951 3.023 1.00 0.00 C ATOM 76 CE LYS A 6 13.574 14.193 2.107 1.00 0.00 C ATOM 77 NZ LYS A 6 12.436 13.625 2.837 1.00 0.00 N ATOM 78 H LYS A 6 16.802 15.454 7.326 1.00 0.00 H ATOM 79 HA LYS A 6 14.678 16.189 5.653 1.00 0.00 H ATOM 80 HB2 LYS A 6 16.681 15.519 4.587 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.748 14.006 5.479 1.00 0.00 H ATOM 82 HG2 LYS A 6 16.139 13.571 3.195 1.00 0.00 H ATOM 83 HG3 LYS A 6 14.768 13.217 4.243 1.00 0.00 H ATOM 84 HD2 LYS A 6 13.948 15.567 3.696 1.00 0.00 H ATOM 85 HD3 LYS A 6 15.168 15.578 2.421 1.00 0.00 H ATOM 86 HE2 LYS A 6 13.202 14.871 1.354 1.00 0.00 H ATOM 87 HE3 LYS A 6 14.118 13.391 1.629 1.00 0.00 H ATOM 88 HZ1 LYS A 6 11.638 14.184 2.922 1.00 0.00 H ATOM 89 N ALA A 7 14.195 13.509 7.429 1.00 0.00 N ATOM 90 CA ALA A 7 13.204 12.501 7.802 1.00 0.00 C ATOM 91 C ALA A 7 11.883 13.131 8.207 1.00 0.00 C ATOM 92 O ALA A 7 10.818 12.670 7.794 1.00 0.00 O ATOM 93 CB ALA A 7 13.738 11.603 8.908 1.00 0.00 C ATOM 94 H ALA A 7 15.004 13.622 7.983 1.00 0.00 H ATOM 95 HA ALA A 7 13.025 11.899 6.934 1.00 0.00 H ATOM 96 HB1 ALA A 7 13.955 12.199 9.783 1.00 0.00 H ATOM 97 HB2 ALA A 7 14.641 11.115 8.572 1.00 0.00 H ATOM 98 HB3 ALA A 7 12.997 10.857 9.155 1.00 0.00 H ATOM 99 N ARG A 8 11.957 14.196 8.991 1.00 0.00 N ATOM 100 CA ARG A 8 10.767 14.911 9.427 1.00 0.00 C ATOM 101 C ARG A 8 10.037 15.469 8.224 1.00 0.00 C ATOM 102 O ARG A 8 8.812 15.582 8.209 1.00 0.00 O ATOM 103 CB ARG A 8 11.153 16.055 10.359 1.00 0.00 C ATOM 104 CG ARG A 8 11.556 15.619 11.764 1.00 0.00 C ATOM 105 CD ARG A 8 12.775 14.706 11.752 1.00 0.00 C ATOM 106 NE ARG A 8 13.224 14.359 13.101 1.00 0.00 N ATOM 107 CZ ARG A 8 13.784 15.223 13.955 1.00 0.00 C ATOM 108 NH1 ARG A 8 14.009 16.485 13.595 1.00 0.00 N ATOM 109 NH2 ARG A 8 14.131 14.818 15.172 1.00 0.00 N ATOM 110 H ARG A 8 12.839 14.524 9.268 1.00 0.00 H ATOM 111 HA ARG A 8 10.119 14.218 9.942 1.00 0.00 H ATOM 112 HB2 ARG A 8 11.988 16.582 9.915 1.00 0.00 H ATOM 113 HB3 ARG A 8 10.317 16.731 10.434 1.00 0.00 H ATOM 114 HG2 ARG A 8 11.785 16.497 12.348 1.00 0.00 H ATOM 115 HG3 ARG A 8 10.728 15.092 12.215 1.00 0.00 H ATOM 116 HD2 ARG A 8 12.522 13.797 11.227 1.00 0.00 H ATOM 117 HD3 ARG A 8 13.579 15.207 11.233 1.00 0.00 H ATOM 118 HE ARG A 8 13.090 13.433 13.394 1.00 0.00 H ATOM 119 HH11 ARG A 8 13.761 16.799 12.679 1.00 0.00 H ATOM 120 HH12 ARG A 8 14.428 17.122 14.243 1.00 0.00 H ATOM 121 HH21 ARG A 8 13.972 13.870 15.448 1.00 0.00 H ATOM 122 HH22 ARG A 8 14.551 15.461 15.813 1.00 0.00 H ATOM 123 N LYS A 9 10.816 15.810 7.215 1.00 0.00 N ATOM 124 CA LYS A 9 10.267 16.358 5.980 1.00 0.00 C ATOM 125 C LYS A 9 9.706 15.238 5.109 1.00 0.00 C ATOM 126 O LYS A 9 8.597 15.342 4.589 1.00 0.00 O ATOM 127 CB LYS A 9 11.331 17.150 5.214 1.00 0.00 C ATOM 128 CG LYS A 9 10.762 17.973 4.067 1.00 0.00 C ATOM 129 CD LYS A 9 11.831 18.826 3.398 1.00 0.00 C ATOM 130 CE LYS A 9 12.870 17.976 2.681 1.00 0.00 C ATOM 131 NZ LYS A 9 12.275 17.185 1.566 1.00 0.00 N ATOM 132 H LYS A 9 11.788 15.675 7.304 1.00 0.00 H ATOM 133 HA LYS A 9 9.460 17.023 6.248 1.00 0.00 H ATOM 134 HB2 LYS A 9 11.828 17.821 5.899 1.00 0.00 H ATOM 135 HB3 LYS A 9 12.056 16.460 4.809 1.00 0.00 H ATOM 136 HG2 LYS A 9 10.338 17.304 3.333 1.00 0.00 H ATOM 137 HG3 LYS A 9 9.988 18.621 4.453 1.00 0.00 H ATOM 138 HD2 LYS A 9 11.358 19.477 2.678 1.00 0.00 H ATOM 139 HD3 LYS A 9 12.325 19.421 4.152 1.00 0.00 H ATOM 140 HE2 LYS A 9 13.633 18.626 2.281 1.00 0.00 H ATOM 141 HE3 LYS A 9 13.315 17.298 3.395 1.00 0.00 H ATOM 142 HZ1 LYS A 9 11.776 16.354 1.943 1.00 0.00 H ATOM 143 HZ2 LYS A 9 13.022 16.863 0.919 1.00 0.00 H ATOM 144 HZ3 LYS A 9 11.599 17.770 1.033 1.00 0.00 H ATOM 145 N ASP A 10 10.477 14.159 4.969 1.00 0.00 N ATOM 146 CA ASP A 10 10.055 13.007 4.176 1.00 0.00 C ATOM 147 C ASP A 10 8.781 12.389 4.757 1.00 0.00 C ATOM 148 O ASP A 10 7.948 11.868 4.018 1.00 0.00 O ATOM 149 CB ASP A 10 11.167 11.948 4.113 1.00 0.00 C ATOM 150 CG ASP A 10 12.434 12.401 3.381 1.00 0.00 C ATOM 151 OD1 ASP A 10 13.403 11.644 3.306 1.00 0.00 O ATOM 152 H ASP A 10 11.347 14.133 5.420 1.00 0.00 H ATOM 153 HA ASP A 10 9.845 13.355 3.176 1.00 0.00 H ATOM 154 HB2 ASP A 10 11.445 11.675 5.120 1.00 0.00 H ATOM 155 HB3 ASP A 10 10.782 11.072 3.609 1.00 0.00 H ATOM 156 N LYS A 11 8.629 12.461 6.084 1.00 0.00 N ATOM 157 CA LYS A 11 7.452 11.917 6.754 1.00 0.00 C ATOM 158 C LYS A 11 6.319 12.935 6.754 1.00 0.00 C ATOM 159 O LYS A 11 5.186 12.613 6.391 1.00 0.00 O ATOM 160 CB LYS A 11 7.785 11.500 8.191 1.00 0.00 C ATOM 161 CG LYS A 11 6.564 11.079 8.994 1.00 0.00 C ATOM 162 CD LYS A 11 5.861 9.886 8.361 1.00 0.00 C ATOM 163 CE LYS A 11 4.397 9.822 8.764 1.00 0.00 C ATOM 164 NZ LYS A 11 3.628 10.937 8.207 1.00 0.00 N ATOM 165 H LYS A 11 9.318 12.904 6.623 1.00 0.00 H ATOM 166 HA LYS A 11 7.134 11.047 6.201 1.00 0.00 H ATOM 167 HB2 LYS A 11 8.476 10.669 8.163 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.254 12.330 8.697 1.00 0.00 H ATOM 169 HG2 LYS A 11 6.877 10.810 9.992 1.00 0.00 H ATOM 170 HG3 LYS A 11 5.874 11.908 9.043 1.00 0.00 H ATOM 171 HD2 LYS A 11 5.924 9.971 7.286 1.00 0.00 H ATOM 172 HD3 LYS A 11 6.354 8.980 8.682 1.00 0.00 H ATOM 173 HE2 LYS A 11 3.978 8.893 8.406 1.00 0.00 H ATOM 174 HE3 LYS A 11 4.331 9.854 9.841 1.00 0.00 H ATOM 175 HZ1 LYS A 11 3.971 11.843 8.358 1.00 0.00 H ATOM 176 N ARG A 12 6.638 14.166 7.155 1.00 0.00 N ATOM 177 CA ARG A 12 5.654 15.243 7.193 1.00 0.00 C ATOM 178 C ARG A 12 4.948 15.379 5.846 1.00 0.00 C ATOM 179 O ARG A 12 3.760 15.701 5.791 1.00 0.00 O ATOM 180 CB ARG A 12 6.328 16.569 7.572 1.00 0.00 C ATOM 181 CG ARG A 12 5.392 17.770 7.543 1.00 0.00 C ATOM 182 CD ARG A 12 4.215 17.593 8.492 1.00 0.00 C ATOM 183 NE ARG A 12 3.293 18.728 8.442 1.00 0.00 N ATOM 184 CZ ARG A 12 2.175 18.815 9.167 1.00 0.00 C ATOM 185 NH1 ARG A 12 1.831 17.836 10.000 1.00 0.00 N ATOM 186 NH2 ARG A 12 1.396 19.887 9.057 1.00 0.00 N ATOM 187 H ARG A 12 7.563 14.354 7.424 1.00 0.00 H ATOM 188 HA ARG A 12 4.921 14.994 7.946 1.00 0.00 H ATOM 189 HB2 ARG A 12 6.731 16.480 8.570 1.00 0.00 H ATOM 190 HB3 ARG A 12 7.138 16.756 6.883 1.00 0.00 H ATOM 191 HG2 ARG A 12 5.944 18.651 7.834 1.00 0.00 H ATOM 192 HG3 ARG A 12 5.016 17.896 6.538 1.00 0.00 H ATOM 193 HD2 ARG A 12 3.680 16.696 8.218 1.00 0.00 H ATOM 194 HD3 ARG A 12 4.593 17.493 9.498 1.00 0.00 H ATOM 195 HE ARG A 12 3.518 19.466 7.836 1.00 0.00 H ATOM 196 HH11 ARG A 12 2.409 17.025 10.088 1.00 0.00 H ATOM 197 HH12 ARG A 12 0.992 17.911 10.539 1.00 0.00 H ATOM 198 HH21 ARG A 12 1.648 20.627 8.432 1.00 0.00 H ATOM 199 HH22 ARG A 12 0.557 19.954 9.598 1.00 0.00 H ATOM 200 N LYS A 13 5.686 15.129 4.762 1.00 0.00 N ATOM 201 CA LYS A 13 5.116 15.225 3.416 1.00 0.00 C ATOM 202 C LYS A 13 4.381 13.952 3.014 1.00 0.00 C ATOM 203 O LYS A 13 3.265 14.020 2.494 1.00 0.00 O ATOM 204 CB LYS A 13 6.195 15.576 2.385 1.00 0.00 C ATOM 205 CG LYS A 13 6.476 17.069 2.273 1.00 0.00 C ATOM 206 CD LYS A 13 6.949 17.664 3.592 1.00 0.00 C ATOM 207 CE LYS A 13 7.154 19.169 3.487 1.00 0.00 C ATOM 208 NZ LYS A 13 5.888 19.887 3.166 1.00 0.00 N ATOM 209 H LYS A 13 6.633 14.869 4.872 1.00 0.00 H ATOM 210 HA LYS A 13 4.393 16.020 3.442 1.00 0.00 H ATOM 211 HB2 LYS A 13 7.114 15.079 2.658 1.00 0.00 H ATOM 212 HB3 LYS A 13 5.879 15.218 1.415 1.00 0.00 H ATOM 213 HG2 LYS A 13 7.240 17.226 1.527 1.00 0.00 H ATOM 214 HG3 LYS A 13 5.568 17.571 1.968 1.00 0.00 H ATOM 215 HD2 LYS A 13 6.210 17.465 4.353 1.00 0.00 H ATOM 216 HD3 LYS A 13 7.885 17.204 3.867 1.00 0.00 H ATOM 217 HE2 LYS A 13 7.534 19.533 4.430 1.00 0.00 H ATOM 218 HE3 LYS A 13 7.877 19.366 2.709 1.00 0.00 H ATOM 219 HZ1 LYS A 13 5.648 19.759 2.162 1.00 0.00 H ATOM 220 HZ2 LYS A 13 5.996 20.904 3.357 1.00 0.00 H ATOM 221 HZ3 LYS A 13 5.108 19.518 3.748 1.00 0.00 H ATOM 222 N LEU A 14 4.991 12.795 3.267 1.00 0.00 N ATOM 223 CA LEU A 14 4.361 11.516 2.939 1.00 0.00 C ATOM 224 C LEU A 14 3.009 11.369 3.642 1.00 0.00 C ATOM 225 O LEU A 14 2.142 10.627 3.177 1.00 0.00 O ATOM 226 CB LEU A 14 5.279 10.344 3.306 1.00 0.00 C ATOM 227 CG LEU A 14 6.163 9.819 2.167 1.00 0.00 C ATOM 228 CD1 LEU A 14 7.002 10.935 1.557 1.00 0.00 C ATOM 229 CD2 LEU A 14 7.058 8.695 2.670 1.00 0.00 C ATOM 230 H LEU A 14 5.873 12.800 3.695 1.00 0.00 H ATOM 231 HA LEU A 14 4.193 11.503 1.872 1.00 0.00 H ATOM 232 HB2 LEU A 14 5.920 10.657 4.116 1.00 0.00 H ATOM 233 HB3 LEU A 14 4.662 9.529 3.655 1.00 0.00 H ATOM 234 HG LEU A 14 5.531 9.417 1.388 1.00 0.00 H ATOM 235 HD11 LEU A 14 6.631 11.891 1.893 1.00 0.00 H ATOM 236 HD12 LEU A 14 6.939 10.884 0.480 1.00 0.00 H ATOM 237 HD13 LEU A 14 8.031 10.820 1.862 1.00 0.00 H ATOM 238 HD21 LEU A 14 6.446 7.902 3.075 1.00 0.00 H ATOM 239 HD22 LEU A 14 7.712 9.074 3.441 1.00 0.00 H ATOM 240 HD23 LEU A 14 7.649 8.312 1.851 1.00 0.00 H ATOM 241 N ASP A 15 2.829 12.086 4.758 1.00 0.00 N ATOM 242 CA ASP A 15 1.574 12.034 5.507 1.00 0.00 C ATOM 243 C ASP A 15 0.649 13.184 5.109 1.00 0.00 C ATOM 244 O ASP A 15 -0.502 12.964 4.732 1.00 0.00 O ATOM 245 CB ASP A 15 1.835 12.060 7.018 1.00 0.00 C ATOM 246 CG ASP A 15 2.498 10.786 7.516 1.00 0.00 C ATOM 247 OD1 ASP A 15 1.994 9.685 7.287 1.00 0.00 O ATOM 248 H ASP A 15 3.551 12.676 5.074 1.00 0.00 H ATOM 249 HA ASP A 15 1.086 11.103 5.257 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.481 12.894 7.250 1.00 0.00 H ATOM 251 HB3 ASP A 15 0.896 12.183 7.537 1.00 0.00 H HETATM 252 N NH2 A 16 1.152 14.413 5.189 1.00 0.00 N HETATM 253 HN1 NH2 A 16 2.077 14.518 5.497 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.577 15.164 4.936 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 13 ATOM 1 N PHE A 1 22.550 15.882 6.806 1.00 0.00 N ATOM 2 CA PHE A 1 23.306 14.633 6.814 1.00 0.00 C ATOM 3 C PHE A 1 22.612 13.593 7.689 1.00 0.00 C ATOM 4 O PHE A 1 22.403 12.456 7.262 1.00 0.00 O ATOM 5 CB PHE A 1 24.745 14.872 7.299 1.00 0.00 C ATOM 6 CG PHE A 1 25.542 15.798 6.412 1.00 0.00 C ATOM 7 CD1 PHE A 1 25.071 17.067 6.108 1.00 0.00 C ATOM 8 CD2 PHE A 1 26.763 15.400 5.884 1.00 0.00 C ATOM 9 CE1 PHE A 1 25.796 17.918 5.299 1.00 0.00 C ATOM 10 CE2 PHE A 1 27.493 16.250 5.073 1.00 0.00 C ATOM 11 CZ PHE A 1 27.008 17.510 4.780 1.00 0.00 C ATOM 12 H1 PHE A 1 21.571 15.849 6.760 1.00 0.00 H ATOM 13 HA PHE A 1 23.337 14.263 5.801 1.00 0.00 H ATOM 14 HB2 PHE A 1 24.717 15.305 8.287 1.00 0.00 H ATOM 15 HB3 PHE A 1 25.264 13.925 7.342 1.00 0.00 H ATOM 16 HD1 PHE A 1 24.123 17.391 6.513 1.00 0.00 H ATOM 17 HD2 PHE A 1 27.142 14.415 6.111 1.00 0.00 H ATOM 18 HE1 PHE A 1 25.415 18.902 5.071 1.00 0.00 H ATOM 19 HE2 PHE A 1 28.441 15.930 4.669 1.00 0.00 H ATOM 20 HZ PHE A 1 27.577 18.175 4.148 1.00 0.00 H ATOM 21 N GLY A 2 22.245 13.991 8.909 1.00 0.00 N ATOM 22 CA GLY A 2 21.566 13.081 9.815 1.00 0.00 C ATOM 23 C GLY A 2 20.189 12.680 9.305 1.00 0.00 C ATOM 24 O GLY A 2 19.366 13.541 8.986 1.00 0.00 O ATOM 25 H GLY A 2 22.431 14.911 9.193 1.00 0.00 H ATOM 26 HA2 GLY A 2 22.168 12.192 9.933 1.00 0.00 H ATOM 27 HA3 GLY A 2 21.459 13.561 10.776 1.00 0.00 H ATOM 28 N GLY A 3 19.943 11.370 9.221 1.00 0.00 N ATOM 29 CA GLY A 3 18.661 10.869 8.738 1.00 0.00 C ATOM 30 C GLY A 3 17.473 11.368 9.548 1.00 0.00 C ATOM 31 O GLY A 3 16.465 11.783 8.979 1.00 0.00 O ATOM 32 H GLY A 3 20.643 10.735 9.484 1.00 0.00 H ATOM 33 HA2 GLY A 3 18.534 11.184 7.712 1.00 0.00 H ATOM 34 HA3 GLY A 3 18.675 9.790 8.769 1.00 0.00 H ATOM 35 N PHE A 4 17.594 11.339 10.879 1.00 0.00 N ATOM 36 CA PHE A 4 16.522 11.807 11.761 1.00 0.00 C ATOM 37 C PHE A 4 16.300 13.319 11.590 1.00 0.00 C ATOM 38 O PHE A 4 15.242 13.844 11.939 1.00 0.00 O ATOM 39 CB PHE A 4 16.847 11.472 13.223 1.00 0.00 C ATOM 40 CG PHE A 4 15.686 11.653 14.166 1.00 0.00 C ATOM 41 CD1 PHE A 4 14.483 10.987 13.957 1.00 0.00 C ATOM 42 CD2 PHE A 4 15.800 12.487 15.265 1.00 0.00 C ATOM 43 CE1 PHE A 4 13.422 11.156 14.827 1.00 0.00 C ATOM 44 CE2 PHE A 4 14.742 12.658 16.137 1.00 0.00 C ATOM 45 CZ PHE A 4 13.552 11.992 15.919 1.00 0.00 C ATOM 46 H PHE A 4 18.426 11.007 11.276 1.00 0.00 H ATOM 47 HA PHE A 4 15.616 11.295 11.477 1.00 0.00 H ATOM 48 HB2 PHE A 4 17.165 10.441 13.287 1.00 0.00 H ATOM 49 HB3 PHE A 4 17.651 12.110 13.560 1.00 0.00 H ATOM 50 HD1 PHE A 4 14.381 10.332 13.104 1.00 0.00 H ATOM 51 HD2 PHE A 4 16.728 13.010 15.438 1.00 0.00 H ATOM 52 HE1 PHE A 4 12.492 10.633 14.656 1.00 0.00 H ATOM 53 HE2 PHE A 4 14.847 13.311 16.991 1.00 0.00 H ATOM 54 HZ PHE A 4 12.725 12.125 16.601 1.00 0.00 H ATOM 55 N THR A 5 17.310 14.004 11.037 1.00 0.00 N ATOM 56 CA THR A 5 17.249 15.439 10.797 1.00 0.00 C ATOM 57 C THR A 5 16.366 15.752 9.602 1.00 0.00 C ATOM 58 O THR A 5 15.530 16.657 9.642 1.00 0.00 O ATOM 59 CB THR A 5 18.660 16.028 10.580 1.00 0.00 C ATOM 60 OG1 THR A 5 19.460 15.816 11.750 1.00 0.00 O ATOM 61 CG2 THR A 5 18.599 17.516 10.275 1.00 0.00 C ATOM 62 H THR A 5 18.115 13.525 10.771 1.00 0.00 H ATOM 63 HA THR A 5 16.822 15.887 11.653 1.00 0.00 H ATOM 64 HB THR A 5 19.119 15.524 9.742 1.00 0.00 H ATOM 65 HG1 THR A 5 20.238 15.302 11.518 1.00 0.00 H ATOM 66 HG21 THR A 5 18.260 17.662 9.258 1.00 0.00 H ATOM 67 HG22 THR A 5 19.582 17.946 10.391 1.00 0.00 H ATOM 68 HG23 THR A 5 17.914 17.993 10.957 1.00 0.00 H ATOM 69 N LYS A 6 16.545 14.974 8.553 1.00 0.00 N ATOM 70 CA LYS A 6 15.747 15.134 7.337 1.00 0.00 C ATOM 71 C LYS A 6 14.357 14.508 7.501 1.00 0.00 C ATOM 72 O LYS A 6 13.576 14.479 6.552 1.00 0.00 O ATOM 73 CB LYS A 6 16.463 14.563 6.091 1.00 0.00 C ATOM 74 CG LYS A 6 16.781 13.064 6.125 1.00 0.00 C ATOM 75 CD LYS A 6 15.531 12.189 6.130 1.00 0.00 C ATOM 76 CE LYS A 6 14.733 12.293 4.831 1.00 0.00 C ATOM 77 NZ LYS A 6 13.291 12.084 5.044 1.00 0.00 N ATOM 78 H LYS A 6 17.210 14.268 8.615 1.00 0.00 H ATOM 79 HA LYS A 6 15.612 16.195 7.192 1.00 0.00 H ATOM 80 HB2 LYS A 6 15.842 14.747 5.228 1.00 0.00 H ATOM 81 HB3 LYS A 6 17.394 15.097 5.961 1.00 0.00 H ATOM 82 HG2 LYS A 6 17.366 12.819 5.251 1.00 0.00 H ATOM 83 HG3 LYS A 6 17.362 12.852 7.011 1.00 0.00 H ATOM 84 HD2 LYS A 6 15.832 11.160 6.261 1.00 0.00 H ATOM 85 HD3 LYS A 6 14.901 12.482 6.953 1.00 0.00 H ATOM 86 HE2 LYS A 6 14.886 13.274 4.405 1.00 0.00 H ATOM 87 HE3 LYS A 6 15.097 11.543 4.142 1.00 0.00 H ATOM 88 HZ1 LYS A 6 12.681 12.555 4.444 1.00 0.00 H ATOM 89 N ALA A 7 14.047 14.014 8.709 1.00 0.00 N ATOM 90 CA ALA A 7 12.747 13.398 8.977 1.00 0.00 C ATOM 91 C ALA A 7 11.603 14.338 8.648 1.00 0.00 C ATOM 92 O ALA A 7 10.568 13.903 8.153 1.00 0.00 O ATOM 93 CB ALA A 7 12.651 12.934 10.420 1.00 0.00 C ATOM 94 H ALA A 7 14.707 14.065 9.435 1.00 0.00 H ATOM 95 HA ALA A 7 12.662 12.540 8.336 1.00 0.00 H ATOM 96 HB1 ALA A 7 11.636 12.629 10.634 1.00 0.00 H ATOM 97 HB2 ALA A 7 12.928 13.745 11.076 1.00 0.00 H ATOM 98 HB3 ALA A 7 13.319 12.100 10.578 1.00 0.00 H ATOM 99 N ARG A 8 11.797 15.627 8.901 1.00 0.00 N ATOM 100 CA ARG A 8 10.773 16.620 8.590 1.00 0.00 C ATOM 101 C ARG A 8 10.330 16.443 7.143 1.00 0.00 C ATOM 102 O ARG A 8 9.152 16.566 6.816 1.00 0.00 O ATOM 103 CB ARG A 8 11.331 18.030 8.778 1.00 0.00 C ATOM 104 CG ARG A 8 10.574 18.890 9.781 1.00 0.00 C ATOM 105 CD ARG A 8 9.093 18.986 9.444 1.00 0.00 C ATOM 106 NE ARG A 8 8.483 20.196 9.997 1.00 0.00 N ATOM 107 CZ ARG A 8 8.734 21.432 9.551 1.00 0.00 C ATOM 108 NH1 ARG A 8 9.559 21.625 8.522 1.00 0.00 N ATOM 109 NH2 ARG A 8 8.153 22.478 10.130 1.00 0.00 N ATOM 110 H ARG A 8 12.653 15.920 9.280 1.00 0.00 H ATOM 111 HA ARG A 8 9.929 16.461 9.244 1.00 0.00 H ATOM 112 HB2 ARG A 8 12.356 17.951 9.108 1.00 0.00 H ATOM 113 HB3 ARG A 8 11.314 18.531 7.822 1.00 0.00 H ATOM 114 HG2 ARG A 8 10.681 18.460 10.765 1.00 0.00 H ATOM 115 HG3 ARG A 8 10.998 19.883 9.775 1.00 0.00 H ATOM 116 HD2 ARG A 8 8.978 18.994 8.370 1.00 0.00 H ATOM 117 HD3 ARG A 8 8.588 18.122 9.852 1.00 0.00 H ATOM 118 HE ARG A 8 7.863 20.085 10.746 1.00 0.00 H ATOM 119 HH11 ARG A 8 9.994 20.846 8.074 1.00 0.00 H ATOM 120 HH12 ARG A 8 9.742 22.553 8.197 1.00 0.00 H ATOM 121 HH21 ARG A 8 7.527 22.342 10.898 1.00 0.00 H ATOM 122 HH22 ARG A 8 8.340 23.402 9.796 1.00 0.00 H ATOM 123 N LYS A 9 11.304 16.127 6.293 1.00 0.00 N ATOM 124 CA LYS A 9 11.065 15.898 4.873 1.00 0.00 C ATOM 125 C LYS A 9 10.407 14.535 4.659 1.00 0.00 C ATOM 126 O LYS A 9 9.457 14.402 3.882 1.00 0.00 O ATOM 127 CB LYS A 9 12.394 15.964 4.105 1.00 0.00 C ATOM 128 CG LYS A 9 12.249 15.840 2.597 1.00 0.00 C ATOM 129 CD LYS A 9 11.513 17.033 2.009 1.00 0.00 C ATOM 130 CE LYS A 9 11.508 17.000 0.487 1.00 0.00 C ATOM 131 NZ LYS A 9 10.705 15.867 -0.056 1.00 0.00 N ATOM 132 H LYS A 9 12.218 16.024 6.643 1.00 0.00 H ATOM 133 HA LYS A 9 10.406 16.673 4.512 1.00 0.00 H ATOM 134 HB2 LYS A 9 12.875 16.906 4.320 1.00 0.00 H ATOM 135 HB3 LYS A 9 13.031 15.161 4.448 1.00 0.00 H ATOM 136 HG2 LYS A 9 13.232 15.782 2.154 1.00 0.00 H ATOM 137 HG3 LYS A 9 11.696 14.940 2.371 1.00 0.00 H ATOM 138 HD2 LYS A 9 10.493 17.022 2.362 1.00 0.00 H ATOM 139 HD3 LYS A 9 12.001 17.939 2.340 1.00 0.00 H ATOM 140 HE2 LYS A 9 11.092 17.927 0.124 1.00 0.00 H ATOM 141 HE3 LYS A 9 12.528 16.905 0.140 1.00 0.00 H ATOM 142 HZ1 LYS A 9 11.144 15.504 -0.928 1.00 0.00 H ATOM 143 HZ2 LYS A 9 9.742 16.187 -0.277 1.00 0.00 H ATOM 144 HZ3 LYS A 9 10.651 15.096 0.641 1.00 0.00 H ATOM 145 N ASP A 10 10.931 13.525 5.360 1.00 0.00 N ATOM 146 CA ASP A 10 10.422 12.157 5.259 1.00 0.00 C ATOM 147 C ASP A 10 8.963 12.064 5.728 1.00 0.00 C ATOM 148 O ASP A 10 8.157 11.342 5.133 1.00 0.00 O ATOM 149 CB ASP A 10 11.254 11.177 6.117 1.00 0.00 C ATOM 150 CG ASP A 10 12.778 11.294 6.002 1.00 0.00 C ATOM 151 OD1 ASP A 10 13.488 10.659 6.787 1.00 0.00 O ATOM 152 H ASP A 10 11.684 13.707 5.958 1.00 0.00 H ATOM 153 HA ASP A 10 10.479 11.855 4.226 1.00 0.00 H ATOM 154 HB2 ASP A 10 10.997 11.328 7.153 1.00 0.00 H ATOM 155 HB3 ASP A 10 10.977 10.168 5.841 1.00 0.00 H ATOM 156 N LYS A 11 8.640 12.770 6.820 1.00 0.00 N ATOM 157 CA LYS A 11 7.298 12.728 7.399 1.00 0.00 C ATOM 158 C LYS A 11 6.335 13.694 6.726 1.00 0.00 C ATOM 159 O LYS A 11 5.243 13.293 6.320 1.00 0.00 O ATOM 160 CB LYS A 11 7.359 13.001 8.911 1.00 0.00 C ATOM 161 CG LYS A 11 5.989 13.051 9.578 1.00 0.00 C ATOM 162 CD LYS A 11 5.348 14.429 9.466 1.00 0.00 C ATOM 163 CE LYS A 11 3.828 14.341 9.482 1.00 0.00 C ATOM 164 NZ LYS A 11 3.245 14.548 8.150 1.00 0.00 N ATOM 165 H LYS A 11 9.325 13.319 7.258 1.00 0.00 H ATOM 166 HA LYS A 11 6.924 11.729 7.252 1.00 0.00 H ATOM 167 HB2 LYS A 11 7.934 12.217 9.383 1.00 0.00 H ATOM 168 HB3 LYS A 11 7.855 13.947 9.077 1.00 0.00 H ATOM 169 HG2 LYS A 11 5.344 12.327 9.105 1.00 0.00 H ATOM 170 HG3 LYS A 11 6.103 12.802 10.625 1.00 0.00 H ATOM 171 HD2 LYS A 11 5.670 15.035 10.301 1.00 0.00 H ATOM 172 HD3 LYS A 11 5.663 14.892 8.545 1.00 0.00 H ATOM 173 HE2 LYS A 11 3.541 13.364 9.838 1.00 0.00 H ATOM 174 HE3 LYS A 11 3.443 15.094 10.154 1.00 0.00 H ATOM 175 HZ1 LYS A 11 3.584 15.300 7.621 1.00 0.00 H ATOM 176 N ARG A 12 6.729 14.961 6.622 1.00 0.00 N ATOM 177 CA ARG A 12 5.879 15.977 6.006 1.00 0.00 C ATOM 178 C ARG A 12 5.392 15.494 4.644 1.00 0.00 C ATOM 179 O ARG A 12 4.262 15.784 4.235 1.00 0.00 O ATOM 180 CB ARG A 12 6.634 17.307 5.871 1.00 0.00 C ATOM 181 CG ARG A 12 5.746 18.503 5.552 1.00 0.00 C ATOM 182 CD ARG A 12 4.750 18.778 6.671 1.00 0.00 C ATOM 183 NE ARG A 12 4.020 20.031 6.465 1.00 0.00 N ATOM 184 CZ ARG A 12 3.137 20.241 5.482 1.00 0.00 C ATOM 185 NH1 ARG A 12 2.830 19.272 4.622 1.00 0.00 N ATOM 186 NH2 ARG A 12 2.556 21.431 5.364 1.00 0.00 N ATOM 187 H ARG A 12 7.605 15.217 6.971 1.00 0.00 H ATOM 188 HA ARG A 12 5.024 16.120 6.648 1.00 0.00 H ATOM 189 HB2 ARG A 12 7.143 17.509 6.802 1.00 0.00 H ATOM 190 HB3 ARG A 12 7.370 17.213 5.085 1.00 0.00 H ATOM 191 HG2 ARG A 12 6.368 19.376 5.420 1.00 0.00 H ATOM 192 HG3 ARG A 12 5.205 18.305 4.639 1.00 0.00 H ATOM 193 HD2 ARG A 12 4.044 17.963 6.714 1.00 0.00 H ATOM 194 HD3 ARG A 12 5.288 18.836 7.606 1.00 0.00 H ATOM 195 HE ARG A 12 4.204 20.763 7.089 1.00 0.00 H ATOM 196 HH11 ARG A 12 3.255 18.372 4.706 1.00 0.00 H ATOM 197 HH12 ARG A 12 2.171 19.445 3.890 1.00 0.00 H ATOM 198 HH21 ARG A 12 2.778 22.162 6.009 1.00 0.00 H ATOM 199 HH22 ARG A 12 1.895 21.594 4.631 1.00 0.00 H ATOM 200 N LYS A 13 6.246 14.737 3.953 1.00 0.00 N ATOM 201 CA LYS A 13 5.889 14.201 2.642 1.00 0.00 C ATOM 202 C LYS A 13 5.006 12.972 2.764 1.00 0.00 C ATOM 203 O LYS A 13 4.004 12.854 2.055 1.00 0.00 O ATOM 204 CB LYS A 13 7.139 13.895 1.821 1.00 0.00 C ATOM 205 CG LYS A 13 7.844 15.145 1.324 1.00 0.00 C ATOM 206 CD LYS A 13 7.009 15.889 0.289 1.00 0.00 C ATOM 207 CE LYS A 13 6.839 15.065 -0.979 1.00 0.00 C ATOM 208 NZ LYS A 13 6.094 15.803 -2.037 1.00 0.00 N ATOM 209 H LYS A 13 7.132 14.522 4.344 1.00 0.00 H ATOM 210 HA LYS A 13 5.321 14.961 2.139 1.00 0.00 H ATOM 211 HB2 LYS A 13 7.831 13.332 2.430 1.00 0.00 H ATOM 212 HB3 LYS A 13 6.858 13.299 0.964 1.00 0.00 H ATOM 213 HG2 LYS A 13 8.025 15.801 2.161 1.00 0.00 H ATOM 214 HG3 LYS A 13 8.783 14.861 0.877 1.00 0.00 H ATOM 215 HD2 LYS A 13 6.034 16.095 0.705 1.00 0.00 H ATOM 216 HD3 LYS A 13 7.501 16.818 0.041 1.00 0.00 H ATOM 217 HE2 LYS A 13 7.817 14.806 -1.356 1.00 0.00 H ATOM 218 HE3 LYS A 13 6.299 14.162 -0.735 1.00 0.00 H ATOM 219 HZ1 LYS A 13 6.606 16.672 -2.295 1.00 0.00 H ATOM 220 HZ2 LYS A 13 5.147 16.060 -1.696 1.00 0.00 H ATOM 221 HZ3 LYS A 13 5.995 15.207 -2.884 1.00 0.00 H ATOM 222 N LEU A 14 5.357 12.071 3.680 1.00 0.00 N ATOM 223 CA LEU A 14 4.559 10.873 3.900 1.00 0.00 C ATOM 224 C LEU A 14 3.133 11.275 4.308 1.00 0.00 C ATOM 225 O LEU A 14 2.182 10.529 4.074 1.00 0.00 O ATOM 226 CB LEU A 14 5.206 9.979 4.967 1.00 0.00 C ATOM 227 CG LEU A 14 4.914 8.474 4.844 1.00 0.00 C ATOM 228 CD1 LEU A 14 3.427 8.189 4.981 1.00 0.00 C ATOM 229 CD2 LEU A 14 5.442 7.927 3.523 1.00 0.00 C ATOM 230 H LEU A 14 6.154 12.226 4.229 1.00 0.00 H ATOM 231 HA LEU A 14 4.510 10.333 2.964 1.00 0.00 H ATOM 232 HB2 LEU A 14 6.277 10.117 4.921 1.00 0.00 H ATOM 233 HB3 LEU A 14 4.863 10.309 5.937 1.00 0.00 H ATOM 234 HG LEU A 14 5.423 7.954 5.642 1.00 0.00 H ATOM 235 HD11 LEU A 14 2.934 8.390 4.042 1.00 0.00 H ATOM 236 HD12 LEU A 14 3.009 8.820 5.751 1.00 0.00 H ATOM 237 HD13 LEU A 14 3.283 7.152 5.248 1.00 0.00 H ATOM 238 HD21 LEU A 14 4.733 8.137 2.736 1.00 0.00 H ATOM 239 HD22 LEU A 14 5.581 6.858 3.606 1.00 0.00 H ATOM 240 HD23 LEU A 14 6.387 8.395 3.289 1.00 0.00 H ATOM 241 N ASP A 15 2.986 12.479 4.891 1.00 0.00 N ATOM 242 CA ASP A 15 1.668 12.975 5.290 1.00 0.00 C ATOM 243 C ASP A 15 0.865 13.381 4.058 1.00 0.00 C ATOM 244 O ASP A 15 -0.210 12.843 3.802 1.00 0.00 O ATOM 245 CB ASP A 15 1.774 14.170 6.250 1.00 0.00 C ATOM 246 CG ASP A 15 2.273 13.788 7.636 1.00 0.00 C ATOM 247 OD1 ASP A 15 1.768 12.845 8.247 1.00 0.00 O ATOM 248 H ASP A 15 3.775 13.054 5.025 1.00 0.00 H ATOM 249 HA ASP A 15 1.150 12.168 5.790 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.452 14.899 5.833 1.00 0.00 H ATOM 251 HB3 ASP A 15 0.797 14.621 6.353 1.00 0.00 H HETATM 252 N NH2 A 16 1.396 14.329 3.286 1.00 0.00 N HETATM 253 HN1 NH2 A 16 2.257 14.715 3.551 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.904 14.601 2.484 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 14 ATOM 1 N PHE A 1 26.516 12.650 12.632 1.00 0.00 N ATOM 2 CA PHE A 1 25.992 12.899 11.293 1.00 0.00 C ATOM 3 C PHE A 1 24.477 13.088 11.325 1.00 0.00 C ATOM 4 O PHE A 1 23.760 12.319 11.969 1.00 0.00 O ATOM 5 CB PHE A 1 26.349 11.746 10.348 1.00 0.00 C ATOM 6 CG PHE A 1 27.815 11.648 10.019 1.00 0.00 C ATOM 7 CD1 PHE A 1 28.765 11.522 11.022 1.00 0.00 C ATOM 8 CD2 PHE A 1 28.242 11.684 8.701 1.00 0.00 C ATOM 9 CE1 PHE A 1 30.110 11.433 10.715 1.00 0.00 C ATOM 10 CE2 PHE A 1 29.585 11.596 8.389 1.00 0.00 C ATOM 11 CZ PHE A 1 30.520 11.471 9.397 1.00 0.00 C ATOM 12 H1 PHE A 1 27.167 13.274 13.015 1.00 0.00 H ATOM 13 HA PHE A 1 26.447 13.806 10.926 1.00 0.00 H ATOM 14 HB2 PHE A 1 26.052 10.814 10.803 1.00 0.00 H ATOM 15 HB3 PHE A 1 25.809 11.873 9.421 1.00 0.00 H ATOM 16 HD1 PHE A 1 28.447 11.491 12.053 1.00 0.00 H ATOM 17 HD2 PHE A 1 27.513 11.783 7.910 1.00 0.00 H ATOM 18 HE1 PHE A 1 30.839 11.336 11.506 1.00 0.00 H ATOM 19 HE2 PHE A 1 29.904 11.626 7.357 1.00 0.00 H ATOM 20 HZ PHE A 1 31.570 11.402 9.156 1.00 0.00 H ATOM 21 N GLY A 2 23.998 14.113 10.617 1.00 0.00 N ATOM 22 CA GLY A 2 22.571 14.392 10.561 1.00 0.00 C ATOM 23 C GLY A 2 21.844 13.524 9.548 1.00 0.00 C ATOM 24 O GLY A 2 21.189 14.041 8.641 1.00 0.00 O ATOM 25 H GLY A 2 24.622 14.684 10.121 1.00 0.00 H ATOM 26 HA2 GLY A 2 22.144 14.220 11.538 1.00 0.00 H ATOM 27 HA3 GLY A 2 22.429 15.429 10.297 1.00 0.00 H ATOM 28 N GLY A 3 21.959 12.202 9.702 1.00 0.00 N ATOM 29 CA GLY A 3 21.307 11.276 8.789 1.00 0.00 C ATOM 30 C GLY A 3 19.864 10.983 9.166 1.00 0.00 C ATOM 31 O GLY A 3 19.423 9.834 9.093 1.00 0.00 O ATOM 32 H GLY A 3 22.490 11.852 10.443 1.00 0.00 H ATOM 33 HA2 GLY A 3 21.325 11.697 7.795 1.00 0.00 H ATOM 34 HA3 GLY A 3 21.860 10.348 8.783 1.00 0.00 H ATOM 35 N PHE A 4 19.127 12.020 9.563 1.00 0.00 N ATOM 36 CA PHE A 4 17.724 11.870 9.945 1.00 0.00 C ATOM 37 C PHE A 4 17.010 13.230 9.952 1.00 0.00 C ATOM 38 O PHE A 4 16.052 13.437 10.700 1.00 0.00 O ATOM 39 CB PHE A 4 17.630 11.207 11.327 1.00 0.00 C ATOM 40 CG PHE A 4 16.234 10.805 11.723 1.00 0.00 C ATOM 41 CD1 PHE A 4 15.472 9.991 10.900 1.00 0.00 C ATOM 42 CD2 PHE A 4 15.689 11.238 12.921 1.00 0.00 C ATOM 43 CE1 PHE A 4 14.192 9.619 11.263 1.00 0.00 C ATOM 44 CE2 PHE A 4 14.409 10.869 13.290 1.00 0.00 C ATOM 45 CZ PHE A 4 13.660 10.058 12.460 1.00 0.00 C ATOM 46 H PHE A 4 19.535 12.908 9.597 1.00 0.00 H ATOM 47 HA PHE A 4 17.249 11.231 9.215 1.00 0.00 H ATOM 48 HB2 PHE A 4 18.242 10.318 11.333 1.00 0.00 H ATOM 49 HB3 PHE A 4 18.002 11.895 12.072 1.00 0.00 H ATOM 50 HD1 PHE A 4 15.887 9.647 9.964 1.00 0.00 H ATOM 51 HD2 PHE A 4 16.273 11.873 13.570 1.00 0.00 H ATOM 52 HE1 PHE A 4 13.608 8.985 10.612 1.00 0.00 H ATOM 53 HE2 PHE A 4 13.996 11.213 14.226 1.00 0.00 H ATOM 54 HZ PHE A 4 12.660 9.768 12.746 1.00 0.00 H ATOM 55 N THR A 5 17.477 14.152 9.103 1.00 0.00 N ATOM 56 CA THR A 5 16.878 15.482 9.006 1.00 0.00 C ATOM 57 C THR A 5 15.837 15.535 7.907 1.00 0.00 C ATOM 58 O THR A 5 14.756 16.105 8.072 1.00 0.00 O ATOM 59 CB THR A 5 17.939 16.579 8.773 1.00 0.00 C ATOM 60 OG1 THR A 5 18.689 16.299 7.583 1.00 0.00 O ATOM 61 CG2 THR A 5 18.886 16.679 9.962 1.00 0.00 C ATOM 62 H THR A 5 18.237 13.929 8.524 1.00 0.00 H ATOM 63 HA THR A 5 16.386 15.674 9.922 1.00 0.00 H ATOM 64 HB THR A 5 17.434 17.528 8.655 1.00 0.00 H ATOM 65 HG1 THR A 5 18.323 16.796 6.848 1.00 0.00 H ATOM 66 HG21 THR A 5 19.566 17.504 9.812 1.00 0.00 H ATOM 67 HG22 THR A 5 19.448 15.761 10.052 1.00 0.00 H ATOM 68 HG23 THR A 5 18.315 16.842 10.864 1.00 0.00 H ATOM 69 N LYS A 6 16.175 14.908 6.804 1.00 0.00 N ATOM 70 CA LYS A 6 15.291 14.823 5.647 1.00 0.00 C ATOM 71 C LYS A 6 14.042 13.995 5.968 1.00 0.00 C ATOM 72 O LYS A 6 13.044 14.067 5.249 1.00 0.00 O ATOM 73 CB LYS A 6 16.045 14.236 4.443 1.00 0.00 C ATOM 74 CG LYS A 6 15.142 13.710 3.335 1.00 0.00 C ATOM 75 CD LYS A 6 14.858 12.224 3.513 1.00 0.00 C ATOM 76 CE LYS A 6 13.668 11.766 2.683 1.00 0.00 C ATOM 77 NZ LYS A 6 12.454 11.639 3.490 1.00 0.00 N ATOM 78 H LYS A 6 17.042 14.468 6.781 1.00 0.00 H ATOM 79 HA LYS A 6 14.980 15.828 5.403 1.00 0.00 H ATOM 80 HB2 LYS A 6 16.679 15.003 4.025 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.666 13.421 4.788 1.00 0.00 H ATOM 82 HG2 LYS A 6 14.209 14.252 3.353 1.00 0.00 H ATOM 83 HG3 LYS A 6 15.631 13.862 2.384 1.00 0.00 H ATOM 84 HD2 LYS A 6 15.729 11.665 3.209 1.00 0.00 H ATOM 85 HD3 LYS A 6 14.652 12.031 4.556 1.00 0.00 H ATOM 86 HE2 LYS A 6 13.493 12.487 1.898 1.00 0.00 H ATOM 87 HE3 LYS A 6 13.899 10.806 2.245 1.00 0.00 H ATOM 88 HZ1 LYS A 6 12.565 11.506 4.455 1.00 0.00 H ATOM 89 N ALA A 7 14.095 13.209 7.050 1.00 0.00 N ATOM 90 CA ALA A 7 12.956 12.380 7.441 1.00 0.00 C ATOM 91 C ALA A 7 11.739 13.230 7.768 1.00 0.00 C ATOM 92 O ALA A 7 10.623 12.898 7.371 1.00 0.00 O ATOM 93 CB ALA A 7 13.317 11.474 8.609 1.00 0.00 C ATOM 94 H ALA A 7 14.913 13.190 7.597 1.00 0.00 H ATOM 95 HA ALA A 7 12.708 11.765 6.596 1.00 0.00 H ATOM 96 HB1 ALA A 7 14.167 10.863 8.342 1.00 0.00 H ATOM 97 HB2 ALA A 7 12.477 10.837 8.844 1.00 0.00 H ATOM 98 HB3 ALA A 7 13.563 12.077 9.470 1.00 0.00 H ATOM 99 N ARG A 8 11.965 14.339 8.464 1.00 0.00 N ATOM 100 CA ARG A 8 10.889 15.261 8.811 1.00 0.00 C ATOM 101 C ARG A 8 10.152 15.692 7.552 1.00 0.00 C ATOM 102 O ARG A 8 8.940 15.900 7.564 1.00 0.00 O ATOM 103 CB ARG A 8 11.466 16.497 9.487 1.00 0.00 C ATOM 104 CG ARG A 8 10.420 17.377 10.156 1.00 0.00 C ATOM 105 CD ARG A 8 11.029 18.666 10.692 1.00 0.00 C ATOM 106 NE ARG A 8 11.630 19.478 9.631 1.00 0.00 N ATOM 107 CZ ARG A 8 10.940 20.074 8.651 1.00 0.00 C ATOM 108 NH1 ARG A 8 9.612 19.996 8.609 1.00 0.00 N ATOM 109 NH2 ARG A 8 11.584 20.764 7.715 1.00 0.00 N ATOM 110 H ARG A 8 12.883 14.557 8.731 1.00 0.00 H ATOM 111 HA ARG A 8 10.202 14.763 9.478 1.00 0.00 H ATOM 112 HB2 ARG A 8 12.182 16.184 10.227 1.00 0.00 H ATOM 113 HB3 ARG A 8 11.974 17.087 8.734 1.00 0.00 H ATOM 114 HG2 ARG A 8 9.657 17.623 9.435 1.00 0.00 H ATOM 115 HG3 ARG A 8 9.978 16.831 10.977 1.00 0.00 H ATOM 116 HD2 ARG A 8 10.253 19.241 11.174 1.00 0.00 H ATOM 117 HD3 ARG A 8 11.791 18.415 11.415 1.00 0.00 H ATOM 118 HE ARG A 8 12.605 19.575 9.640 1.00 0.00 H ATOM 119 HH11 ARG A 8 9.115 19.490 9.313 1.00 0.00 H ATOM 120 HH12 ARG A 8 9.108 20.446 7.871 1.00 0.00 H ATOM 121 HH21 ARG A 8 12.581 20.836 7.744 1.00 0.00 H ATOM 122 HH22 ARG A 8 11.072 21.211 6.982 1.00 0.00 H ATOM 123 N LYS A 9 10.913 15.822 6.469 1.00 0.00 N ATOM 124 CA LYS A 9 10.360 16.229 5.177 1.00 0.00 C ATOM 125 C LYS A 9 9.448 15.142 4.614 1.00 0.00 C ATOM 126 O LYS A 9 8.312 15.413 4.225 1.00 0.00 O ATOM 127 CB LYS A 9 11.486 16.538 4.182 1.00 0.00 C ATOM 128 CG LYS A 9 12.435 17.637 4.644 1.00 0.00 C ATOM 129 CD LYS A 9 11.724 18.974 4.833 1.00 0.00 C ATOM 130 CE LYS A 9 11.454 19.677 3.507 1.00 0.00 C ATOM 131 NZ LYS A 9 10.474 18.944 2.656 1.00 0.00 N ATOM 132 H LYS A 9 11.877 15.630 6.546 1.00 0.00 H ATOM 133 HA LYS A 9 9.776 17.124 5.335 1.00 0.00 H ATOM 134 HB2 LYS A 9 12.064 15.641 4.022 1.00 0.00 H ATOM 135 HB3 LYS A 9 11.048 16.840 3.244 1.00 0.00 H ATOM 136 HG2 LYS A 9 12.876 17.344 5.585 1.00 0.00 H ATOM 137 HG3 LYS A 9 13.213 17.758 3.905 1.00 0.00 H ATOM 138 HD2 LYS A 9 10.782 18.800 5.331 1.00 0.00 H ATOM 139 HD3 LYS A 9 12.342 19.612 5.448 1.00 0.00 H ATOM 140 HE2 LYS A 9 11.066 20.663 3.713 1.00 0.00 H ATOM 141 HE3 LYS A 9 12.387 19.766 2.969 1.00 0.00 H ATOM 142 HZ1 LYS A 9 9.804 18.415 3.251 1.00 0.00 H ATOM 143 HZ2 LYS A 9 10.971 18.276 2.032 1.00 0.00 H ATOM 144 HZ3 LYS A 9 9.942 19.616 2.068 1.00 0.00 H ATOM 145 N ASP A 10 9.955 13.909 4.583 1.00 0.00 N ATOM 146 CA ASP A 10 9.194 12.767 4.078 1.00 0.00 C ATOM 147 C ASP A 10 7.977 12.471 4.959 1.00 0.00 C ATOM 148 O ASP A 10 6.934 12.049 4.458 1.00 0.00 O ATOM 149 CB ASP A 10 10.087 11.527 3.991 1.00 0.00 C ATOM 150 CG ASP A 10 11.219 11.687 2.991 1.00 0.00 C ATOM 151 OD1 ASP A 10 10.984 11.847 1.792 1.00 0.00 O ATOM 152 H ASP A 10 10.866 13.762 4.915 1.00 0.00 H ATOM 153 HA ASP A 10 8.848 13.017 3.086 1.00 0.00 H ATOM 154 HB2 ASP A 10 10.515 11.332 4.963 1.00 0.00 H ATOM 155 HB3 ASP A 10 9.485 10.681 3.693 1.00 0.00 H ATOM 156 N LYS A 11 8.114 12.700 6.269 1.00 0.00 N ATOM 157 CA LYS A 11 7.022 12.463 7.211 1.00 0.00 C ATOM 158 C LYS A 11 5.981 13.565 7.103 1.00 0.00 C ATOM 159 O LYS A 11 4.788 13.291 6.967 1.00 0.00 O ATOM 160 CB LYS A 11 7.545 12.375 8.650 1.00 0.00 C ATOM 161 CG LYS A 11 6.435 12.358 9.692 1.00 0.00 C ATOM 162 CD LYS A 11 5.514 11.160 9.511 1.00 0.00 C ATOM 163 CE LYS A 11 4.152 11.400 10.146 1.00 0.00 C ATOM 164 NZ LYS A 11 3.381 12.413 9.420 1.00 0.00 N ATOM 165 H LYS A 11 8.962 13.048 6.605 1.00 0.00 H ATOM 166 HA LYS A 11 6.560 11.524 6.948 1.00 0.00 H ATOM 167 HB2 LYS A 11 8.125 11.471 8.756 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.180 13.227 8.844 1.00 0.00 H ATOM 169 HG2 LYS A 11 6.879 12.311 10.675 1.00 0.00 H ATOM 170 HG3 LYS A 11 5.854 13.265 9.601 1.00 0.00 H ATOM 171 HD2 LYS A 11 5.380 10.976 8.456 1.00 0.00 H ATOM 172 HD3 LYS A 11 5.969 10.296 9.974 1.00 0.00 H ATOM 173 HE2 LYS A 11 3.600 10.471 10.146 1.00 0.00 H ATOM 174 HE3 LYS A 11 4.296 11.732 11.163 1.00 0.00 H ATOM 175 HZ1 LYS A 11 3.816 13.274 9.246 1.00 0.00 H ATOM 176 N ARG A 12 6.447 14.813 7.150 1.00 0.00 N ATOM 177 CA ARG A 12 5.562 15.967 7.038 1.00 0.00 C ATOM 178 C ARG A 12 4.686 15.831 5.796 1.00 0.00 C ATOM 179 O ARG A 12 3.541 16.283 5.782 1.00 0.00 O ATOM 180 CB ARG A 12 6.376 17.264 6.969 1.00 0.00 C ATOM 181 CG ARG A 12 5.524 18.524 6.961 1.00 0.00 C ATOM 182 CD ARG A 12 6.379 19.774 6.822 1.00 0.00 C ATOM 183 NE ARG A 12 7.052 19.844 5.523 1.00 0.00 N ATOM 184 CZ ARG A 12 6.422 20.044 4.359 1.00 0.00 C ATOM 185 NH1 ARG A 12 5.107 20.248 4.325 1.00 0.00 N ATOM 186 NH2 ARG A 12 7.116 20.055 3.226 1.00 0.00 N ATOM 187 H ARG A 12 7.412 14.958 7.250 1.00 0.00 H ATOM 188 HA ARG A 12 4.930 15.990 7.914 1.00 0.00 H ATOM 189 HB2 ARG A 12 7.034 17.307 7.824 1.00 0.00 H ATOM 190 HB3 ARG A 12 6.972 17.253 6.068 1.00 0.00 H ATOM 191 HG2 ARG A 12 4.835 18.476 6.132 1.00 0.00 H ATOM 192 HG3 ARG A 12 4.971 18.578 7.888 1.00 0.00 H ATOM 193 HD2 ARG A 12 5.746 20.642 6.934 1.00 0.00 H ATOM 194 HD3 ARG A 12 7.125 19.772 7.603 1.00 0.00 H ATOM 195 HE ARG A 12 8.025 19.720 5.513 1.00 0.00 H ATOM 196 HH11 ARG A 12 4.577 20.253 5.172 1.00 0.00 H ATOM 197 HH12 ARG A 12 4.648 20.398 3.449 1.00 0.00 H ATOM 198 HH21 ARG A 12 8.105 19.915 3.244 1.00 0.00 H ATOM 199 HH22 ARG A 12 6.648 20.203 2.354 1.00 0.00 H ATOM 200 N LYS A 13 5.235 15.195 4.757 1.00 0.00 N ATOM 201 CA LYS A 13 4.498 14.988 3.512 1.00 0.00 C ATOM 202 C LYS A 13 3.610 13.753 3.598 1.00 0.00 C ATOM 203 O LYS A 13 2.447 13.788 3.190 1.00 0.00 O ATOM 204 CB LYS A 13 5.460 14.869 2.324 1.00 0.00 C ATOM 205 CG LYS A 13 6.331 16.101 2.095 1.00 0.00 C ATOM 206 CD LYS A 13 5.609 17.188 1.307 1.00 0.00 C ATOM 207 CE LYS A 13 4.401 17.738 2.052 1.00 0.00 C ATOM 208 NZ LYS A 13 3.772 18.877 1.328 1.00 0.00 N ATOM 209 H LYS A 13 6.157 14.847 4.836 1.00 0.00 H ATOM 210 HA LYS A 13 3.862 15.840 3.374 1.00 0.00 H ATOM 211 HB2 LYS A 13 6.112 14.025 2.491 1.00 0.00 H ATOM 212 HB3 LYS A 13 4.884 14.693 1.428 1.00 0.00 H ATOM 213 HG2 LYS A 13 6.621 16.504 3.054 1.00 0.00 H ATOM 214 HG3 LYS A 13 7.216 15.803 1.550 1.00 0.00 H ATOM 215 HD2 LYS A 13 6.298 17.998 1.120 1.00 0.00 H ATOM 216 HD3 LYS A 13 5.280 16.773 0.365 1.00 0.00 H ATOM 217 HE2 LYS A 13 3.672 16.950 2.158 1.00 0.00 H ATOM 218 HE3 LYS A 13 4.717 18.072 3.029 1.00 0.00 H ATOM 219 HZ1 LYS A 13 4.493 19.581 1.071 1.00 0.00 H ATOM 220 HZ2 LYS A 13 3.058 19.333 1.930 1.00 0.00 H ATOM 221 HZ3 LYS A 13 3.310 18.537 0.460 1.00 0.00 H ATOM 222 N LEU A 14 4.159 12.668 4.143 1.00 0.00 N ATOM 223 CA LEU A 14 3.413 11.422 4.303 1.00 0.00 C ATOM 224 C LEU A 14 2.138 11.666 5.115 1.00 0.00 C ATOM 225 O LEU A 14 1.135 10.974 4.934 1.00 0.00 O ATOM 226 CB LEU A 14 4.297 10.368 4.990 1.00 0.00 C ATOM 227 CG LEU A 14 3.743 8.938 5.023 1.00 0.00 C ATOM 228 CD1 LEU A 14 4.842 7.957 5.402 1.00 0.00 C ATOM 229 CD2 LEU A 14 2.580 8.823 6.002 1.00 0.00 C ATOM 230 H LEU A 14 5.086 12.711 4.457 1.00 0.00 H ATOM 231 HA LEU A 14 3.140 11.068 3.320 1.00 0.00 H ATOM 232 HB2 LEU A 14 5.249 10.346 4.480 1.00 0.00 H ATOM 233 HB3 LEU A 14 4.466 10.685 6.009 1.00 0.00 H ATOM 234 HG LEU A 14 3.382 8.674 4.039 1.00 0.00 H ATOM 235 HD11 LEU A 14 5.406 8.351 6.234 1.00 0.00 H ATOM 236 HD12 LEU A 14 5.501 7.811 4.558 1.00 0.00 H ATOM 237 HD13 LEU A 14 4.401 7.011 5.681 1.00 0.00 H ATOM 238 HD21 LEU A 14 1.651 8.783 5.453 1.00 0.00 H ATOM 239 HD22 LEU A 14 2.575 9.680 6.659 1.00 0.00 H ATOM 240 HD23 LEU A 14 2.690 7.922 6.588 1.00 0.00 H ATOM 241 N ASP A 15 2.183 12.666 6.002 1.00 0.00 N ATOM 242 CA ASP A 15 1.034 13.009 6.836 1.00 0.00 C ATOM 243 C ASP A 15 0.221 14.141 6.210 1.00 0.00 C ATOM 244 O ASP A 15 -0.981 14.004 5.986 1.00 0.00 O ATOM 245 CB ASP A 15 1.490 13.393 8.249 1.00 0.00 C ATOM 246 CG ASP A 15 2.132 12.227 8.987 1.00 0.00 C ATOM 247 OD1 ASP A 15 1.511 11.177 9.162 1.00 0.00 O ATOM 248 H ASP A 15 3.009 13.198 6.085 1.00 0.00 H ATOM 249 HA ASP A 15 0.405 12.133 6.901 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.211 14.195 8.183 1.00 0.00 H ATOM 251 HB3 ASP A 15 0.636 13.729 8.818 1.00 0.00 H HETATM 252 N NH2 A 16 0.878 15.261 5.922 1.00 0.00 N HETATM 253 HN1 NH2 A 16 1.836 15.304 6.127 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.377 15.999 5.517 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 15 ATOM 1 N PHE A 1 25.097 11.693 7.289 1.00 0.00 N ATOM 2 CA PHE A 1 24.267 12.888 7.172 1.00 0.00 C ATOM 3 C PHE A 1 23.096 12.833 8.151 1.00 0.00 C ATOM 4 O PHE A 1 22.554 11.759 8.418 1.00 0.00 O ATOM 5 CB PHE A 1 23.743 13.049 5.738 1.00 0.00 C ATOM 6 CG PHE A 1 24.825 13.216 4.703 1.00 0.00 C ATOM 7 CD1 PHE A 1 25.722 12.191 4.439 1.00 0.00 C ATOM 8 CD2 PHE A 1 24.938 14.399 3.989 1.00 0.00 C ATOM 9 CE1 PHE A 1 26.710 12.344 3.486 1.00 0.00 C ATOM 10 CE2 PHE A 1 25.925 14.557 3.034 1.00 0.00 C ATOM 11 CZ PHE A 1 26.812 13.528 2.783 1.00 0.00 C ATOM 12 H1 PHE A 1 26.065 11.791 7.407 1.00 0.00 H ATOM 13 HA PHE A 1 24.883 13.741 7.417 1.00 0.00 H ATOM 14 HB2 PHE A 1 23.167 12.175 5.474 1.00 0.00 H ATOM 15 HB3 PHE A 1 23.105 13.920 5.694 1.00 0.00 H ATOM 16 HD1 PHE A 1 25.644 11.263 4.987 1.00 0.00 H ATOM 17 HD2 PHE A 1 24.247 15.204 4.185 1.00 0.00 H ATOM 18 HE1 PHE A 1 27.403 11.538 3.292 1.00 0.00 H ATOM 19 HE2 PHE A 1 26.002 15.483 2.484 1.00 0.00 H ATOM 20 HZ PHE A 1 27.585 13.649 2.037 1.00 0.00 H ATOM 21 N GLY A 2 22.721 13.998 8.687 1.00 0.00 N ATOM 22 CA GLY A 2 21.620 14.077 9.638 1.00 0.00 C ATOM 23 C GLY A 2 20.277 13.705 9.030 1.00 0.00 C ATOM 24 O GLY A 2 19.483 14.582 8.686 1.00 0.00 O ATOM 25 H GLY A 2 23.200 14.815 8.435 1.00 0.00 H ATOM 26 HA2 GLY A 2 21.824 13.409 10.462 1.00 0.00 H ATOM 27 HA3 GLY A 2 21.563 15.087 10.017 1.00 0.00 H ATOM 28 N GLY A 3 20.024 12.402 8.900 1.00 0.00 N ATOM 29 CA GLY A 3 18.769 11.929 8.336 1.00 0.00 C ATOM 30 C GLY A 3 17.597 12.111 9.286 1.00 0.00 C ATOM 31 O GLY A 3 16.492 12.440 8.855 1.00 0.00 O ATOM 32 H GLY A 3 20.696 11.752 9.195 1.00 0.00 H ATOM 33 HA2 GLY A 3 18.569 12.477 7.427 1.00 0.00 H ATOM 34 HA3 GLY A 3 18.866 10.880 8.098 1.00 0.00 H ATOM 35 N PHE A 4 17.841 11.892 10.582 1.00 0.00 N ATOM 36 CA PHE A 4 16.801 12.029 11.607 1.00 0.00 C ATOM 37 C PHE A 4 16.162 13.423 11.591 1.00 0.00 C ATOM 38 O PHE A 4 14.958 13.557 11.813 1.00 0.00 O ATOM 39 CB PHE A 4 17.370 11.713 13.001 1.00 0.00 C ATOM 40 CG PHE A 4 18.597 12.508 13.372 1.00 0.00 C ATOM 41 CD1 PHE A 4 18.508 13.856 13.693 1.00 0.00 C ATOM 42 CD2 PHE A 4 19.842 11.899 13.408 1.00 0.00 C ATOM 43 CE1 PHE A 4 19.636 14.578 14.036 1.00 0.00 C ATOM 44 CE2 PHE A 4 20.973 12.617 13.751 1.00 0.00 C ATOM 45 CZ PHE A 4 20.869 13.958 14.065 1.00 0.00 C ATOM 46 H PHE A 4 18.744 11.628 10.857 1.00 0.00 H ATOM 47 HA PHE A 4 16.032 11.305 11.381 1.00 0.00 H ATOM 48 HB2 PHE A 4 16.612 11.915 13.742 1.00 0.00 H ATOM 49 HB3 PHE A 4 17.629 10.664 13.042 1.00 0.00 H ATOM 50 HD1 PHE A 4 17.544 14.343 13.672 1.00 0.00 H ATOM 51 HD2 PHE A 4 19.926 10.851 13.161 1.00 0.00 H ATOM 52 HE1 PHE A 4 19.553 15.626 14.281 1.00 0.00 H ATOM 53 HE2 PHE A 4 21.936 12.129 13.774 1.00 0.00 H ATOM 54 HZ PHE A 4 21.752 14.520 14.333 1.00 0.00 H ATOM 55 N THR A 5 16.968 14.454 11.320 1.00 0.00 N ATOM 56 CA THR A 5 16.462 15.826 11.269 1.00 0.00 C ATOM 57 C THR A 5 15.774 16.101 9.945 1.00 0.00 C ATOM 58 O THR A 5 14.760 16.800 9.883 1.00 0.00 O ATOM 59 CB THR A 5 17.571 16.876 11.526 1.00 0.00 C ATOM 60 OG1 THR A 5 17.015 18.199 11.492 1.00 0.00 O ATOM 61 CG2 THR A 5 18.693 16.768 10.501 1.00 0.00 C ATOM 62 H THR A 5 17.913 14.288 11.143 1.00 0.00 H ATOM 63 HA THR A 5 15.732 15.914 12.031 1.00 0.00 H ATOM 64 HB THR A 5 17.987 16.699 12.508 1.00 0.00 H ATOM 65 HG1 THR A 5 16.829 18.448 10.583 1.00 0.00 H ATOM 66 HG21 THR A 5 19.237 15.848 10.658 1.00 0.00 H ATOM 67 HG22 THR A 5 19.364 17.606 10.613 1.00 0.00 H ATOM 68 HG23 THR A 5 18.274 16.772 9.506 1.00 0.00 H ATOM 69 N LYS A 6 16.322 15.511 8.903 1.00 0.00 N ATOM 70 CA LYS A 6 15.771 15.633 7.557 1.00 0.00 C ATOM 71 C LYS A 6 14.450 14.864 7.468 1.00 0.00 C ATOM 72 O LYS A 6 13.663 15.071 6.543 1.00 0.00 O ATOM 73 CB LYS A 6 16.779 15.117 6.512 1.00 0.00 C ATOM 74 CG LYS A 6 16.476 13.723 5.967 1.00 0.00 C ATOM 75 CD LYS A 6 15.707 13.795 4.653 1.00 0.00 C ATOM 76 CE LYS A 6 15.113 12.449 4.264 1.00 0.00 C ATOM 77 NZ LYS A 6 13.789 12.240 4.854 1.00 0.00 N ATOM 78 H LYS A 6 17.105 14.954 9.055 1.00 0.00 H ATOM 79 HA LYS A 6 15.574 16.679 7.373 1.00 0.00 H ATOM 80 HB2 LYS A 6 16.793 15.805 5.679 1.00 0.00 H ATOM 81 HB3 LYS A 6 17.761 15.096 6.961 1.00 0.00 H ATOM 82 HG2 LYS A 6 17.408 13.205 5.798 1.00 0.00 H ATOM 83 HG3 LYS A 6 15.887 13.180 6.690 1.00 0.00 H ATOM 84 HD2 LYS A 6 14.907 14.511 4.754 1.00 0.00 H ATOM 85 HD3 LYS A 6 16.381 14.117 3.872 1.00 0.00 H ATOM 86 HE2 LYS A 6 15.029 12.405 3.189 1.00 0.00 H ATOM 87 HE3 LYS A 6 15.775 11.666 4.604 1.00 0.00 H ATOM 88 HZ1 LYS A 6 13.718 12.260 5.831 1.00 0.00 H ATOM 89 N ALA A 7 14.219 13.971 8.443 1.00 0.00 N ATOM 90 CA ALA A 7 13.004 13.164 8.482 1.00 0.00 C ATOM 91 C ALA A 7 11.752 14.023 8.503 1.00 0.00 C ATOM 92 O ALA A 7 10.717 13.617 7.982 1.00 0.00 O ATOM 93 CB ALA A 7 13.024 12.217 9.671 1.00 0.00 C ATOM 94 H ALA A 7 14.889 13.854 9.156 1.00 0.00 H ATOM 95 HA ALA A 7 12.983 12.576 7.583 1.00 0.00 H ATOM 96 HB1 ALA A 7 12.273 11.454 9.534 1.00 0.00 H ATOM 97 HB2 ALA A 7 12.816 12.770 10.575 1.00 0.00 H ATOM 98 HB3 ALA A 7 13.998 11.755 9.747 1.00 0.00 H ATOM 99 N ARG A 8 11.849 15.213 9.084 1.00 0.00 N ATOM 100 CA ARG A 8 10.716 16.125 9.134 1.00 0.00 C ATOM 101 C ARG A 8 10.193 16.370 7.733 1.00 0.00 C ATOM 102 O ARG A 8 8.990 16.488 7.515 1.00 0.00 O ATOM 103 CB ARG A 8 11.132 17.447 9.771 1.00 0.00 C ATOM 104 CG ARG A 8 10.921 17.514 11.281 1.00 0.00 C ATOM 105 CD ARG A 8 11.702 16.438 12.034 1.00 0.00 C ATOM 106 NE ARG A 8 11.171 15.089 11.810 1.00 0.00 N ATOM 107 CZ ARG A 8 9.951 14.681 12.185 1.00 0.00 C ATOM 108 NH1 ARG A 8 9.140 15.489 12.865 1.00 0.00 N ATOM 109 NH2 ARG A 8 9.550 13.446 11.893 1.00 0.00 N ATOM 110 H ARG A 8 12.706 15.490 9.473 1.00 0.00 H ATOM 111 HA ARG A 8 9.935 15.667 9.722 1.00 0.00 H ATOM 112 HB2 ARG A 8 12.181 17.606 9.567 1.00 0.00 H ATOM 113 HB3 ARG A 8 10.565 18.242 9.311 1.00 0.00 H ATOM 114 HG2 ARG A 8 11.243 18.482 11.633 1.00 0.00 H ATOM 115 HG3 ARG A 8 9.868 17.390 11.487 1.00 0.00 H ATOM 116 HD2 ARG A 8 12.730 16.465 11.706 1.00 0.00 H ATOM 117 HD3 ARG A 8 11.660 16.658 13.091 1.00 0.00 H ATOM 118 HE ARG A 8 11.751 14.453 11.342 1.00 0.00 H ATOM 119 HH11 ARG A 8 9.436 16.413 13.106 1.00 0.00 H ATOM 120 HH12 ARG A 8 8.231 15.172 13.137 1.00 0.00 H ATOM 121 HH21 ARG A 8 10.157 12.826 11.395 1.00 0.00 H ATOM 122 HH22 ARG A 8 8.639 13.137 12.169 1.00 0.00 H ATOM 123 N LYS A 9 11.112 16.419 6.783 1.00 0.00 N ATOM 124 CA LYS A 9 10.746 16.622 5.386 1.00 0.00 C ATOM 125 C LYS A 9 10.133 15.344 4.821 1.00 0.00 C ATOM 126 O LYS A 9 9.058 15.370 4.222 1.00 0.00 O ATOM 127 CB LYS A 9 11.965 17.045 4.558 1.00 0.00 C ATOM 128 CG LYS A 9 11.668 17.200 3.072 1.00 0.00 C ATOM 129 CD LYS A 9 12.855 17.774 2.311 1.00 0.00 C ATOM 130 CE LYS A 9 14.086 16.884 2.419 1.00 0.00 C ATOM 131 NZ LYS A 9 15.235 17.433 1.647 1.00 0.00 N ATOM 132 H LYS A 9 12.057 16.291 7.030 1.00 0.00 H ATOM 133 HA LYS A 9 10.004 17.407 5.350 1.00 0.00 H ATOM 134 HB2 LYS A 9 12.327 17.991 4.930 1.00 0.00 H ATOM 135 HB3 LYS A 9 12.739 16.302 4.673 1.00 0.00 H ATOM 136 HG2 LYS A 9 11.428 16.231 2.662 1.00 0.00 H ATOM 137 HG3 LYS A 9 10.822 17.861 2.953 1.00 0.00 H ATOM 138 HD2 LYS A 9 12.587 17.872 1.271 1.00 0.00 H ATOM 139 HD3 LYS A 9 13.090 18.747 2.716 1.00 0.00 H ATOM 140 HE2 LYS A 9 14.367 16.804 3.458 1.00 0.00 H ATOM 141 HE3 LYS A 9 13.842 15.903 2.038 1.00 0.00 H ATOM 142 HZ1 LYS A 9 14.952 17.610 0.661 1.00 0.00 H ATOM 143 HZ2 LYS A 9 16.026 16.758 1.651 1.00 0.00 H ATOM 144 HZ3 LYS A 9 15.555 18.327 2.071 1.00 0.00 H ATOM 145 N ASP A 10 10.822 14.224 5.038 1.00 0.00 N ATOM 146 CA ASP A 10 10.355 12.920 4.573 1.00 0.00 C ATOM 147 C ASP A 10 8.995 12.563 5.182 1.00 0.00 C ATOM 148 O ASP A 10 8.182 11.898 4.543 1.00 0.00 O ATOM 149 CB ASP A 10 11.391 11.840 4.907 1.00 0.00 C ATOM 150 CG ASP A 10 12.685 12.031 4.132 1.00 0.00 C ATOM 151 OD1 ASP A 10 12.688 11.996 2.900 1.00 0.00 O ATOM 152 H ASP A 10 11.665 14.275 5.535 1.00 0.00 H ATOM 153 HA ASP A 10 10.247 12.976 3.500 1.00 0.00 H ATOM 154 HB2 ASP A 10 11.616 11.876 5.962 1.00 0.00 H ATOM 155 HB3 ASP A 10 10.986 10.869 4.662 1.00 0.00 H ATOM 156 N LYS A 11 8.750 13.022 6.412 1.00 0.00 N ATOM 157 CA LYS A 11 7.489 12.762 7.101 1.00 0.00 C ATOM 158 C LYS A 11 6.415 13.737 6.638 1.00 0.00 C ATOM 159 O LYS A 11 5.304 13.329 6.293 1.00 0.00 O ATOM 160 CB LYS A 11 7.668 12.867 8.620 1.00 0.00 C ATOM 161 CG LYS A 11 6.354 12.822 9.388 1.00 0.00 C ATOM 162 CD LYS A 11 5.621 11.507 9.169 1.00 0.00 C ATOM 163 CE LYS A 11 4.135 11.640 9.464 1.00 0.00 C ATOM 164 NZ LYS A 11 3.458 12.500 8.489 1.00 0.00 N ATOM 165 H LYS A 11 9.428 13.563 6.862 1.00 0.00 H ATOM 166 HA LYS A 11 7.178 11.760 6.852 1.00 0.00 H ATOM 167 HB2 LYS A 11 8.287 12.048 8.956 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.163 13.799 8.850 1.00 0.00 H ATOM 169 HG2 LYS A 11 6.562 12.934 10.441 1.00 0.00 H ATOM 170 HG3 LYS A 11 5.725 13.635 9.055 1.00 0.00 H ATOM 171 HD2 LYS A 11 5.746 11.201 8.142 1.00 0.00 H ATOM 172 HD3 LYS A 11 6.043 10.759 9.824 1.00 0.00 H ATOM 173 HE2 LYS A 11 3.685 10.659 9.441 1.00 0.00 H ATOM 174 HE3 LYS A 11 4.015 12.068 10.449 1.00 0.00 H ATOM 175 HZ1 LYS A 11 3.867 13.369 8.292 1.00 0.00 H ATOM 176 N ARG A 12 6.760 15.025 6.629 1.00 0.00 N ATOM 177 CA ARG A 12 5.832 16.069 6.200 1.00 0.00 C ATOM 178 C ARG A 12 5.228 15.712 4.843 1.00 0.00 C ATOM 179 O ARG A 12 4.073 16.040 4.564 1.00 0.00 O ATOM 180 CB ARG A 12 6.546 17.424 6.114 1.00 0.00 C ATOM 181 CG ARG A 12 5.606 18.610 5.947 1.00 0.00 C ATOM 182 CD ARG A 12 4.773 18.837 7.201 1.00 0.00 C ATOM 183 NE ARG A 12 3.935 20.034 7.105 1.00 0.00 N ATOM 184 CZ ARG A 12 3.160 20.481 8.097 1.00 0.00 C ATOM 185 NH1 ARG A 12 3.111 19.836 9.260 1.00 0.00 N ATOM 186 NH2 ARG A 12 2.433 21.582 7.927 1.00 0.00 N ATOM 187 H ARG A 12 7.665 15.278 6.913 1.00 0.00 H ATOM 188 HA ARG A 12 5.039 16.130 6.931 1.00 0.00 H ATOM 189 HB2 ARG A 12 7.116 17.573 7.019 1.00 0.00 H ATOM 190 HB3 ARG A 12 7.223 17.409 5.272 1.00 0.00 H ATOM 191 HG2 ARG A 12 6.190 19.496 5.749 1.00 0.00 H ATOM 192 HG3 ARG A 12 4.944 18.418 5.116 1.00 0.00 H ATOM 193 HD2 ARG A 12 4.136 17.979 7.354 1.00 0.00 H ATOM 194 HD3 ARG A 12 5.439 18.943 8.044 1.00 0.00 H ATOM 195 HE ARG A 12 3.951 20.531 6.260 1.00 0.00 H ATOM 196 HH11 ARG A 12 3.655 19.009 9.399 1.00 0.00 H ATOM 197 HH12 ARG A 12 2.529 20.179 9.998 1.00 0.00 H ATOM 198 HH21 ARG A 12 2.465 22.073 7.057 1.00 0.00 H ATOM 199 HH22 ARG A 12 1.853 21.918 8.670 1.00 0.00 H ATOM 200 N LYS A 13 6.018 15.029 4.006 1.00 0.00 N ATOM 201 CA LYS A 13 5.554 14.620 2.679 1.00 0.00 C ATOM 202 C LYS A 13 4.746 13.329 2.735 1.00 0.00 C ATOM 203 O LYS A 13 3.668 13.247 2.145 1.00 0.00 O ATOM 204 CB LYS A 13 6.729 14.469 1.704 1.00 0.00 C ATOM 205 CG LYS A 13 7.137 15.765 1.015 1.00 0.00 C ATOM 206 CD LYS A 13 7.568 16.834 2.009 1.00 0.00 C ATOM 207 CE LYS A 13 7.948 18.131 1.309 1.00 0.00 C ATOM 208 NZ LYS A 13 9.102 17.954 0.382 1.00 0.00 N ATOM 209 H LYS A 13 6.933 14.790 4.295 1.00 0.00 H ATOM 210 HA LYS A 13 4.903 15.396 2.322 1.00 0.00 H ATOM 211 HB2 LYS A 13 7.584 14.092 2.245 1.00 0.00 H ATOM 212 HB3 LYS A 13 6.457 13.754 0.941 1.00 0.00 H ATOM 213 HG2 LYS A 13 7.961 15.560 0.348 1.00 0.00 H ATOM 214 HG3 LYS A 13 6.298 16.136 0.445 1.00 0.00 H ATOM 215 HD2 LYS A 13 6.752 17.030 2.688 1.00 0.00 H ATOM 216 HD3 LYS A 13 8.419 16.473 2.562 1.00 0.00 H ATOM 217 HE2 LYS A 13 7.097 18.483 0.746 1.00 0.00 H ATOM 218 HE3 LYS A 13 8.208 18.865 2.058 1.00 0.00 H ATOM 219 HZ1 LYS A 13 8.768 17.627 -0.548 1.00 0.00 H ATOM 220 HZ2 LYS A 13 9.767 17.252 0.765 1.00 0.00 H ATOM 221 HZ3 LYS A 13 9.604 18.858 0.260 1.00 0.00 H ATOM 222 N LEU A 14 5.258 12.331 3.455 1.00 0.00 N ATOM 223 CA LEU A 14 4.562 11.052 3.594 1.00 0.00 C ATOM 224 C LEU A 14 3.145 11.256 4.131 1.00 0.00 C ATOM 225 O LEU A 14 2.250 10.457 3.852 1.00 0.00 O ATOM 226 CB LEU A 14 5.340 10.111 4.520 1.00 0.00 C ATOM 227 CG LEU A 14 6.602 9.491 3.913 1.00 0.00 C ATOM 228 CD1 LEU A 14 7.379 8.720 4.970 1.00 0.00 C ATOM 229 CD2 LEU A 14 6.239 8.580 2.749 1.00 0.00 C ATOM 230 H LEU A 14 6.116 12.460 3.911 1.00 0.00 H ATOM 231 HA LEU A 14 4.499 10.604 2.614 1.00 0.00 H ATOM 232 HB2 LEU A 14 5.627 10.667 5.402 1.00 0.00 H ATOM 233 HB3 LEU A 14 4.682 9.310 4.820 1.00 0.00 H ATOM 234 HG LEU A 14 7.238 10.278 3.537 1.00 0.00 H ATOM 235 HD11 LEU A 14 8.378 8.524 4.611 1.00 0.00 H ATOM 236 HD12 LEU A 14 6.879 7.784 5.173 1.00 0.00 H ATOM 237 HD13 LEU A 14 7.431 9.304 5.877 1.00 0.00 H ATOM 238 HD21 LEU A 14 7.112 8.023 2.441 1.00 0.00 H ATOM 239 HD22 LEU A 14 5.883 9.177 1.923 1.00 0.00 H ATOM 240 HD23 LEU A 14 5.464 7.893 3.057 1.00 0.00 H ATOM 241 N ASP A 15 2.947 12.334 4.896 1.00 0.00 N ATOM 242 CA ASP A 15 1.635 12.640 5.461 1.00 0.00 C ATOM 243 C ASP A 15 0.878 13.629 4.577 1.00 0.00 C ATOM 244 O ASP A 15 -0.237 13.353 4.136 1.00 0.00 O ATOM 245 CB ASP A 15 1.772 13.193 6.884 1.00 0.00 C ATOM 246 CG ASP A 15 2.327 12.168 7.863 1.00 0.00 C ATOM 247 OD1 ASP A 15 1.745 11.098 8.053 1.00 0.00 O ATOM 248 H ASP A 15 3.700 12.946 5.070 1.00 0.00 H ATOM 249 HA ASP A 15 1.074 11.718 5.500 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.435 14.045 6.870 1.00 0.00 H ATOM 251 HB3 ASP A 15 0.799 13.507 7.234 1.00 0.00 H HETATM 252 N NH2 A 16 1.484 14.784 4.316 1.00 0.00 N HETATM 253 HN1 NH2 A 16 2.373 14.940 4.701 1.00 0.00 H HETATM 254 HN2 NH2 A 16 1.017 15.433 3.750 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 16 ATOM 1 N PHE A 1 25.085 14.982 9.363 1.00 0.00 N ATOM 2 CA PHE A 1 25.293 13.616 8.894 1.00 0.00 C ATOM 3 C PHE A 1 24.033 12.773 9.087 1.00 0.00 C ATOM 4 O PHE A 1 23.589 12.089 8.163 1.00 0.00 O ATOM 5 CB PHE A 1 26.473 12.966 9.628 1.00 0.00 C ATOM 6 CG PHE A 1 27.806 13.608 9.342 1.00 0.00 C ATOM 7 CD1 PHE A 1 28.022 14.953 9.608 1.00 0.00 C ATOM 8 CD2 PHE A 1 28.844 12.863 8.804 1.00 0.00 C ATOM 9 CE1 PHE A 1 29.246 15.538 9.344 1.00 0.00 C ATOM 10 CE2 PHE A 1 30.069 13.444 8.538 1.00 0.00 C ATOM 11 CZ PHE A 1 30.270 14.783 8.808 1.00 0.00 C ATOM 12 H1 PHE A 1 25.202 15.726 8.736 1.00 0.00 H ATOM 13 HA PHE A 1 25.520 13.661 7.839 1.00 0.00 H ATOM 14 HB2 PHE A 1 26.301 13.026 10.692 1.00 0.00 H ATOM 15 HB3 PHE A 1 26.536 11.927 9.339 1.00 0.00 H ATOM 16 HD1 PHE A 1 27.224 15.545 10.029 1.00 0.00 H ATOM 17 HD2 PHE A 1 28.689 11.815 8.592 1.00 0.00 H ATOM 18 HE1 PHE A 1 29.400 16.586 9.555 1.00 0.00 H ATOM 19 HE2 PHE A 1 30.869 12.851 8.119 1.00 0.00 H ATOM 20 HZ PHE A 1 31.227 15.239 8.600 1.00 0.00 H ATOM 21 N GLY A 2 23.462 12.828 10.294 1.00 0.00 N ATOM 22 CA GLY A 2 22.257 12.068 10.591 1.00 0.00 C ATOM 23 C GLY A 2 21.040 12.583 9.844 1.00 0.00 C ATOM 24 O GLY A 2 20.827 13.795 9.755 1.00 0.00 O ATOM 25 H GLY A 2 23.862 13.391 10.989 1.00 0.00 H ATOM 26 HA2 GLY A 2 22.421 11.035 10.320 1.00 0.00 H ATOM 27 HA3 GLY A 2 22.064 12.124 11.652 1.00 0.00 H ATOM 28 N GLY A 3 20.235 11.660 9.311 1.00 0.00 N ATOM 29 CA GLY A 3 19.036 12.038 8.580 1.00 0.00 C ATOM 30 C GLY A 3 17.830 12.250 9.481 1.00 0.00 C ATOM 31 O GLY A 3 16.697 11.983 9.076 1.00 0.00 O ATOM 32 H GLY A 3 20.453 10.715 9.422 1.00 0.00 H ATOM 33 HA2 GLY A 3 19.231 12.953 8.041 1.00 0.00 H ATOM 34 HA3 GLY A 3 18.805 11.259 7.868 1.00 0.00 H ATOM 35 N PHE A 4 18.069 12.743 10.699 1.00 0.00 N ATOM 36 CA PHE A 4 16.993 13.006 11.653 1.00 0.00 C ATOM 37 C PHE A 4 16.117 14.165 11.177 1.00 0.00 C ATOM 38 O PHE A 4 14.924 14.217 11.481 1.00 0.00 O ATOM 39 CB PHE A 4 17.568 13.301 13.048 1.00 0.00 C ATOM 40 CG PHE A 4 18.514 14.474 13.094 1.00 0.00 C ATOM 41 CD1 PHE A 4 18.046 15.772 12.955 1.00 0.00 C ATOM 42 CD2 PHE A 4 19.872 14.275 13.285 1.00 0.00 C ATOM 43 CE1 PHE A 4 18.913 16.846 13.002 1.00 0.00 C ATOM 44 CE2 PHE A 4 20.744 15.346 13.334 1.00 0.00 C ATOM 45 CZ PHE A 4 20.264 16.633 13.192 1.00 0.00 C ATOM 46 H PHE A 4 18.989 12.946 10.960 1.00 0.00 H ATOM 47 HA PHE A 4 16.383 12.116 11.709 1.00 0.00 H ATOM 48 HB2 PHE A 4 16.754 13.510 13.725 1.00 0.00 H ATOM 49 HB3 PHE A 4 18.102 12.429 13.397 1.00 0.00 H ATOM 50 HD1 PHE A 4 16.989 15.941 12.807 1.00 0.00 H ATOM 51 HD2 PHE A 4 20.250 13.269 13.394 1.00 0.00 H ATOM 52 HE1 PHE A 4 18.535 17.851 12.891 1.00 0.00 H ATOM 53 HE2 PHE A 4 21.800 15.176 13.484 1.00 0.00 H ATOM 54 HZ PHE A 4 20.944 17.471 13.230 1.00 0.00 H ATOM 55 N THR A 5 16.720 15.087 10.421 1.00 0.00 N ATOM 56 CA THR A 5 15.997 16.242 9.894 1.00 0.00 C ATOM 57 C THR A 5 15.192 15.862 8.669 1.00 0.00 C ATOM 58 O THR A 5 14.054 16.298 8.489 1.00 0.00 O ATOM 59 CB THR A 5 16.938 17.427 9.569 1.00 0.00 C ATOM 60 OG1 THR A 5 16.176 18.550 9.102 1.00 0.00 O ATOM 61 CG2 THR A 5 17.977 17.042 8.522 1.00 0.00 C ATOM 62 H THR A 5 17.669 14.979 10.205 1.00 0.00 H ATOM 63 HA THR A 5 15.313 16.547 10.641 1.00 0.00 H ATOM 64 HB THR A 5 17.454 17.710 10.476 1.00 0.00 H ATOM 65 HG1 THR A 5 15.860 18.380 8.211 1.00 0.00 H ATOM 66 HG21 THR A 5 18.688 17.848 8.408 1.00 0.00 H ATOM 67 HG22 THR A 5 17.487 16.860 7.577 1.00 0.00 H ATOM 68 HG23 THR A 5 18.494 16.149 8.838 1.00 0.00 H ATOM 69 N LYS A 6 15.789 15.013 7.863 1.00 0.00 N ATOM 70 CA LYS A 6 15.146 14.504 6.660 1.00 0.00 C ATOM 71 C LYS A 6 13.937 13.649 7.033 1.00 0.00 C ATOM 72 O LYS A 6 13.044 13.445 6.214 1.00 0.00 O ATOM 73 CB LYS A 6 16.131 13.679 5.819 1.00 0.00 C ATOM 74 CG LYS A 6 15.468 12.893 4.692 1.00 0.00 C ATOM 75 CD LYS A 6 14.796 13.808 3.676 1.00 0.00 C ATOM 76 CE LYS A 6 13.863 13.036 2.749 1.00 0.00 C ATOM 77 NZ LYS A 6 12.606 12.666 3.408 1.00 0.00 N ATOM 78 H LYS A 6 16.676 14.699 8.106 1.00 0.00 H ATOM 79 HA LYS A 6 14.809 15.351 6.080 1.00 0.00 H ATOM 80 HB2 LYS A 6 16.859 14.347 5.382 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.640 12.980 6.466 1.00 0.00 H ATOM 82 HG2 LYS A 6 16.220 12.307 4.187 1.00 0.00 H ATOM 83 HG3 LYS A 6 14.725 12.235 5.117 1.00 0.00 H ATOM 84 HD2 LYS A 6 14.223 14.556 4.203 1.00 0.00 H ATOM 85 HD3 LYS A 6 15.559 14.289 3.082 1.00 0.00 H ATOM 86 HE2 LYS A 6 13.638 13.653 1.892 1.00 0.00 H ATOM 87 HE3 LYS A 6 14.365 12.137 2.422 1.00 0.00 H ATOM 88 HZ1 LYS A 6 11.867 13.302 3.342 1.00 0.00 H ATOM 89 N ALA A 7 13.915 13.143 8.272 1.00 0.00 N ATOM 90 CA ALA A 7 12.807 12.305 8.723 1.00 0.00 C ATOM 91 C ALA A 7 11.511 13.091 8.786 1.00 0.00 C ATOM 92 O ALA A 7 10.494 12.667 8.236 1.00 0.00 O ATOM 93 CB ALA A 7 13.122 11.660 10.065 1.00 0.00 C ATOM 94 H ALA A 7 14.658 13.339 8.892 1.00 0.00 H ATOM 95 HA ALA A 7 12.682 11.531 7.994 1.00 0.00 H ATOM 96 HB1 ALA A 7 14.078 11.161 10.009 1.00 0.00 H ATOM 97 HB2 ALA A 7 12.354 10.941 10.308 1.00 0.00 H ATOM 98 HB3 ALA A 7 13.157 12.421 10.831 1.00 0.00 H ATOM 99 N ARG A 8 11.561 14.251 9.424 1.00 0.00 N ATOM 100 CA ARG A 8 10.397 15.120 9.520 1.00 0.00 C ATOM 101 C ARG A 8 9.944 15.505 8.118 1.00 0.00 C ATOM 102 O ARG A 8 8.757 15.680 7.857 1.00 0.00 O ATOM 103 CB ARG A 8 10.763 16.384 10.296 1.00 0.00 C ATOM 104 CG ARG A 8 9.605 17.021 11.059 1.00 0.00 C ATOM 105 CD ARG A 8 8.472 17.458 10.138 1.00 0.00 C ATOM 106 NE ARG A 8 8.921 18.380 9.092 1.00 0.00 N ATOM 107 CZ ARG A 8 9.357 19.624 9.316 1.00 0.00 C ATOM 108 NH1 ARG A 8 9.364 20.131 10.548 1.00 0.00 N ATOM 109 NH2 ARG A 8 9.774 20.371 8.299 1.00 0.00 N ATOM 110 H ARG A 8 12.410 14.544 9.818 1.00 0.00 H ATOM 111 HA ARG A 8 9.604 14.590 10.023 1.00 0.00 H ATOM 112 HB2 ARG A 8 11.542 16.139 10.999 1.00 0.00 H ATOM 113 HB3 ARG A 8 11.146 17.112 9.592 1.00 0.00 H ATOM 114 HG2 ARG A 8 9.219 16.303 11.766 1.00 0.00 H ATOM 115 HG3 ARG A 8 9.976 17.884 11.592 1.00 0.00 H ATOM 116 HD2 ARG A 8 8.046 16.582 9.674 1.00 0.00 H ATOM 117 HD3 ARG A 8 7.715 17.948 10.734 1.00 0.00 H ATOM 118 HE ARG A 8 8.909 18.050 8.169 1.00 0.00 H ATOM 119 HH11 ARG A 8 9.041 19.583 11.319 1.00 0.00 H ATOM 120 HH12 ARG A 8 9.694 21.062 10.702 1.00 0.00 H ATOM 121 HH21 ARG A 8 9.763 20.002 7.370 1.00 0.00 H ATOM 122 HH22 ARG A 8 10.101 21.302 8.463 1.00 0.00 H ATOM 123 N LYS A 9 10.919 15.628 7.224 1.00 0.00 N ATOM 124 CA LYS A 9 10.656 15.993 5.833 1.00 0.00 C ATOM 125 C LYS A 9 10.000 14.839 5.077 1.00 0.00 C ATOM 126 O LYS A 9 9.001 15.028 4.383 1.00 0.00 O ATOM 127 CB LYS A 9 11.959 16.408 5.139 1.00 0.00 C ATOM 128 CG LYS A 9 11.775 16.870 3.701 1.00 0.00 C ATOM 129 CD LYS A 9 10.868 18.089 3.614 1.00 0.00 C ATOM 130 CE LYS A 9 10.723 18.581 2.181 1.00 0.00 C ATOM 131 NZ LYS A 9 10.119 17.551 1.287 1.00 0.00 N ATOM 132 H LYS A 9 11.847 15.457 7.513 1.00 0.00 H ATOM 133 HA LYS A 9 9.978 16.834 5.836 1.00 0.00 H ATOM 134 HB2 LYS A 9 12.408 17.216 5.697 1.00 0.00 H ATOM 135 HB3 LYS A 9 12.635 15.565 5.139 1.00 0.00 H ATOM 136 HG2 LYS A 9 12.740 17.123 3.288 1.00 0.00 H ATOM 137 HG3 LYS A 9 11.337 16.065 3.128 1.00 0.00 H ATOM 138 HD2 LYS A 9 9.892 17.827 3.994 1.00 0.00 H ATOM 139 HD3 LYS A 9 11.289 18.881 4.216 1.00 0.00 H ATOM 140 HE2 LYS A 9 10.092 19.458 2.178 1.00 0.00 H ATOM 141 HE3 LYS A 9 11.701 18.844 1.804 1.00 0.00 H ATOM 142 HZ1 LYS A 9 9.784 16.740 1.846 1.00 0.00 H ATOM 143 HZ2 LYS A 9 10.825 17.215 0.601 1.00 0.00 H ATOM 144 HZ3 LYS A 9 9.314 17.957 0.767 1.00 0.00 H ATOM 145 N ASP A 10 10.574 13.646 5.220 1.00 0.00 N ATOM 146 CA ASP A 10 10.061 12.451 4.555 1.00 0.00 C ATOM 147 C ASP A 10 8.684 12.056 5.102 1.00 0.00 C ATOM 148 O ASP A 10 7.867 11.487 4.376 1.00 0.00 O ATOM 149 CB ASP A 10 11.045 11.280 4.713 1.00 0.00 C ATOM 150 CG ASP A 10 12.420 11.520 4.079 1.00 0.00 C ATOM 151 OD1 ASP A 10 13.306 10.672 4.195 1.00 0.00 O ATOM 152 H ASP A 10 11.369 13.567 5.788 1.00 0.00 H ATOM 153 HA ASP A 10 9.959 12.679 3.505 1.00 0.00 H ATOM 154 HB2 ASP A 10 11.192 11.090 5.765 1.00 0.00 H ATOM 155 HB3 ASP A 10 10.613 10.400 4.257 1.00 0.00 H ATOM 156 N LYS A 11 8.429 12.365 6.379 1.00 0.00 N ATOM 157 CA LYS A 11 7.149 12.043 7.007 1.00 0.00 C ATOM 158 C LYS A 11 6.129 13.138 6.730 1.00 0.00 C ATOM 159 O LYS A 11 4.990 12.850 6.365 1.00 0.00 O ATOM 160 CB LYS A 11 7.310 11.828 8.517 1.00 0.00 C ATOM 161 CG LYS A 11 5.993 11.557 9.232 1.00 0.00 C ATOM 162 CD LYS A 11 5.292 12.849 9.633 1.00 0.00 C ATOM 163 CE LYS A 11 3.783 12.670 9.718 1.00 0.00 C ATOM 164 NZ LYS A 11 3.094 13.264 8.569 1.00 0.00 N ATOM 165 H LYS A 11 9.110 12.830 6.905 1.00 0.00 H ATOM 166 HA LYS A 11 6.792 11.127 6.562 1.00 0.00 H ATOM 167 HB2 LYS A 11 7.965 10.985 8.681 1.00 0.00 H ATOM 168 HB3 LYS A 11 7.757 12.711 8.950 1.00 0.00 H ATOM 169 HG2 LYS A 11 5.345 10.999 8.573 1.00 0.00 H ATOM 170 HG3 LYS A 11 6.191 10.976 10.120 1.00 0.00 H ATOM 171 HD2 LYS A 11 5.660 13.159 10.599 1.00 0.00 H ATOM 172 HD3 LYS A 11 5.515 13.611 8.903 1.00 0.00 H ATOM 173 HE2 LYS A 11 3.559 11.615 9.754 1.00 0.00 H ATOM 174 HE3 LYS A 11 3.429 13.144 10.622 1.00 0.00 H ATOM 175 HZ1 LYS A 11 3.428 14.126 8.241 1.00 0.00 H ATOM 176 N ARG A 12 6.551 14.394 6.889 1.00 0.00 N ATOM 177 CA ARG A 12 5.676 15.534 6.632 1.00 0.00 C ATOM 178 C ARG A 12 5.037 15.387 5.255 1.00 0.00 C ATOM 179 O ARG A 12 3.865 15.720 5.062 1.00 0.00 O ATOM 180 CB ARG A 12 6.462 16.847 6.713 1.00 0.00 C ATOM 181 CG ARG A 12 5.635 18.081 6.389 1.00 0.00 C ATOM 182 CD ARG A 12 6.477 19.347 6.458 1.00 0.00 C ATOM 183 NE ARG A 12 5.722 20.535 6.058 1.00 0.00 N ATOM 184 CZ ARG A 12 5.285 20.767 4.815 1.00 0.00 C ATOM 185 NH1 ARG A 12 5.559 19.915 3.828 1.00 0.00 N ATOM 186 NH2 ARG A 12 4.580 21.863 4.556 1.00 0.00 N ATOM 187 H ARG A 12 7.477 14.555 7.171 1.00 0.00 H ATOM 188 HA ARG A 12 4.899 15.536 7.382 1.00 0.00 H ATOM 189 HB2 ARG A 12 6.851 16.957 7.714 1.00 0.00 H ATOM 190 HB3 ARG A 12 7.288 16.802 6.019 1.00 0.00 H ATOM 191 HG2 ARG A 12 5.232 17.982 5.393 1.00 0.00 H ATOM 192 HG3 ARG A 12 4.826 18.158 7.101 1.00 0.00 H ATOM 193 HD2 ARG A 12 6.822 19.479 7.473 1.00 0.00 H ATOM 194 HD3 ARG A 12 7.328 19.235 5.802 1.00 0.00 H ATOM 195 HE ARG A 12 5.519 21.194 6.755 1.00 0.00 H ATOM 196 HH11 ARG A 12 6.098 19.093 4.008 1.00 0.00 H ATOM 197 HH12 ARG A 12 5.226 20.099 2.903 1.00 0.00 H ATOM 198 HH21 ARG A 12 4.377 22.513 5.289 1.00 0.00 H ATOM 199 HH22 ARG A 12 4.251 22.039 3.628 1.00 0.00 H ATOM 200 N LYS A 13 5.816 14.860 4.306 1.00 0.00 N ATOM 201 CA LYS A 13 5.321 14.641 2.949 1.00 0.00 C ATOM 202 C LYS A 13 4.484 13.372 2.885 1.00 0.00 C ATOM 203 O LYS A 13 3.426 13.350 2.252 1.00 0.00 O ATOM 204 CB LYS A 13 6.475 14.577 1.944 1.00 0.00 C ATOM 205 CG LYS A 13 7.287 15.862 1.857 1.00 0.00 C ATOM 206 CD LYS A 13 6.428 17.054 1.458 1.00 0.00 C ATOM 207 CE LYS A 13 5.814 16.871 0.078 1.00 0.00 C ATOM 208 NZ LYS A 13 4.975 18.037 -0.318 1.00 0.00 N ATOM 209 H LYS A 13 6.740 14.594 4.534 1.00 0.00 H ATOM 210 HA LYS A 13 4.682 15.471 2.704 1.00 0.00 H ATOM 211 HB2 LYS A 13 7.140 13.775 2.230 1.00 0.00 H ATOM 212 HB3 LYS A 13 6.072 14.364 0.965 1.00 0.00 H ATOM 213 HG2 LYS A 13 7.730 16.061 2.821 1.00 0.00 H ATOM 214 HG3 LYS A 13 8.068 15.731 1.122 1.00 0.00 H ATOM 215 HD2 LYS A 13 5.634 17.171 2.180 1.00 0.00 H ATOM 216 HD3 LYS A 13 7.043 17.942 1.453 1.00 0.00 H ATOM 217 HE2 LYS A 13 6.609 16.750 -0.643 1.00 0.00 H ATOM 218 HE3 LYS A 13 5.199 15.983 0.086 1.00 0.00 H ATOM 219 HZ1 LYS A 13 4.529 17.859 -1.240 1.00 0.00 H ATOM 220 HZ2 LYS A 13 5.562 18.892 -0.390 1.00 0.00 H ATOM 221 HZ3 LYS A 13 4.231 18.199 0.390 1.00 0.00 H ATOM 222 N LEU A 14 4.948 12.326 3.570 1.00 0.00 N ATOM 223 CA LEU A 14 4.227 11.059 3.623 1.00 0.00 C ATOM 224 C LEU A 14 2.801 11.291 4.133 1.00 0.00 C ATOM 225 O LEU A 14 1.874 10.569 3.761 1.00 0.00 O ATOM 226 CB LEU A 14 4.976 10.065 4.528 1.00 0.00 C ATOM 227 CG LEU A 14 4.386 8.649 4.621 1.00 0.00 C ATOM 228 CD1 LEU A 14 3.100 8.642 5.435 1.00 0.00 C ATOM 229 CD2 LEU A 14 4.144 8.077 3.230 1.00 0.00 C ATOM 230 H LEU A 14 5.786 12.417 4.070 1.00 0.00 H ATOM 231 HA LEU A 14 4.180 10.660 2.620 1.00 0.00 H ATOM 232 HB2 LEU A 14 5.989 9.981 4.164 1.00 0.00 H ATOM 233 HB3 LEU A 14 5.008 10.480 5.525 1.00 0.00 H ATOM 234 HG LEU A 14 5.097 8.009 5.123 1.00 0.00 H ATOM 235 HD11 LEU A 14 3.123 7.821 6.136 1.00 0.00 H ATOM 236 HD12 LEU A 14 2.254 8.526 4.774 1.00 0.00 H ATOM 237 HD13 LEU A 14 3.009 9.573 5.976 1.00 0.00 H ATOM 238 HD21 LEU A 14 3.938 7.019 3.307 1.00 0.00 H ATOM 239 HD22 LEU A 14 5.022 8.229 2.620 1.00 0.00 H ATOM 240 HD23 LEU A 14 3.300 8.576 2.777 1.00 0.00 H ATOM 241 N ASP A 15 2.632 12.323 4.970 1.00 0.00 N ATOM 242 CA ASP A 15 1.320 12.666 5.514 1.00 0.00 C ATOM 243 C ASP A 15 0.494 13.435 4.484 1.00 0.00 C ATOM 244 O ASP A 15 -0.620 13.036 4.145 1.00 0.00 O ATOM 245 CB ASP A 15 1.456 13.498 6.797 1.00 0.00 C ATOM 246 CG ASP A 15 2.042 12.714 7.962 1.00 0.00 C ATOM 247 OD1 ASP A 15 1.542 11.645 8.318 1.00 0.00 O ATOM 248 H ASP A 15 3.408 12.881 5.209 1.00 0.00 H ATOM 249 HA ASP A 15 0.809 11.744 5.748 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.098 14.343 6.601 1.00 0.00 H ATOM 251 HB3 ASP A 15 0.479 13.858 7.086 1.00 0.00 H HETATM 252 N NH2 A 16 1.042 14.541 3.984 1.00 0.00 N HETATM 253 HN1 NH2 A 16 1.934 14.801 4.298 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.532 15.050 3.321 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 17 ATOM 1 N PHE A 1 17.227 10.519 3.643 1.00 0.00 N ATOM 2 CA PHE A 1 16.542 11.791 3.855 1.00 0.00 C ATOM 3 C PHE A 1 16.221 12.010 5.337 1.00 0.00 C ATOM 4 O PHE A 1 16.294 13.136 5.832 1.00 0.00 O ATOM 5 CB PHE A 1 15.263 11.861 3.007 1.00 0.00 C ATOM 6 CG PHE A 1 14.244 10.792 3.317 1.00 0.00 C ATOM 7 CD1 PHE A 1 13.468 10.859 4.465 1.00 0.00 C ATOM 8 CD2 PHE A 1 14.054 9.728 2.449 1.00 0.00 C ATOM 9 CE1 PHE A 1 12.530 9.884 4.743 1.00 0.00 C ATOM 10 CE2 PHE A 1 13.115 8.751 2.722 1.00 0.00 C ATOM 11 CZ PHE A 1 12.353 8.829 3.871 1.00 0.00 C ATOM 12 H1 PHE A 1 18.120 10.387 4.024 1.00 0.00 H ATOM 13 HA PHE A 1 17.211 12.576 3.534 1.00 0.00 H ATOM 14 HB2 PHE A 1 14.792 12.818 3.165 1.00 0.00 H ATOM 15 HB3 PHE A 1 15.531 11.770 1.964 1.00 0.00 H ATOM 16 HD1 PHE A 1 13.605 11.683 5.149 1.00 0.00 H ATOM 17 HD2 PHE A 1 14.651 9.663 1.551 1.00 0.00 H ATOM 18 HE1 PHE A 1 11.935 9.948 5.642 1.00 0.00 H ATOM 19 HE2 PHE A 1 12.977 7.927 2.037 1.00 0.00 H ATOM 20 HZ PHE A 1 11.619 8.067 4.086 1.00 0.00 H ATOM 21 N GLY A 2 15.868 10.929 6.036 1.00 0.00 N ATOM 22 CA GLY A 2 15.543 11.019 7.449 1.00 0.00 C ATOM 23 C GLY A 2 16.773 10.965 8.337 1.00 0.00 C ATOM 24 O GLY A 2 16.865 10.107 9.217 1.00 0.00 O ATOM 25 H GLY A 2 15.830 10.061 5.589 1.00 0.00 H ATOM 26 HA2 GLY A 2 15.024 11.948 7.628 1.00 0.00 H ATOM 27 HA3 GLY A 2 14.890 10.199 7.708 1.00 0.00 H ATOM 28 N GLY A 3 17.722 11.876 8.104 1.00 0.00 N ATOM 29 CA GLY A 3 18.939 11.903 8.897 1.00 0.00 C ATOM 30 C GLY A 3 18.675 12.194 10.361 1.00 0.00 C ATOM 31 O GLY A 3 19.027 11.391 11.227 1.00 0.00 O ATOM 32 H GLY A 3 17.595 12.533 7.389 1.00 0.00 H ATOM 33 HA2 GLY A 3 19.430 10.945 8.815 1.00 0.00 H ATOM 34 HA3 GLY A 3 19.594 12.666 8.503 1.00 0.00 H ATOM 35 N PHE A 4 18.042 13.339 10.635 1.00 0.00 N ATOM 36 CA PHE A 4 17.717 13.736 12.008 1.00 0.00 C ATOM 37 C PHE A 4 17.115 15.142 12.060 1.00 0.00 C ATOM 38 O PHE A 4 16.058 15.347 12.658 1.00 0.00 O ATOM 39 CB PHE A 4 18.967 13.684 12.899 1.00 0.00 C ATOM 40 CG PHE A 4 18.694 14.001 14.345 1.00 0.00 C ATOM 41 CD1 PHE A 4 17.651 13.384 15.019 1.00 0.00 C ATOM 42 CD2 PHE A 4 19.482 14.914 15.028 1.00 0.00 C ATOM 43 CE1 PHE A 4 17.399 13.672 16.346 1.00 0.00 C ATOM 44 CE2 PHE A 4 19.234 15.205 16.356 1.00 0.00 C ATOM 45 CZ PHE A 4 18.191 14.584 17.016 1.00 0.00 C ATOM 46 H PHE A 4 17.780 13.925 9.894 1.00 0.00 H ATOM 47 HA PHE A 4 16.989 13.035 12.389 1.00 0.00 H ATOM 48 HB2 PHE A 4 19.392 12.693 12.856 1.00 0.00 H ATOM 49 HB3 PHE A 4 19.691 14.396 12.532 1.00 0.00 H ATOM 50 HD1 PHE A 4 17.031 12.671 14.496 1.00 0.00 H ATOM 51 HD2 PHE A 4 20.297 15.401 14.514 1.00 0.00 H ATOM 52 HE1 PHE A 4 16.583 13.185 16.859 1.00 0.00 H ATOM 53 HE2 PHE A 4 19.855 15.918 16.878 1.00 0.00 H ATOM 54 HZ PHE A 4 17.995 14.810 18.053 1.00 0.00 H ATOM 55 N THR A 5 17.803 16.111 11.447 1.00 0.00 N ATOM 56 CA THR A 5 17.337 17.499 11.445 1.00 0.00 C ATOM 57 C THR A 5 16.161 17.706 10.515 1.00 0.00 C ATOM 58 O THR A 5 15.017 17.835 10.954 1.00 0.00 O ATOM 59 CB THR A 5 18.472 18.490 11.089 1.00 0.00 C ATOM 60 OG1 THR A 5 19.068 18.140 9.831 1.00 0.00 O ATOM 61 CG2 THR A 5 19.540 18.510 12.175 1.00 0.00 C ATOM 62 H THR A 5 18.645 15.888 10.997 1.00 0.00 H ATOM 63 HA THR A 5 17.005 17.720 12.420 1.00 0.00 H ATOM 64 HB THR A 5 18.047 19.481 11.010 1.00 0.00 H ATOM 65 HG1 THR A 5 19.692 17.421 9.956 1.00 0.00 H ATOM 66 HG21 THR A 5 19.122 18.919 13.083 1.00 0.00 H ATOM 67 HG22 THR A 5 20.370 19.122 11.853 1.00 0.00 H ATOM 68 HG23 THR A 5 19.886 17.503 12.359 1.00 0.00 H ATOM 69 N LYS A 6 16.454 17.719 9.237 1.00 0.00 N ATOM 70 CA LYS A 6 15.431 17.892 8.210 1.00 0.00 C ATOM 71 C LYS A 6 14.703 16.573 7.924 1.00 0.00 C ATOM 72 O LYS A 6 13.998 16.456 6.921 1.00 0.00 O ATOM 73 CB LYS A 6 16.053 18.460 6.919 1.00 0.00 C ATOM 74 CG LYS A 6 17.228 17.654 6.357 1.00 0.00 C ATOM 75 CD LYS A 6 16.797 16.289 5.833 1.00 0.00 C ATOM 76 CE LYS A 6 15.843 16.411 4.651 1.00 0.00 C ATOM 77 NZ LYS A 6 14.844 15.344 4.644 1.00 0.00 N ATOM 78 H LYS A 6 17.384 17.598 8.983 1.00 0.00 H ATOM 79 HA LYS A 6 14.710 18.603 8.587 1.00 0.00 H ATOM 80 HB2 LYS A 6 15.287 18.507 6.160 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.402 19.463 7.120 1.00 0.00 H ATOM 82 HG2 LYS A 6 17.674 18.209 5.547 1.00 0.00 H ATOM 83 HG3 LYS A 6 17.960 17.513 7.139 1.00 0.00 H ATOM 84 HD2 LYS A 6 17.674 15.746 5.515 1.00 0.00 H ATOM 85 HD3 LYS A 6 16.308 15.745 6.626 1.00 0.00 H ATOM 86 HE2 LYS A 6 15.338 17.363 4.708 1.00 0.00 H ATOM 87 HE3 LYS A 6 16.415 16.362 3.737 1.00 0.00 H ATOM 88 HZ1 LYS A 6 14.924 14.645 5.328 1.00 0.00 H ATOM 89 N ALA A 7 14.874 15.580 8.808 1.00 0.00 N ATOM 90 CA ALA A 7 14.238 14.278 8.628 1.00 0.00 C ATOM 91 C ALA A 7 12.724 14.365 8.705 1.00 0.00 C ATOM 92 O ALA A 7 12.026 13.805 7.862 1.00 0.00 O ATOM 93 CB ALA A 7 14.770 13.276 9.642 1.00 0.00 C ATOM 94 H ALA A 7 15.446 15.725 9.595 1.00 0.00 H ATOM 95 HA ALA A 7 14.495 13.933 7.645 1.00 0.00 H ATOM 96 HB1 ALA A 7 14.646 13.674 10.639 1.00 0.00 H ATOM 97 HB2 ALA A 7 15.818 13.096 9.455 1.00 0.00 H ATOM 98 HB3 ALA A 7 14.224 12.349 9.554 1.00 0.00 H ATOM 99 N ARG A 8 12.223 15.080 9.702 1.00 0.00 N ATOM 100 CA ARG A 8 10.786 15.254 9.867 1.00 0.00 C ATOM 101 C ARG A 8 10.175 15.842 8.610 1.00 0.00 C ATOM 102 O ARG A 8 9.026 15.574 8.272 1.00 0.00 O ATOM 103 CB ARG A 8 10.505 16.185 11.040 1.00 0.00 C ATOM 104 CG ARG A 8 10.464 15.486 12.390 1.00 0.00 C ATOM 105 CD ARG A 8 9.279 14.536 12.485 1.00 0.00 C ATOM 106 NE ARG A 8 9.202 13.870 13.786 1.00 0.00 N ATOM 107 CZ ARG A 8 8.228 13.024 14.134 1.00 0.00 C ATOM 108 NH1 ARG A 8 7.242 12.740 13.286 1.00 0.00 N ATOM 109 NH2 ARG A 8 8.240 12.459 15.337 1.00 0.00 N ATOM 110 H ARG A 8 12.833 15.513 10.336 1.00 0.00 H ATOM 111 HA ARG A 8 10.346 14.288 10.056 1.00 0.00 H ATOM 112 HB2 ARG A 8 11.281 16.938 11.069 1.00 0.00 H ATOM 113 HB3 ARG A 8 9.555 16.669 10.874 1.00 0.00 H ATOM 114 HG2 ARG A 8 11.376 14.923 12.521 1.00 0.00 H ATOM 115 HG3 ARG A 8 10.382 16.230 13.168 1.00 0.00 H ATOM 116 HD2 ARG A 8 8.371 15.098 12.327 1.00 0.00 H ATOM 117 HD3 ARG A 8 9.374 13.786 11.713 1.00 0.00 H ATOM 118 HE ARG A 8 9.912 14.061 14.434 1.00 0.00 H ATOM 119 HH11 ARG A 8 7.223 13.160 12.379 1.00 0.00 H ATOM 120 HH12 ARG A 8 6.518 12.105 13.557 1.00 0.00 H ATOM 121 HH21 ARG A 8 8.976 12.668 15.981 1.00 0.00 H ATOM 122 HH22 ARG A 8 7.512 11.825 15.600 1.00 0.00 H ATOM 123 N LYS A 9 10.961 16.653 7.931 1.00 0.00 N ATOM 124 CA LYS A 9 10.509 17.303 6.706 1.00 0.00 C ATOM 125 C LYS A 9 10.374 16.299 5.561 1.00 0.00 C ATOM 126 O LYS A 9 9.335 16.234 4.904 1.00 0.00 O ATOM 127 CB LYS A 9 11.474 18.428 6.311 1.00 0.00 C ATOM 128 CG LYS A 9 11.057 19.184 5.056 1.00 0.00 C ATOM 129 CD LYS A 9 9.697 19.852 5.219 1.00 0.00 C ATOM 130 CE LYS A 9 9.707 20.892 6.332 1.00 0.00 C ATOM 131 NZ LYS A 9 10.674 21.995 6.061 1.00 0.00 N ATOM 132 H LYS A 9 11.872 16.818 8.268 1.00 0.00 H ATOM 133 HA LYS A 9 9.538 17.732 6.904 1.00 0.00 H ATOM 134 HB2 LYS A 9 11.537 19.134 7.125 1.00 0.00 H ATOM 135 HB3 LYS A 9 12.452 18.004 6.139 1.00 0.00 H ATOM 136 HG2 LYS A 9 11.794 19.944 4.845 1.00 0.00 H ATOM 137 HG3 LYS A 9 11.009 18.490 4.230 1.00 0.00 H ATOM 138 HD2 LYS A 9 9.432 20.337 4.292 1.00 0.00 H ATOM 139 HD3 LYS A 9 8.962 19.096 5.453 1.00 0.00 H ATOM 140 HE2 LYS A 9 8.716 21.311 6.424 1.00 0.00 H ATOM 141 HE3 LYS A 9 9.978 20.407 7.258 1.00 0.00 H ATOM 142 HZ1 LYS A 9 10.598 22.303 5.071 1.00 0.00 H ATOM 143 HZ2 LYS A 9 11.646 21.669 6.237 1.00 0.00 H ATOM 144 HZ3 LYS A 9 10.474 22.805 6.682 1.00 0.00 H ATOM 145 N ASP A 10 11.435 15.530 5.323 1.00 0.00 N ATOM 146 CA ASP A 10 11.451 14.538 4.246 1.00 0.00 C ATOM 147 C ASP A 10 10.591 13.312 4.572 1.00 0.00 C ATOM 148 O ASP A 10 10.050 12.677 3.665 1.00 0.00 O ATOM 149 CB ASP A 10 12.890 14.098 3.951 1.00 0.00 C ATOM 150 CG ASP A 10 13.832 15.277 3.780 1.00 0.00 C ATOM 151 OD1 ASP A 10 13.642 16.116 2.898 1.00 0.00 O ATOM 152 H ASP A 10 12.235 15.639 5.879 1.00 0.00 H ATOM 153 HA ASP A 10 11.050 15.011 3.362 1.00 0.00 H ATOM 154 HB2 ASP A 10 13.248 13.491 4.769 1.00 0.00 H ATOM 155 HB3 ASP A 10 12.903 13.515 3.042 1.00 0.00 H ATOM 156 N LYS A 11 10.475 12.973 5.859 1.00 0.00 N ATOM 157 CA LYS A 11 9.691 11.812 6.275 1.00 0.00 C ATOM 158 C LYS A 11 8.207 12.150 6.336 1.00 0.00 C ATOM 159 O LYS A 11 7.396 11.523 5.654 1.00 0.00 O ATOM 160 CB LYS A 11 10.179 11.293 7.639 1.00 0.00 C ATOM 161 CG LYS A 11 9.562 9.961 8.062 1.00 0.00 C ATOM 162 CD LYS A 11 8.089 10.099 8.427 1.00 0.00 C ATOM 163 CE LYS A 11 7.223 9.122 7.642 1.00 0.00 C ATOM 164 NZ LYS A 11 6.005 9.754 7.133 1.00 0.00 N ATOM 165 H LYS A 11 10.927 13.511 6.543 1.00 0.00 H ATOM 166 HA LYS A 11 9.836 11.038 5.538 1.00 0.00 H ATOM 167 HB2 LYS A 11 11.251 11.169 7.598 1.00 0.00 H ATOM 168 HB3 LYS A 11 9.942 12.029 8.394 1.00 0.00 H ATOM 169 HG2 LYS A 11 9.654 9.261 7.246 1.00 0.00 H ATOM 170 HG3 LYS A 11 10.102 9.585 8.919 1.00 0.00 H ATOM 171 HD2 LYS A 11 7.972 9.895 9.481 1.00 0.00 H ATOM 172 HD3 LYS A 11 7.764 11.105 8.219 1.00 0.00 H ATOM 173 HE2 LYS A 11 7.795 8.743 6.808 1.00 0.00 H ATOM 174 HE3 LYS A 11 6.948 8.304 8.291 1.00 0.00 H ATOM 175 HZ1 LYS A 11 5.785 10.649 7.468 1.00 0.00 H ATOM 176 N ARG A 12 7.860 13.142 7.158 1.00 0.00 N ATOM 177 CA ARG A 12 6.470 13.559 7.315 1.00 0.00 C ATOM 178 C ARG A 12 5.865 13.912 5.964 1.00 0.00 C ATOM 179 O ARG A 12 4.684 13.667 5.722 1.00 0.00 O ATOM 180 CB ARG A 12 6.363 14.750 8.272 1.00 0.00 C ATOM 181 CG ARG A 12 4.934 15.098 8.665 1.00 0.00 C ATOM 182 CD ARG A 12 4.252 13.938 9.379 1.00 0.00 C ATOM 183 NE ARG A 12 2.893 14.274 9.809 1.00 0.00 N ATOM 184 CZ ARG A 12 2.602 15.161 10.767 1.00 0.00 C ATOM 185 NH1 ARG A 12 3.573 15.775 11.441 1.00 0.00 N ATOM 186 NH2 ARG A 12 1.333 15.423 11.062 1.00 0.00 N ATOM 187 H ARG A 12 8.557 13.598 7.672 1.00 0.00 H ATOM 188 HA ARG A 12 5.923 12.726 7.730 1.00 0.00 H ATOM 189 HB2 ARG A 12 6.914 14.524 9.173 1.00 0.00 H ATOM 190 HB3 ARG A 12 6.803 15.616 7.800 1.00 0.00 H ATOM 191 HG2 ARG A 12 4.951 15.953 9.324 1.00 0.00 H ATOM 192 HG3 ARG A 12 4.375 15.339 7.773 1.00 0.00 H ATOM 193 HD2 ARG A 12 4.206 13.096 8.706 1.00 0.00 H ATOM 194 HD3 ARG A 12 4.838 13.673 10.247 1.00 0.00 H ATOM 195 HE ARG A 12 2.154 13.822 9.350 1.00 0.00 H ATOM 196 HH11 ARG A 12 4.531 15.575 11.238 1.00 0.00 H ATOM 197 HH12 ARG A 12 3.343 16.438 12.154 1.00 0.00 H ATOM 198 HH21 ARG A 12 0.598 14.958 10.568 1.00 0.00 H ATOM 199 HH22 ARG A 12 1.112 16.086 11.777 1.00 0.00 H ATOM 200 N LYS A 13 6.682 14.476 5.080 1.00 0.00 N ATOM 201 CA LYS A 13 6.204 14.840 3.750 1.00 0.00 C ATOM 202 C LYS A 13 6.000 13.596 2.896 1.00 0.00 C ATOM 203 O LYS A 13 4.982 13.465 2.214 1.00 0.00 O ATOM 204 CB LYS A 13 7.171 15.810 3.063 1.00 0.00 C ATOM 205 CG LYS A 13 6.681 16.305 1.711 1.00 0.00 C ATOM 206 CD LYS A 13 7.680 17.257 1.070 1.00 0.00 C ATOM 207 CE LYS A 13 7.177 17.784 -0.266 1.00 0.00 C ATOM 208 NZ LYS A 13 6.943 16.689 -1.250 1.00 0.00 N ATOM 209 H LYS A 13 7.625 14.639 5.324 1.00 0.00 H ATOM 210 HA LYS A 13 5.249 15.318 3.873 1.00 0.00 H ATOM 211 HB2 LYS A 13 7.318 16.667 3.703 1.00 0.00 H ATOM 212 HB3 LYS A 13 8.118 15.313 2.918 1.00 0.00 H ATOM 213 HG2 LYS A 13 6.538 15.458 1.058 1.00 0.00 H ATOM 214 HG3 LYS A 13 5.741 16.821 1.846 1.00 0.00 H ATOM 215 HD2 LYS A 13 7.843 18.092 1.735 1.00 0.00 H ATOM 216 HD3 LYS A 13 8.611 16.732 0.913 1.00 0.00 H ATOM 217 HE2 LYS A 13 6.250 18.312 -0.104 1.00 0.00 H ATOM 218 HE3 LYS A 13 7.913 18.466 -0.668 1.00 0.00 H ATOM 219 HZ1 LYS A 13 6.028 16.229 -1.062 1.00 0.00 H ATOM 220 HZ2 LYS A 13 7.698 15.976 -1.181 1.00 0.00 H ATOM 221 HZ3 LYS A 13 6.933 17.074 -2.216 1.00 0.00 H ATOM 222 N LEU A 14 6.960 12.676 2.958 1.00 0.00 N ATOM 223 CA LEU A 14 6.877 11.425 2.212 1.00 0.00 C ATOM 224 C LEU A 14 5.610 10.653 2.599 1.00 0.00 C ATOM 225 O LEU A 14 5.084 9.873 1.803 1.00 0.00 O ATOM 226 CB LEU A 14 8.133 10.576 2.471 1.00 0.00 C ATOM 227 CG LEU A 14 8.198 9.225 1.746 1.00 0.00 C ATOM 228 CD1 LEU A 14 9.627 8.701 1.736 1.00 0.00 C ATOM 229 CD2 LEU A 14 7.276 8.207 2.408 1.00 0.00 C ATOM 230 H LEU A 14 7.738 12.835 3.534 1.00 0.00 H ATOM 231 HA LEU A 14 6.828 11.669 1.161 1.00 0.00 H ATOM 232 HB2 LEU A 14 8.994 11.157 2.173 1.00 0.00 H ATOM 233 HB3 LEU A 14 8.200 10.391 3.533 1.00 0.00 H ATOM 234 HG LEU A 14 7.880 9.354 0.722 1.00 0.00 H ATOM 235 HD11 LEU A 14 9.683 7.821 1.112 1.00 0.00 H ATOM 236 HD12 LEU A 14 9.925 8.448 2.743 1.00 0.00 H ATOM 237 HD13 LEU A 14 10.287 9.462 1.346 1.00 0.00 H ATOM 238 HD21 LEU A 14 7.826 7.300 2.609 1.00 0.00 H ATOM 239 HD22 LEU A 14 6.450 7.987 1.748 1.00 0.00 H ATOM 240 HD23 LEU A 14 6.899 8.611 3.336 1.00 0.00 H ATOM 241 N ASP A 15 5.118 10.886 3.823 1.00 0.00 N ATOM 242 CA ASP A 15 3.911 10.213 4.306 1.00 0.00 C ATOM 243 C ASP A 15 2.656 11.003 3.938 1.00 0.00 C ATOM 244 O ASP A 15 1.736 10.470 3.317 1.00 0.00 O ATOM 245 CB ASP A 15 3.980 10.003 5.824 1.00 0.00 C ATOM 246 CG ASP A 15 5.192 9.187 6.242 1.00 0.00 C ATOM 247 OD1 ASP A 15 5.394 8.069 5.765 1.00 0.00 O ATOM 248 H ASP A 15 5.571 11.535 4.409 1.00 0.00 H ATOM 249 HA ASP A 15 3.861 9.248 3.824 1.00 0.00 H ATOM 250 HB2 ASP A 15 4.031 10.965 6.313 1.00 0.00 H ATOM 251 HB3 ASP A 15 3.090 9.484 6.151 1.00 0.00 H HETATM 252 N NH2 A 16 2.615 12.276 4.321 1.00 0.00 N HETATM 253 HN1 NH2 A 16 3.382 12.639 4.812 1.00 0.00 H HETATM 254 HN2 NH2 A 16 1.819 12.802 4.094 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 18 ATOM 1 N PHE A 1 17.863 15.914 11.863 1.00 0.00 N ATOM 2 CA PHE A 1 18.505 14.666 12.266 1.00 0.00 C ATOM 3 C PHE A 1 19.808 14.451 11.499 1.00 0.00 C ATOM 4 O PHE A 1 19.903 14.781 10.316 1.00 0.00 O ATOM 5 CB PHE A 1 17.568 13.474 12.045 1.00 0.00 C ATOM 6 CG PHE A 1 16.316 13.515 12.879 1.00 0.00 C ATOM 7 CD1 PHE A 1 15.410 14.558 12.752 1.00 0.00 C ATOM 8 CD2 PHE A 1 16.047 12.509 13.794 1.00 0.00 C ATOM 9 CE1 PHE A 1 14.263 14.595 13.521 1.00 0.00 C ATOM 10 CE2 PHE A 1 14.901 12.542 14.565 1.00 0.00 C ATOM 11 CZ PHE A 1 14.008 13.586 14.428 1.00 0.00 C ATOM 12 H1 PHE A 1 18.297 16.766 12.076 1.00 0.00 H ATOM 13 HA PHE A 1 18.733 14.741 13.318 1.00 0.00 H ATOM 14 HB2 PHE A 1 17.273 13.447 11.008 1.00 0.00 H ATOM 15 HB3 PHE A 1 18.097 12.563 12.284 1.00 0.00 H ATOM 16 HD1 PHE A 1 15.607 15.346 12.042 1.00 0.00 H ATOM 17 HD2 PHE A 1 16.745 11.691 13.902 1.00 0.00 H ATOM 18 HE1 PHE A 1 13.567 15.413 13.412 1.00 0.00 H ATOM 19 HE2 PHE A 1 14.704 11.751 15.274 1.00 0.00 H ATOM 20 HZ PHE A 1 13.112 13.614 15.030 1.00 0.00 H ATOM 21 N GLY A 2 20.809 13.900 12.185 1.00 0.00 N ATOM 22 CA GLY A 2 22.100 13.651 11.560 1.00 0.00 C ATOM 23 C GLY A 2 22.012 12.715 10.366 1.00 0.00 C ATOM 24 O GLY A 2 22.563 13.007 9.304 1.00 0.00 O ATOM 25 H GLY A 2 20.672 13.662 13.125 1.00 0.00 H ATOM 26 HA2 GLY A 2 22.514 14.593 11.233 1.00 0.00 H ATOM 27 HA3 GLY A 2 22.762 13.217 12.294 1.00 0.00 H ATOM 28 N GLY A 3 21.320 11.587 10.542 1.00 0.00 N ATOM 29 CA GLY A 3 21.177 10.621 9.466 1.00 0.00 C ATOM 30 C GLY A 3 20.042 10.955 8.512 1.00 0.00 C ATOM 31 O GLY A 3 20.237 10.981 7.296 1.00 0.00 O ATOM 32 H GLY A 3 20.905 11.409 11.413 1.00 0.00 H ATOM 33 HA2 GLY A 3 22.100 10.584 8.906 1.00 0.00 H ATOM 34 HA3 GLY A 3 20.994 9.647 9.896 1.00 0.00 H ATOM 35 N PHE A 4 18.853 11.200 9.066 1.00 0.00 N ATOM 36 CA PHE A 4 17.676 11.523 8.262 1.00 0.00 C ATOM 37 C PHE A 4 17.225 12.964 8.513 1.00 0.00 C ATOM 38 O PHE A 4 16.182 13.206 9.126 1.00 0.00 O ATOM 39 CB PHE A 4 16.533 10.540 8.562 1.00 0.00 C ATOM 40 CG PHE A 4 16.838 9.109 8.198 1.00 0.00 C ATOM 41 CD1 PHE A 4 17.929 8.450 8.748 1.00 0.00 C ATOM 42 CD2 PHE A 4 16.030 8.423 7.304 1.00 0.00 C ATOM 43 CE1 PHE A 4 18.206 7.138 8.412 1.00 0.00 C ATOM 44 CE2 PHE A 4 16.304 7.111 6.966 1.00 0.00 C ATOM 45 CZ PHE A 4 17.393 6.468 7.521 1.00 0.00 C ATOM 46 H PHE A 4 18.764 11.157 10.041 1.00 0.00 H ATOM 47 HA PHE A 4 17.953 11.427 7.223 1.00 0.00 H ATOM 48 HB2 PHE A 4 16.310 10.571 9.617 1.00 0.00 H ATOM 49 HB3 PHE A 4 15.657 10.843 8.006 1.00 0.00 H ATOM 50 HD1 PHE A 4 18.566 8.970 9.447 1.00 0.00 H ATOM 51 HD2 PHE A 4 15.178 8.923 6.870 1.00 0.00 H ATOM 52 HE1 PHE A 4 19.059 6.638 8.848 1.00 0.00 H ATOM 53 HE2 PHE A 4 15.666 6.588 6.268 1.00 0.00 H ATOM 54 HZ PHE A 4 17.608 5.443 7.257 1.00 0.00 H ATOM 55 N THR A 5 18.023 13.918 8.033 1.00 0.00 N ATOM 56 CA THR A 5 17.723 15.343 8.196 1.00 0.00 C ATOM 57 C THR A 5 16.512 15.745 7.379 1.00 0.00 C ATOM 58 O THR A 5 15.671 16.530 7.822 1.00 0.00 O ATOM 59 CB THR A 5 18.926 16.240 7.817 1.00 0.00 C ATOM 60 OG1 THR A 5 18.606 17.617 8.051 1.00 0.00 O ATOM 61 CG2 THR A 5 19.319 16.051 6.356 1.00 0.00 C ATOM 62 H THR A 5 18.829 13.657 7.554 1.00 0.00 H ATOM 63 HA THR A 5 17.494 15.502 9.219 1.00 0.00 H ATOM 64 HB THR A 5 19.767 15.966 8.436 1.00 0.00 H ATOM 65 HG1 THR A 5 18.728 17.821 8.981 1.00 0.00 H ATOM 66 HG21 THR A 5 18.648 16.617 5.727 1.00 0.00 H ATOM 67 HG22 THR A 5 19.258 15.005 6.098 1.00 0.00 H ATOM 68 HG23 THR A 5 20.330 16.400 6.209 1.00 0.00 H ATOM 69 N LYS A 6 16.430 15.176 6.196 1.00 0.00 N ATOM 70 CA LYS A 6 15.318 15.426 5.286 1.00 0.00 C ATOM 71 C LYS A 6 14.058 14.687 5.752 1.00 0.00 C ATOM 72 O LYS A 6 13.009 14.795 5.117 1.00 0.00 O ATOM 73 CB LYS A 6 15.663 14.973 3.862 1.00 0.00 C ATOM 74 CG LYS A 6 15.605 13.463 3.680 1.00 0.00 C ATOM 75 CD LYS A 6 14.946 13.087 2.364 1.00 0.00 C ATOM 76 CE LYS A 6 14.318 11.703 2.434 1.00 0.00 C ATOM 77 NZ LYS A 6 13.215 11.649 3.400 1.00 0.00 N ATOM 78 H LYS A 6 17.132 14.553 5.941 1.00 0.00 H ATOM 79 HA LYS A 6 15.121 16.487 5.281 1.00 0.00 H ATOM 80 HB2 LYS A 6 14.964 15.426 3.174 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.661 15.306 3.621 1.00 0.00 H ATOM 82 HG2 LYS A 6 16.611 13.071 3.691 1.00 0.00 H ATOM 83 HG3 LYS A 6 15.041 13.031 4.493 1.00 0.00 H ATOM 84 HD2 LYS A 6 14.176 13.810 2.138 1.00 0.00 H ATOM 85 HD3 LYS A 6 15.692 13.095 1.583 1.00 0.00 H ATOM 86 HE2 LYS A 6 13.941 11.443 1.456 1.00 0.00 H ATOM 87 HE3 LYS A 6 15.076 10.992 2.727 1.00 0.00 H ATOM 88 HZ1 LYS A 6 13.443 11.717 4.351 1.00 0.00 H ATOM 89 N ALA A 7 14.172 13.918 6.847 1.00 0.00 N ATOM 90 CA ALA A 7 13.039 13.152 7.366 1.00 0.00 C ATOM 91 C ALA A 7 11.813 14.022 7.557 1.00 0.00 C ATOM 92 O ALA A 7 10.695 13.574 7.326 1.00 0.00 O ATOM 93 CB ALA A 7 13.404 12.451 8.666 1.00 0.00 C ATOM 94 H ALA A 7 15.040 13.854 7.305 1.00 0.00 H ATOM 95 HA ALA A 7 12.799 12.405 6.633 1.00 0.00 H ATOM 96 HB1 ALA A 7 14.128 11.678 8.467 1.00 0.00 H ATOM 97 HB2 ALA A 7 12.518 12.012 9.099 1.00 0.00 H ATOM 98 HB3 ALA A 7 13.823 13.168 9.356 1.00 0.00 H ATOM 99 N ARG A 8 12.025 15.268 7.951 1.00 0.00 N ATOM 100 CA ARG A 8 10.919 16.201 8.133 1.00 0.00 C ATOM 101 C ARG A 8 10.087 16.289 6.859 1.00 0.00 C ATOM 102 O ARG A 8 8.860 16.395 6.907 1.00 0.00 O ATOM 103 CB ARG A 8 11.454 17.579 8.505 1.00 0.00 C ATOM 104 CG ARG A 8 11.877 17.693 9.963 1.00 0.00 C ATOM 105 CD ARG A 8 12.597 19.004 10.247 1.00 0.00 C ATOM 106 NE ARG A 8 13.958 19.016 9.707 1.00 0.00 N ATOM 107 CZ ARG A 8 14.803 20.042 9.837 1.00 0.00 C ATOM 108 NH1 ARG A 8 14.421 21.159 10.452 1.00 0.00 N ATOM 109 NH2 ARG A 8 16.037 19.952 9.350 1.00 0.00 N ATOM 110 H ARG A 8 12.945 15.576 8.102 1.00 0.00 H ATOM 111 HA ARG A 8 10.294 15.825 8.928 1.00 0.00 H ATOM 112 HB2 ARG A 8 12.312 17.790 7.881 1.00 0.00 H ATOM 113 HB3 ARG A 8 10.688 18.312 8.309 1.00 0.00 H ATOM 114 HG2 ARG A 8 10.998 17.637 10.587 1.00 0.00 H ATOM 115 HG3 ARG A 8 12.538 16.872 10.200 1.00 0.00 H ATOM 116 HD2 ARG A 8 12.036 19.811 9.800 1.00 0.00 H ATOM 117 HD3 ARG A 8 12.643 19.149 11.316 1.00 0.00 H ATOM 118 HE ARG A 8 14.264 18.213 9.235 1.00 0.00 H ATOM 119 HH11 ARG A 8 13.494 21.237 10.821 1.00 0.00 H ATOM 120 HH12 ARG A 8 15.059 21.923 10.544 1.00 0.00 H ATOM 121 HH21 ARG A 8 16.333 19.117 8.886 1.00 0.00 H ATOM 122 HH22 ARG A 8 16.672 20.719 9.449 1.00 0.00 H ATOM 123 N LYS A 9 10.771 16.216 5.721 1.00 0.00 N ATOM 124 CA LYS A 9 10.109 16.257 4.419 1.00 0.00 C ATOM 125 C LYS A 9 9.482 14.902 4.103 1.00 0.00 C ATOM 126 O LYS A 9 8.313 14.824 3.732 1.00 0.00 O ATOM 127 CB LYS A 9 11.092 16.644 3.309 1.00 0.00 C ATOM 128 CG LYS A 9 11.596 18.076 3.397 1.00 0.00 C ATOM 129 CD LYS A 9 10.452 19.078 3.346 1.00 0.00 C ATOM 130 CE LYS A 9 10.961 20.510 3.248 1.00 0.00 C ATOM 131 NZ LYS A 9 11.855 20.871 4.385 1.00 0.00 N ATOM 132 H LYS A 9 11.748 16.106 5.765 1.00 0.00 H ATOM 133 HA LYS A 9 9.325 16.999 4.470 1.00 0.00 H ATOM 134 HB2 LYS A 9 11.945 15.984 3.356 1.00 0.00 H ATOM 135 HB3 LYS A 9 10.604 16.516 2.353 1.00 0.00 H ATOM 136 HG2 LYS A 9 12.131 18.202 4.327 1.00 0.00 H ATOM 137 HG3 LYS A 9 12.263 18.262 2.567 1.00 0.00 H ATOM 138 HD2 LYS A 9 9.839 18.866 2.483 1.00 0.00 H ATOM 139 HD3 LYS A 9 9.859 18.978 4.244 1.00 0.00 H ATOM 140 HE2 LYS A 9 11.508 20.621 2.324 1.00 0.00 H ATOM 141 HE3 LYS A 9 10.112 21.178 3.243 1.00 0.00 H ATOM 142 HZ1 LYS A 9 12.028 21.897 4.390 1.00 0.00 H ATOM 143 HZ2 LYS A 9 12.766 20.379 4.295 1.00 0.00 H ATOM 144 HZ3 LYS A 9 11.415 20.601 5.288 1.00 0.00 H ATOM 145 N ASP A 10 10.267 13.836 4.266 1.00 0.00 N ATOM 146 CA ASP A 10 9.789 12.479 4.008 1.00 0.00 C ATOM 147 C ASP A 10 8.604 12.122 4.910 1.00 0.00 C ATOM 148 O ASP A 10 7.678 11.433 4.478 1.00 0.00 O ATOM 149 CB ASP A 10 10.922 11.460 4.189 1.00 0.00 C ATOM 150 CG ASP A 10 11.934 11.505 3.054 1.00 0.00 C ATOM 151 OD1 ASP A 10 11.567 11.400 1.882 1.00 0.00 O ATOM 152 H ASP A 10 11.189 13.965 4.573 1.00 0.00 H ATOM 153 HA ASP A 10 9.456 12.445 2.981 1.00 0.00 H ATOM 154 HB2 ASP A 10 11.438 11.666 5.115 1.00 0.00 H ATOM 155 HB3 ASP A 10 10.500 10.465 4.233 1.00 0.00 H ATOM 156 N LYS A 11 8.625 12.608 6.156 1.00 0.00 N ATOM 157 CA LYS A 11 7.542 12.347 7.097 1.00 0.00 C ATOM 158 C LYS A 11 6.459 13.398 6.913 1.00 0.00 C ATOM 159 O LYS A 11 5.282 13.071 6.772 1.00 0.00 O ATOM 160 CB LYS A 11 8.051 12.369 8.547 1.00 0.00 C ATOM 161 CG LYS A 11 7.234 11.510 9.513 1.00 0.00 C ATOM 162 CD LYS A 11 5.735 11.766 9.396 1.00 0.00 C ATOM 163 CE LYS A 11 5.354 13.185 9.801 1.00 0.00 C ATOM 164 NZ LYS A 11 4.185 13.666 9.060 1.00 0.00 N ATOM 165 H LYS A 11 9.376 13.174 6.440 1.00 0.00 H ATOM 166 HA LYS A 11 7.131 11.374 6.876 1.00 0.00 H ATOM 167 HB2 LYS A 11 9.070 12.011 8.561 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.034 13.388 8.905 1.00 0.00 H ATOM 169 HG2 LYS A 11 7.424 10.469 9.298 1.00 0.00 H ATOM 170 HG3 LYS A 11 7.548 11.730 10.523 1.00 0.00 H ATOM 171 HD2 LYS A 11 5.433 11.602 8.374 1.00 0.00 H ATOM 172 HD3 LYS A 11 5.215 11.069 10.038 1.00 0.00 H ATOM 173 HE2 LYS A 11 5.130 13.197 10.857 1.00 0.00 H ATOM 174 HE3 LYS A 11 6.189 13.841 9.603 1.00 0.00 H ATOM 175 HZ1 LYS A 11 4.274 14.520 8.588 1.00 0.00 H ATOM 176 N ARG A 12 6.881 14.664 6.893 1.00 0.00 N ATOM 177 CA ARG A 12 5.970 15.788 6.708 1.00 0.00 C ATOM 178 C ARG A 12 5.021 15.499 5.550 1.00 0.00 C ATOM 179 O ARG A 12 3.825 15.787 5.627 1.00 0.00 O ATOM 180 CB ARG A 12 6.776 17.071 6.450 1.00 0.00 C ATOM 181 CG ARG A 12 5.961 18.358 6.501 1.00 0.00 C ATOM 182 CD ARG A 12 5.093 18.540 5.264 1.00 0.00 C ATOM 183 NE ARG A 12 4.396 19.827 5.268 1.00 0.00 N ATOM 184 CZ ARG A 12 5.004 21.012 5.153 1.00 0.00 C ATOM 185 NH1 ARG A 12 6.320 21.086 4.963 1.00 0.00 N ATOM 186 NH2 ARG A 12 4.287 22.128 5.211 1.00 0.00 N ATOM 187 H ARG A 12 7.838 14.844 6.991 1.00 0.00 H ATOM 188 HA ARG A 12 5.395 15.906 7.614 1.00 0.00 H ATOM 189 HB2 ARG A 12 7.557 17.143 7.192 1.00 0.00 H ATOM 190 HB3 ARG A 12 7.232 17.001 5.473 1.00 0.00 H ATOM 191 HG2 ARG A 12 5.323 18.331 7.372 1.00 0.00 H ATOM 192 HG3 ARG A 12 6.639 19.195 6.580 1.00 0.00 H ATOM 193 HD2 ARG A 12 5.719 18.484 4.388 1.00 0.00 H ATOM 194 HD3 ARG A 12 4.361 17.750 5.233 1.00 0.00 H ATOM 195 HE ARG A 12 3.423 19.809 5.379 1.00 0.00 H ATOM 196 HH11 ARG A 12 6.868 20.252 4.904 1.00 0.00 H ATOM 197 HH12 ARG A 12 6.763 21.979 4.878 1.00 0.00 H ATOM 198 HH21 ARG A 12 3.296 22.080 5.342 1.00 0.00 H ATOM 199 HH22 ARG A 12 4.736 23.018 5.127 1.00 0.00 H ATOM 200 N LYS A 13 5.560 14.896 4.489 1.00 0.00 N ATOM 201 CA LYS A 13 4.749 14.541 3.326 1.00 0.00 C ATOM 202 C LYS A 13 3.954 13.276 3.603 1.00 0.00 C ATOM 203 O LYS A 13 2.769 13.190 3.280 1.00 0.00 O ATOM 204 CB LYS A 13 5.614 14.362 2.073 1.00 0.00 C ATOM 205 CG LYS A 13 6.367 15.616 1.649 1.00 0.00 C ATOM 206 CD LYS A 13 5.431 16.791 1.410 1.00 0.00 C ATOM 207 CE LYS A 13 6.184 18.005 0.883 1.00 0.00 C ATOM 208 NZ LYS A 13 7.293 18.421 1.790 1.00 0.00 N ATOM 209 H LYS A 13 6.522 14.666 4.502 1.00 0.00 H ATOM 210 HA LYS A 13 4.052 15.344 3.164 1.00 0.00 H ATOM 211 HB2 LYS A 13 6.338 13.583 2.261 1.00 0.00 H ATOM 212 HB3 LYS A 13 4.979 14.057 1.254 1.00 0.00 H ATOM 213 HG2 LYS A 13 7.066 15.884 2.425 1.00 0.00 H ATOM 214 HG3 LYS A 13 6.905 15.406 0.736 1.00 0.00 H ATOM 215 HD2 LYS A 13 4.683 16.502 0.688 1.00 0.00 H ATOM 216 HD3 LYS A 13 4.952 17.053 2.343 1.00 0.00 H ATOM 217 HE2 LYS A 13 6.596 17.764 -0.085 1.00 0.00 H ATOM 218 HE3 LYS A 13 5.489 18.825 0.780 1.00 0.00 H ATOM 219 HZ1 LYS A 13 6.947 18.498 2.768 1.00 0.00 H ATOM 220 HZ2 LYS A 13 7.670 19.344 1.494 1.00 0.00 H ATOM 221 HZ3 LYS A 13 8.062 17.720 1.760 1.00 0.00 H ATOM 222 N LEU A 14 4.606 12.305 4.228 1.00 0.00 N ATOM 223 CA LEU A 14 3.952 11.052 4.580 1.00 0.00 C ATOM 224 C LEU A 14 2.682 11.318 5.396 1.00 0.00 C ATOM 225 O LEU A 14 1.739 10.525 5.361 1.00 0.00 O ATOM 226 CB LEU A 14 4.914 10.161 5.376 1.00 0.00 C ATOM 227 CG LEU A 14 4.340 8.824 5.857 1.00 0.00 C ATOM 228 CD1 LEU A 14 3.966 7.941 4.675 1.00 0.00 C ATOM 229 CD2 LEU A 14 5.337 8.116 6.764 1.00 0.00 C ATOM 230 H LEU A 14 5.545 12.442 4.476 1.00 0.00 H ATOM 231 HA LEU A 14 3.680 10.548 3.664 1.00 0.00 H ATOM 232 HB2 LEU A 14 5.772 9.954 4.753 1.00 0.00 H ATOM 233 HB3 LEU A 14 5.248 10.714 6.242 1.00 0.00 H ATOM 234 HG LEU A 14 3.443 9.011 6.429 1.00 0.00 H ATOM 235 HD11 LEU A 14 3.158 8.399 4.125 1.00 0.00 H ATOM 236 HD12 LEU A 14 3.653 6.972 5.035 1.00 0.00 H ATOM 237 HD13 LEU A 14 4.822 7.825 4.027 1.00 0.00 H ATOM 238 HD21 LEU A 14 5.532 8.728 7.632 1.00 0.00 H ATOM 239 HD22 LEU A 14 6.259 7.950 6.226 1.00 0.00 H ATOM 240 HD23 LEU A 14 4.928 7.167 7.077 1.00 0.00 H ATOM 241 N ASP A 15 2.665 12.439 6.129 1.00 0.00 N ATOM 242 CA ASP A 15 1.511 12.805 6.951 1.00 0.00 C ATOM 243 C ASP A 15 0.460 13.537 6.120 1.00 0.00 C ATOM 244 O ASP A 15 -0.709 13.150 6.099 1.00 0.00 O ATOM 245 CB ASP A 15 1.944 13.674 8.140 1.00 0.00 C ATOM 246 CG ASP A 15 3.025 13.011 8.977 1.00 0.00 C ATOM 247 OD1 ASP A 15 2.823 11.925 9.523 1.00 0.00 O ATOM 248 H ASP A 15 3.447 13.037 6.109 1.00 0.00 H ATOM 249 HA ASP A 15 1.075 11.891 7.329 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.327 14.614 7.771 1.00 0.00 H ATOM 251 HB3 ASP A 15 1.089 13.862 8.772 1.00 0.00 H HETATM 252 N NH2 A 16 0.874 14.596 5.429 1.00 0.00 N HETATM 253 HN1 NH2 A 16 1.819 14.851 5.491 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.218 15.079 4.885 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 19 ATOM 1 N PHE A 1 25.176 10.259 9.728 1.00 0.00 N ATOM 2 CA PHE A 1 23.752 10.466 9.974 1.00 0.00 C ATOM 3 C PHE A 1 23.080 11.126 8.770 1.00 0.00 C ATOM 4 O PHE A 1 23.598 12.098 8.217 1.00 0.00 O ATOM 5 CB PHE A 1 23.541 11.328 11.223 1.00 0.00 C ATOM 6 CG PHE A 1 23.971 10.676 12.510 1.00 0.00 C ATOM 7 CD1 PHE A 1 25.273 10.234 12.682 1.00 0.00 C ATOM 8 CD2 PHE A 1 23.068 10.507 13.548 1.00 0.00 C ATOM 9 CE1 PHE A 1 25.667 9.639 13.864 1.00 0.00 C ATOM 10 CE2 PHE A 1 23.456 9.912 14.733 1.00 0.00 C ATOM 11 CZ PHE A 1 24.758 9.476 14.890 1.00 0.00 C ATOM 12 H1 PHE A 1 25.564 9.374 9.879 1.00 0.00 H ATOM 13 HA PHE A 1 23.303 9.498 10.137 1.00 0.00 H ATOM 14 HB2 PHE A 1 24.102 12.244 11.116 1.00 0.00 H ATOM 15 HB3 PHE A 1 22.493 11.566 11.307 1.00 0.00 H ATOM 16 HD1 PHE A 1 25.986 10.361 11.882 1.00 0.00 H ATOM 17 HD2 PHE A 1 22.050 10.847 13.426 1.00 0.00 H ATOM 18 HE1 PHE A 1 26.684 9.299 13.983 1.00 0.00 H ATOM 19 HE2 PHE A 1 22.744 9.785 15.535 1.00 0.00 H ATOM 20 HZ PHE A 1 25.065 9.011 15.815 1.00 0.00 H ATOM 21 N GLY A 2 21.924 10.589 8.368 1.00 0.00 N ATOM 22 CA GLY A 2 21.200 11.136 7.228 1.00 0.00 C ATOM 23 C GLY A 2 20.436 12.410 7.558 1.00 0.00 C ATOM 24 O GLY A 2 20.926 13.262 8.305 1.00 0.00 O ATOM 25 H GLY A 2 21.562 9.814 8.846 1.00 0.00 H ATOM 26 HA2 GLY A 2 21.907 11.350 6.441 1.00 0.00 H ATOM 27 HA3 GLY A 2 20.501 10.394 6.873 1.00 0.00 H ATOM 28 N GLY A 3 19.231 12.537 6.993 1.00 0.00 N ATOM 29 CA GLY A 3 18.401 13.708 7.223 1.00 0.00 C ATOM 30 C GLY A 3 17.539 13.594 8.467 1.00 0.00 C ATOM 31 O GLY A 3 16.342 13.887 8.422 1.00 0.00 O ATOM 32 H GLY A 3 18.902 11.828 6.413 1.00 0.00 H ATOM 33 HA2 GLY A 3 19.040 14.573 7.322 1.00 0.00 H ATOM 34 HA3 GLY A 3 17.757 13.849 6.367 1.00 0.00 H ATOM 35 N PHE A 4 18.144 13.185 9.584 1.00 0.00 N ATOM 36 CA PHE A 4 17.418 13.053 10.848 1.00 0.00 C ATOM 37 C PHE A 4 16.825 14.398 11.278 1.00 0.00 C ATOM 38 O PHE A 4 15.844 14.441 12.022 1.00 0.00 O ATOM 39 CB PHE A 4 18.339 12.504 11.947 1.00 0.00 C ATOM 40 CG PHE A 4 19.489 13.409 12.305 1.00 0.00 C ATOM 41 CD1 PHE A 4 19.275 14.604 12.973 1.00 0.00 C ATOM 42 CD2 PHE A 4 20.785 13.052 11.982 1.00 0.00 C ATOM 43 CE1 PHE A 4 20.333 15.426 13.308 1.00 0.00 C ATOM 44 CE2 PHE A 4 21.848 13.870 12.314 1.00 0.00 C ATOM 45 CZ PHE A 4 21.622 15.059 12.978 1.00 0.00 C ATOM 46 H PHE A 4 19.101 12.978 9.562 1.00 0.00 H ATOM 47 HA PHE A 4 16.610 12.355 10.689 1.00 0.00 H ATOM 48 HB2 PHE A 4 17.758 12.343 12.842 1.00 0.00 H ATOM 49 HB3 PHE A 4 18.749 11.560 11.619 1.00 0.00 H ATOM 50 HD1 PHE A 4 18.268 14.893 13.232 1.00 0.00 H ATOM 51 HD2 PHE A 4 20.961 12.124 11.461 1.00 0.00 H ATOM 52 HE1 PHE A 4 20.151 16.355 13.827 1.00 0.00 H ATOM 53 HE2 PHE A 4 22.856 13.579 12.056 1.00 0.00 H ATOM 54 HZ PHE A 4 22.451 15.700 13.238 1.00 0.00 H ATOM 55 N THR A 5 17.428 15.490 10.797 1.00 0.00 N ATOM 56 CA THR A 5 16.964 16.836 11.121 1.00 0.00 C ATOM 57 C THR A 5 15.738 17.181 10.304 1.00 0.00 C ATOM 58 O THR A 5 14.741 17.688 10.821 1.00 0.00 O ATOM 59 CB THR A 5 18.062 17.899 10.883 1.00 0.00 C ATOM 60 OG1 THR A 5 19.257 17.539 11.587 1.00 0.00 O ATOM 61 CG2 THR A 5 17.602 19.276 11.344 1.00 0.00 C ATOM 62 H THR A 5 18.196 15.383 10.198 1.00 0.00 H ATOM 63 HA THR A 5 16.693 16.846 12.145 1.00 0.00 H ATOM 64 HB THR A 5 18.276 17.945 9.824 1.00 0.00 H ATOM 65 HG1 THR A 5 19.784 16.946 11.044 1.00 0.00 H ATOM 66 HG21 THR A 5 18.464 19.906 11.510 1.00 0.00 H ATOM 67 HG22 THR A 5 17.043 19.182 12.263 1.00 0.00 H ATOM 68 HG23 THR A 5 16.974 19.719 10.585 1.00 0.00 H ATOM 69 N LYS A 6 15.827 16.866 9.030 1.00 0.00 N ATOM 70 CA LYS A 6 14.734 17.094 8.094 1.00 0.00 C ATOM 71 C LYS A 6 13.731 15.938 8.135 1.00 0.00 C ATOM 72 O LYS A 6 12.903 15.804 7.233 1.00 0.00 O ATOM 73 CB LYS A 6 15.261 17.237 6.663 1.00 0.00 C ATOM 74 CG LYS A 6 15.670 15.909 6.040 1.00 0.00 C ATOM 75 CD LYS A 6 15.430 15.895 4.540 1.00 0.00 C ATOM 76 CE LYS A 6 15.232 14.477 4.024 1.00 0.00 C ATOM 77 NZ LYS A 6 14.052 13.837 4.615 1.00 0.00 N ATOM 78 H LYS A 6 16.649 16.446 8.722 1.00 0.00 H ATOM 79 HA LYS A 6 14.231 18.006 8.379 1.00 0.00 H ATOM 80 HB2 LYS A 6 14.488 17.678 6.049 1.00 0.00 H ATOM 81 HB3 LYS A 6 16.121 17.889 6.670 1.00 0.00 H ATOM 82 HG2 LYS A 6 16.721 15.745 6.227 1.00 0.00 H ATOM 83 HG3 LYS A 6 15.096 15.116 6.494 1.00 0.00 H ATOM 84 HD2 LYS A 6 14.546 16.474 4.320 1.00 0.00 H ATOM 85 HD3 LYS A 6 16.284 16.334 4.044 1.00 0.00 H ATOM 86 HE2 LYS A 6 15.113 14.511 2.952 1.00 0.00 H ATOM 87 HE3 LYS A 6 16.107 13.893 4.269 1.00 0.00 H ATOM 88 HZ1 LYS A 6 14.104 13.572 5.557 1.00 0.00 H ATOM 89 N ALA A 7 13.809 15.091 9.166 1.00 0.00 N ATOM 90 CA ALA A 7 12.899 13.956 9.275 1.00 0.00 C ATOM 91 C ALA A 7 11.449 14.413 9.234 1.00 0.00 C ATOM 92 O ALA A 7 10.605 13.770 8.612 1.00 0.00 O ATOM 93 CB ALA A 7 13.182 13.152 10.536 1.00 0.00 C ATOM 94 H ALA A 7 14.495 15.225 9.857 1.00 0.00 H ATOM 95 HA ALA A 7 13.070 13.329 8.421 1.00 0.00 H ATOM 96 HB1 ALA A 7 12.896 13.731 11.402 1.00 0.00 H ATOM 97 HB2 ALA A 7 14.237 12.925 10.589 1.00 0.00 H ATOM 98 HB3 ALA A 7 12.617 12.233 10.512 1.00 0.00 H ATOM 99 N ARG A 8 11.180 15.541 9.876 1.00 0.00 N ATOM 100 CA ARG A 8 9.845 16.118 9.895 1.00 0.00 C ATOM 101 C ARG A 8 9.416 16.450 8.482 1.00 0.00 C ATOM 102 O ARG A 8 8.245 16.357 8.125 1.00 0.00 O ATOM 103 CB ARG A 8 9.863 17.397 10.719 1.00 0.00 C ATOM 104 CG ARG A 8 8.487 17.968 11.023 1.00 0.00 C ATOM 105 CD ARG A 8 8.590 19.279 11.792 1.00 0.00 C ATOM 106 NE ARG A 8 9.378 19.138 13.017 1.00 0.00 N ATOM 107 CZ ARG A 8 8.998 18.420 14.078 1.00 0.00 C ATOM 108 NH1 ARG A 8 7.793 17.855 14.122 1.00 0.00 N ATOM 109 NH2 ARG A 8 9.823 18.283 15.109 1.00 0.00 N ATOM 110 H ARG A 8 11.908 16.012 10.334 1.00 0.00 H ATOM 111 HA ARG A 8 9.159 15.406 10.325 1.00 0.00 H ATOM 112 HB2 ARG A 8 10.367 17.198 11.649 1.00 0.00 H ATOM 113 HB3 ARG A 8 10.425 18.141 10.169 1.00 0.00 H ATOM 114 HG2 ARG A 8 7.969 18.150 10.093 1.00 0.00 H ATOM 115 HG3 ARG A 8 7.932 17.254 11.615 1.00 0.00 H ATOM 116 HD2 ARG A 8 9.060 20.016 11.158 1.00 0.00 H ATOM 117 HD3 ARG A 8 7.595 19.610 12.050 1.00 0.00 H ATOM 118 HE ARG A 8 10.254 19.578 13.039 1.00 0.00 H ATOM 119 HH11 ARG A 8 7.157 17.965 13.358 1.00 0.00 H ATOM 120 HH12 ARG A 8 7.522 17.318 14.921 1.00 0.00 H ATOM 121 HH21 ARG A 8 10.724 18.717 15.091 1.00 0.00 H ATOM 122 HH22 ARG A 8 9.544 17.746 15.905 1.00 0.00 H ATOM 123 N LYS A 9 10.394 16.845 7.690 1.00 0.00 N ATOM 124 CA LYS A 9 10.156 17.211 6.297 1.00 0.00 C ATOM 125 C LYS A 9 9.815 15.982 5.460 1.00 0.00 C ATOM 126 O LYS A 9 8.777 15.938 4.800 1.00 0.00 O ATOM 127 CB LYS A 9 11.386 17.914 5.708 1.00 0.00 C ATOM 128 CG LYS A 9 11.251 18.258 4.232 1.00 0.00 C ATOM 129 CD LYS A 9 12.584 18.682 3.632 1.00 0.00 C ATOM 130 CE LYS A 9 12.479 18.922 2.131 1.00 0.00 C ATOM 131 NZ LYS A 9 11.611 20.090 1.808 1.00 0.00 N ATOM 132 H LYS A 9 11.308 16.886 8.059 1.00 0.00 H ATOM 133 HA LYS A 9 9.318 17.893 6.272 1.00 0.00 H ATOM 134 HB2 LYS A 9 11.557 18.830 6.253 1.00 0.00 H ATOM 135 HB3 LYS A 9 12.243 17.270 5.827 1.00 0.00 H ATOM 136 HG2 LYS A 9 10.887 17.391 3.701 1.00 0.00 H ATOM 137 HG3 LYS A 9 10.545 19.068 4.127 1.00 0.00 H ATOM 138 HD2 LYS A 9 12.905 19.595 4.109 1.00 0.00 H ATOM 139 HD3 LYS A 9 13.311 17.905 3.812 1.00 0.00 H ATOM 140 HE2 LYS A 9 13.469 19.103 1.739 1.00 0.00 H ATOM 141 HE3 LYS A 9 12.066 18.038 1.667 1.00 0.00 H ATOM 142 HZ1 LYS A 9 11.603 20.255 0.781 1.00 0.00 H ATOM 143 HZ2 LYS A 9 11.969 20.943 2.282 1.00 0.00 H ATOM 144 HZ3 LYS A 9 10.638 19.913 2.129 1.00 0.00 H ATOM 145 N ASP A 10 10.704 14.991 5.486 1.00 0.00 N ATOM 146 CA ASP A 10 10.515 13.760 4.721 1.00 0.00 C ATOM 147 C ASP A 10 9.336 12.926 5.234 1.00 0.00 C ATOM 148 O ASP A 10 8.758 12.150 4.475 1.00 0.00 O ATOM 149 CB ASP A 10 11.803 12.927 4.722 1.00 0.00 C ATOM 150 CG ASP A 10 12.924 13.599 3.944 1.00 0.00 C ATOM 151 OD1 ASP A 10 12.774 13.897 2.759 1.00 0.00 O ATOM 152 H ASP A 10 11.516 15.092 6.029 1.00 0.00 H ATOM 153 HA ASP A 10 10.302 14.051 3.703 1.00 0.00 H ATOM 154 HB2 ASP A 10 12.132 12.784 5.741 1.00 0.00 H ATOM 155 HB3 ASP A 10 11.604 11.964 4.274 1.00 0.00 H ATOM 156 N LYS A 11 8.976 13.078 6.514 1.00 0.00 N ATOM 157 CA LYS A 11 7.863 12.316 7.079 1.00 0.00 C ATOM 158 C LYS A 11 6.522 12.961 6.752 1.00 0.00 C ATOM 159 O LYS A 11 5.636 12.310 6.198 1.00 0.00 O ATOM 160 CB LYS A 11 8.008 12.157 8.597 1.00 0.00 C ATOM 161 CG LYS A 11 6.787 11.523 9.250 1.00 0.00 C ATOM 162 CD LYS A 11 6.464 10.165 8.639 1.00 0.00 C ATOM 163 CE LYS A 11 4.992 9.809 8.800 1.00 0.00 C ATOM 164 NZ LYS A 11 4.126 10.682 8.003 1.00 0.00 N ATOM 165 H LYS A 11 9.459 13.715 7.083 1.00 0.00 H ATOM 166 HA LYS A 11 7.884 11.337 6.629 1.00 0.00 H ATOM 167 HB2 LYS A 11 8.868 11.536 8.804 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.161 13.131 9.038 1.00 0.00 H ATOM 169 HG2 LYS A 11 6.983 11.394 10.304 1.00 0.00 H ATOM 170 HG3 LYS A 11 5.939 12.179 9.118 1.00 0.00 H ATOM 171 HD2 LYS A 11 6.703 10.187 7.586 1.00 0.00 H ATOM 172 HD3 LYS A 11 7.063 9.410 9.128 1.00 0.00 H ATOM 173 HE2 LYS A 11 4.846 8.787 8.484 1.00 0.00 H ATOM 174 HE3 LYS A 11 4.724 9.904 9.842 1.00 0.00 H ATOM 175 HZ1 LYS A 11 4.244 11.650 8.101 1.00 0.00 H ATOM 176 N ARG A 12 6.379 14.239 7.099 1.00 0.00 N ATOM 177 CA ARG A 12 5.140 14.967 6.839 1.00 0.00 C ATOM 178 C ARG A 12 4.775 14.901 5.360 1.00 0.00 C ATOM 179 O ARG A 12 3.596 14.909 5.007 1.00 0.00 O ATOM 180 CB ARG A 12 5.255 16.429 7.285 1.00 0.00 C ATOM 181 CG ARG A 12 4.183 16.849 8.280 1.00 0.00 C ATOM 182 CD ARG A 12 2.782 16.705 7.698 1.00 0.00 C ATOM 183 NE ARG A 12 2.575 17.559 6.527 1.00 0.00 N ATOM 184 CZ ARG A 12 2.519 18.895 6.568 1.00 0.00 C ATOM 185 NH1 ARG A 12 2.609 19.545 7.726 1.00 0.00 N ATOM 186 NH2 ARG A 12 2.362 19.582 5.442 1.00 0.00 N ATOM 187 H ARG A 12 7.124 14.701 7.538 1.00 0.00 H ATOM 188 HA ARG A 12 4.356 14.490 7.408 1.00 0.00 H ATOM 189 HB2 ARG A 12 6.218 16.579 7.745 1.00 0.00 H ATOM 190 HB3 ARG A 12 5.178 17.065 6.416 1.00 0.00 H ATOM 191 HG2 ARG A 12 4.260 16.227 9.159 1.00 0.00 H ATOM 192 HG3 ARG A 12 4.346 17.881 8.554 1.00 0.00 H ATOM 193 HD2 ARG A 12 2.631 15.675 7.409 1.00 0.00 H ATOM 194 HD3 ARG A 12 2.062 16.971 8.458 1.00 0.00 H ATOM 195 HE ARG A 12 2.485 17.113 5.659 1.00 0.00 H ATOM 196 HH11 ARG A 12 2.719 19.039 8.581 1.00 0.00 H ATOM 197 HH12 ARG A 12 2.565 20.545 7.742 1.00 0.00 H ATOM 198 HH21 ARG A 12 2.287 19.101 4.568 1.00 0.00 H ATOM 199 HH22 ARG A 12 2.316 20.581 5.468 1.00 0.00 H ATOM 200 N LYS A 13 5.794 14.832 4.496 1.00 0.00 N ATOM 201 CA LYS A 13 5.559 14.759 3.054 1.00 0.00 C ATOM 202 C LYS A 13 5.133 13.358 2.630 1.00 0.00 C ATOM 203 O LYS A 13 4.150 13.200 1.902 1.00 0.00 O ATOM 204 CB LYS A 13 6.800 15.200 2.270 1.00 0.00 C ATOM 205 CG LYS A 13 7.134 16.678 2.425 1.00 0.00 C ATOM 206 CD LYS A 13 6.017 17.572 1.903 1.00 0.00 C ATOM 207 CE LYS A 13 5.781 17.368 0.413 1.00 0.00 C ATOM 208 NZ LYS A 13 4.679 18.230 -0.100 1.00 0.00 N ATOM 209 H LYS A 13 6.720 14.825 4.837 1.00 0.00 H ATOM 210 HA LYS A 13 4.749 15.428 2.832 1.00 0.00 H ATOM 211 HB2 LYS A 13 7.649 14.625 2.612 1.00 0.00 H ATOM 212 HB3 LYS A 13 6.640 14.998 1.221 1.00 0.00 H ATOM 213 HG2 LYS A 13 7.289 16.893 3.471 1.00 0.00 H ATOM 214 HG3 LYS A 13 8.040 16.891 1.876 1.00 0.00 H ATOM 215 HD2 LYS A 13 5.107 17.342 2.436 1.00 0.00 H ATOM 216 HD3 LYS A 13 6.286 18.604 2.077 1.00 0.00 H ATOM 217 HE2 LYS A 13 6.689 17.608 -0.119 1.00 0.00 H ATOM 218 HE3 LYS A 13 5.526 16.332 0.241 1.00 0.00 H ATOM 219 HZ1 LYS A 13 4.546 18.070 -1.119 1.00 0.00 H ATOM 220 HZ2 LYS A 13 4.907 19.233 0.054 1.00 0.00 H ATOM 221 HZ3 LYS A 13 3.790 18.009 0.395 1.00 0.00 H ATOM 222 N LEU A 14 5.860 12.344 3.097 1.00 0.00 N ATOM 223 CA LEU A 14 5.533 10.956 2.773 1.00 0.00 C ATOM 224 C LEU A 14 4.157 10.568 3.324 1.00 0.00 C ATOM 225 O LEU A 14 3.551 9.602 2.857 1.00 0.00 O ATOM 226 CB LEU A 14 6.604 10.003 3.316 1.00 0.00 C ATOM 227 CG LEU A 14 7.953 10.060 2.593 1.00 0.00 C ATOM 228 CD1 LEU A 14 8.964 9.146 3.271 1.00 0.00 C ATOM 229 CD2 LEU A 14 7.790 9.676 1.129 1.00 0.00 C ATOM 230 H LEU A 14 6.624 12.531 3.683 1.00 0.00 H ATOM 231 HA LEU A 14 5.506 10.872 1.697 1.00 0.00 H ATOM 232 HB2 LEU A 14 6.767 10.236 4.358 1.00 0.00 H ATOM 233 HB3 LEU A 14 6.226 8.994 3.245 1.00 0.00 H ATOM 234 HG LEU A 14 8.336 11.069 2.633 1.00 0.00 H ATOM 235 HD11 LEU A 14 8.622 8.123 3.211 1.00 0.00 H ATOM 236 HD12 LEU A 14 9.068 9.430 4.307 1.00 0.00 H ATOM 237 HD13 LEU A 14 9.919 9.236 2.775 1.00 0.00 H ATOM 238 HD21 LEU A 14 7.284 8.724 1.061 1.00 0.00 H ATOM 239 HD22 LEU A 14 8.763 9.600 0.666 1.00 0.00 H ATOM 240 HD23 LEU A 14 7.208 10.431 0.622 1.00 0.00 H ATOM 241 N ASP A 15 3.663 11.327 4.312 1.00 0.00 N ATOM 242 CA ASP A 15 2.355 11.051 4.907 1.00 0.00 C ATOM 243 C ASP A 15 1.261 11.897 4.258 1.00 0.00 C ATOM 244 O ASP A 15 0.256 11.369 3.784 1.00 0.00 O ATOM 245 CB ASP A 15 2.379 11.284 6.424 1.00 0.00 C ATOM 246 CG ASP A 15 3.190 10.232 7.165 1.00 0.00 C ATOM 247 OD1 ASP A 15 2.967 9.032 6.992 1.00 0.00 O ATOM 248 H ASP A 15 4.185 12.097 4.637 1.00 0.00 H ATOM 249 HA ASP A 15 2.131 10.010 4.724 1.00 0.00 H ATOM 250 HB2 ASP A 15 2.813 12.253 6.626 1.00 0.00 H ATOM 251 HB3 ASP A 15 1.367 11.264 6.800 1.00 0.00 H HETATM 252 N NH2 A 16 1.456 13.212 4.232 1.00 0.00 N HETATM 253 HN1 NH2 A 16 2.279 13.569 4.628 1.00 0.00 H HETATM 254 HN2 NH2 A 16 0.766 13.773 3.819 1.00 0.00 H TER 255 NH2 A 16 ENDMDL MODEL 20 ATOM 1 N PHE A 1 17.599 9.171 3.794 1.00 0.00 N ATOM 2 CA PHE A 1 17.298 9.153 5.222 1.00 0.00 C ATOM 3 C PHE A 1 17.663 10.486 5.874 1.00 0.00 C ATOM 4 O PHE A 1 18.737 11.037 5.623 1.00 0.00 O ATOM 5 CB PHE A 1 18.047 8.010 5.920 1.00 0.00 C ATOM 6 CG PHE A 1 17.598 6.634 5.501 1.00 0.00 C ATOM 7 CD1 PHE A 1 17.669 6.235 4.174 1.00 0.00 C ATOM 8 CD2 PHE A 1 17.111 5.739 6.440 1.00 0.00 C ATOM 9 CE1 PHE A 1 17.260 4.970 3.794 1.00 0.00 C ATOM 10 CE2 PHE A 1 16.702 4.473 6.065 1.00 0.00 C ATOM 11 CZ PHE A 1 16.776 4.089 4.741 1.00 0.00 C ATOM 12 H1 PHE A 1 18.529 9.266 3.501 1.00 0.00 H ATOM 13 HA PHE A 1 16.236 8.993 5.332 1.00 0.00 H ATOM 14 HB2 PHE A 1 19.100 8.094 5.699 1.00 0.00 H ATOM 15 HB3 PHE A 1 17.902 8.096 6.987 1.00 0.00 H ATOM 16 HD1 PHE A 1 18.048 6.921 3.433 1.00 0.00 H ATOM 17 HD2 PHE A 1 17.051 6.038 7.476 1.00 0.00 H ATOM 18 HE1 PHE A 1 17.319 4.672 2.758 1.00 0.00 H ATOM 19 HE2 PHE A 1 16.324 3.785 6.807 1.00 0.00 H ATOM 20 HZ PHE A 1 16.456 3.100 4.446 1.00 0.00 H ATOM 21 N GLY A 2 16.759 10.997 6.713 1.00 0.00 N ATOM 22 CA GLY A 2 16.994 12.260 7.394 1.00 0.00 C ATOM 23 C GLY A 2 18.141 12.188 8.385 1.00 0.00 C ATOM 24 O GLY A 2 18.265 11.210 9.127 1.00 0.00 O ATOM 25 H GLY A 2 15.923 10.510 6.872 1.00 0.00 H ATOM 26 HA2 GLY A 2 17.219 13.016 6.656 1.00 0.00 H ATOM 27 HA3 GLY A 2 16.096 12.544 7.920 1.00 0.00 H ATOM 28 N GLY A 3 18.979 13.226 8.398 1.00 0.00 N ATOM 29 CA GLY A 3 20.113 13.265 9.309 1.00 0.00 C ATOM 30 C GLY A 3 19.694 13.234 10.769 1.00 0.00 C ATOM 31 O GLY A 3 20.225 12.445 11.552 1.00 0.00 O ATOM 32 H GLY A 3 18.825 13.975 7.784 1.00 0.00 H ATOM 33 HA2 GLY A 3 20.748 12.413 9.111 1.00 0.00 H ATOM 34 HA3 GLY A 3 20.676 14.169 9.127 1.00 0.00 H ATOM 35 N PHE A 4 18.735 14.090 11.131 1.00 0.00 N ATOM 36 CA PHE A 4 18.237 14.158 12.505 1.00 0.00 C ATOM 37 C PHE A 4 17.059 15.127 12.618 1.00 0.00 C ATOM 38 O PHE A 4 15.976 14.746 13.068 1.00 0.00 O ATOM 39 CB PHE A 4 19.358 14.589 13.461 1.00 0.00 C ATOM 40 CG PHE A 4 18.932 14.668 14.902 1.00 0.00 C ATOM 41 CD1 PHE A 4 18.283 13.603 15.508 1.00 0.00 C ATOM 42 CD2 PHE A 4 19.179 15.809 15.649 1.00 0.00 C ATOM 43 CE1 PHE A 4 17.889 13.675 16.830 1.00 0.00 C ATOM 44 CE2 PHE A 4 18.789 15.886 16.972 1.00 0.00 C ATOM 45 CZ PHE A 4 18.143 14.818 17.563 1.00 0.00 C ATOM 46 H PHE A 4 18.350 14.688 10.455 1.00 0.00 H ATOM 47 HA PHE A 4 17.901 13.170 12.783 1.00 0.00 H ATOM 48 HB2 PHE A 4 20.169 13.880 13.395 1.00 0.00 H ATOM 49 HB3 PHE A 4 19.716 15.565 13.165 1.00 0.00 H ATOM 50 HD1 PHE A 4 18.085 12.708 14.936 1.00 0.00 H ATOM 51 HD2 PHE A 4 19.684 16.644 15.187 1.00 0.00 H ATOM 52 HE1 PHE A 4 17.384 12.839 17.290 1.00 0.00 H ATOM 53 HE2 PHE A 4 18.988 16.781 17.542 1.00 0.00 H ATOM 54 HZ PHE A 4 17.836 14.877 18.597 1.00 0.00 H ATOM 55 N THR A 5 17.276 16.378 12.205 1.00 0.00 N ATOM 56 CA THR A 5 16.231 17.398 12.261 1.00 0.00 C ATOM 57 C THR A 5 15.439 17.448 10.971 1.00 0.00 C ATOM 58 O THR A 5 14.212 17.566 10.977 1.00 0.00 O ATOM 59 CB THR A 5 16.809 18.796 12.574 1.00 0.00 C ATOM 60 OG1 THR A 5 17.541 18.761 13.808 1.00 0.00 O ATOM 61 CG2 THR A 5 15.702 19.839 12.669 1.00 0.00 C ATOM 62 H THR A 5 18.158 16.618 11.854 1.00 0.00 H ATOM 63 HA THR A 5 15.566 17.125 13.036 1.00 0.00 H ATOM 64 HB THR A 5 17.480 19.078 11.775 1.00 0.00 H ATOM 65 HG1 THR A 5 16.981 18.411 14.506 1.00 0.00 H ATOM 66 HG21 THR A 5 15.327 20.056 11.680 1.00 0.00 H ATOM 67 HG22 THR A 5 16.096 20.742 13.111 1.00 0.00 H ATOM 68 HG23 THR A 5 14.900 19.458 13.283 1.00 0.00 H ATOM 69 N LYS A 6 16.156 17.333 9.877 1.00 0.00 N ATOM 70 CA LYS A 6 15.555 17.335 8.548 1.00 0.00 C ATOM 71 C LYS A 6 14.707 16.077 8.331 1.00 0.00 C ATOM 72 O LYS A 6 13.896 16.025 7.406 1.00 0.00 O ATOM 73 CB LYS A 6 16.637 17.457 7.464 1.00 0.00 C ATOM 74 CG LYS A 6 16.096 17.376 6.041 1.00 0.00 C ATOM 75 CD LYS A 6 16.164 15.957 5.496 1.00 0.00 C ATOM 76 CE LYS A 6 15.275 15.775 4.271 1.00 0.00 C ATOM 77 NZ LYS A 6 14.092 14.964 4.571 1.00 0.00 N ATOM 78 H LYS A 6 17.118 17.224 9.973 1.00 0.00 H ATOM 79 HA LYS A 6 14.907 18.197 8.488 1.00 0.00 H ATOM 80 HB2 LYS A 6 17.139 18.405 7.580 1.00 0.00 H ATOM 81 HB3 LYS A 6 17.355 16.661 7.599 1.00 0.00 H ATOM 82 HG2 LYS A 6 15.066 17.703 6.039 1.00 0.00 H ATOM 83 HG3 LYS A 6 16.682 18.025 5.407 1.00 0.00 H ATOM 84 HD2 LYS A 6 17.184 15.739 5.219 1.00 0.00 H ATOM 85 HD3 LYS A 6 15.846 15.270 6.266 1.00 0.00 H ATOM 86 HE2 LYS A 6 14.955 16.746 3.925 1.00 0.00 H ATOM 87 HE3 LYS A 6 15.847 15.287 3.496 1.00 0.00 H ATOM 88 HZ1 LYS A 6 13.217 15.379 4.439 1.00 0.00 H ATOM 89 N ALA A 7 14.890 15.065 9.191 1.00 0.00 N ATOM 90 CA ALA A 7 14.129 13.821 9.076 1.00 0.00 C ATOM 91 C ALA A 7 12.635 14.070 9.217 1.00 0.00 C ATOM 92 O ALA A 7 11.832 13.485 8.489 1.00 0.00 O ATOM 93 CB ALA A 7 14.607 12.796 10.097 1.00 0.00 C ATOM 94 H ALA A 7 15.546 15.160 9.919 1.00 0.00 H ATOM 95 HA ALA A 7 14.305 13.430 8.092 1.00 0.00 H ATOM 96 HB1 ALA A 7 15.684 12.726 10.059 1.00 0.00 H ATOM 97 HB2 ALA A 7 14.175 11.833 9.870 1.00 0.00 H ATOM 98 HB3 ALA A 7 14.301 13.104 11.086 1.00 0.00 H ATOM 99 N ARG A 8 12.271 14.963 10.132 1.00 0.00 N ATOM 100 CA ARG A 8 10.873 15.325 10.342 1.00 0.00 C ATOM 101 C ARG A 8 10.274 15.808 9.028 1.00 0.00 C ATOM 102 O ARG A 8 9.106 15.565 8.731 1.00 0.00 O ATOM 103 CB ARG A 8 10.790 16.448 11.378 1.00 0.00 C ATOM 104 CG ARG A 8 9.644 16.324 12.376 1.00 0.00 C ATOM 105 CD ARG A 8 8.280 16.307 11.697 1.00 0.00 C ATOM 106 NE ARG A 8 7.948 14.992 11.151 1.00 0.00 N ATOM 107 CZ ARG A 8 7.720 13.905 11.895 1.00 0.00 C ATOM 108 NH1 ARG A 8 7.755 13.970 13.224 1.00 0.00 N ATOM 109 NH2 ARG A 8 7.447 12.749 11.303 1.00 0.00 N ATOM 110 H ARG A 8 12.963 15.410 10.663 1.00 0.00 H ATOM 111 HA ARG A 8 10.333 14.456 10.684 1.00 0.00 H ATOM 112 HB2 ARG A 8 11.716 16.472 11.929 1.00 0.00 H ATOM 113 HB3 ARG A 8 10.678 17.386 10.850 1.00 0.00 H ATOM 114 HG2 ARG A 8 9.765 15.408 12.932 1.00 0.00 H ATOM 115 HG3 ARG A 8 9.685 17.163 13.055 1.00 0.00 H ATOM 116 HD2 ARG A 8 7.529 16.585 12.421 1.00 0.00 H ATOM 117 HD3 ARG A 8 8.285 17.029 10.893 1.00 0.00 H ATOM 118 HE ARG A 8 7.899 14.909 10.176 1.00 0.00 H ATOM 119 HH11 ARG A 8 7.951 14.838 13.680 1.00 0.00 H ATOM 120 HH12 ARG A 8 7.584 13.149 13.769 1.00 0.00 H ATOM 121 HH21 ARG A 8 7.411 12.695 10.307 1.00 0.00 H ATOM 122 HH22 ARG A 8 7.276 11.931 11.854 1.00 0.00 H ATOM 123 N LYS A 9 11.107 16.483 8.240 1.00 0.00 N ATOM 124 CA LYS A 9 10.693 17.001 6.939 1.00 0.00 C ATOM 125 C LYS A 9 10.589 15.865 5.925 1.00 0.00 C ATOM 126 O LYS A 9 9.660 15.825 5.117 1.00 0.00 O ATOM 127 CB LYS A 9 11.671 18.071 6.435 1.00 0.00 C ATOM 128 CG LYS A 9 11.653 19.368 7.239 1.00 0.00 C ATOM 129 CD LYS A 9 12.141 19.166 8.667 1.00 0.00 C ATOM 130 CE LYS A 9 12.200 20.479 9.433 1.00 0.00 C ATOM 131 NZ LYS A 9 10.857 21.112 9.569 1.00 0.00 N ATOM 132 H LYS A 9 12.036 16.617 8.539 1.00 0.00 H ATOM 133 HA LYS A 9 9.716 17.447 7.059 1.00 0.00 H ATOM 134 HB2 LYS A 9 12.672 17.670 6.470 1.00 0.00 H ATOM 135 HB3 LYS A 9 11.426 18.308 5.410 1.00 0.00 H ATOM 136 HG2 LYS A 9 12.293 20.088 6.752 1.00 0.00 H ATOM 137 HG3 LYS A 9 10.641 19.746 7.265 1.00 0.00 H ATOM 138 HD2 LYS A 9 11.465 18.498 9.177 1.00 0.00 H ATOM 139 HD3 LYS A 9 13.129 18.730 8.640 1.00 0.00 H ATOM 140 HE2 LYS A 9 12.597 20.287 10.419 1.00 0.00 H ATOM 141 HE3 LYS A 9 12.858 21.157 8.909 1.00 0.00 H ATOM 142 HZ1 LYS A 9 10.886 21.858 10.294 1.00 0.00 H ATOM 143 HZ2 LYS A 9 10.152 20.401 9.847 1.00 0.00 H ATOM 144 HZ3 LYS A 9 10.568 21.535 8.663 1.00 0.00 H ATOM 145 N ASP A 10 11.550 14.940 5.982 1.00 0.00 N ATOM 146 CA ASP A 10 11.578 13.793 5.078 1.00 0.00 C ATOM 147 C ASP A 10 10.356 12.895 5.289 1.00 0.00 C ATOM 148 O ASP A 10 9.760 12.417 4.324 1.00 0.00 O ATOM 149 CB ASP A 10 12.852 12.960 5.286 1.00 0.00 C ATOM 150 CG ASP A 10 14.160 13.701 5.008 1.00 0.00 C ATOM 151 OD1 ASP A 10 15.235 13.126 5.186 1.00 0.00 O ATOM 152 H ASP A 10 12.259 15.031 6.653 1.00 0.00 H ATOM 153 HA ASP A 10 11.564 14.167 4.065 1.00 0.00 H ATOM 154 HB2 ASP A 10 12.877 12.618 6.309 1.00 0.00 H ATOM 155 HB3 ASP A 10 12.809 12.098 4.634 1.00 0.00 H ATOM 156 N LYS A 11 9.989 12.667 6.556 1.00 0.00 N ATOM 157 CA LYS A 11 8.841 11.821 6.880 1.00 0.00 C ATOM 158 C LYS A 11 7.546 12.573 6.618 1.00 0.00 C ATOM 159 O LYS A 11 6.707 12.121 5.837 1.00 0.00 O ATOM 160 CB LYS A 11 8.909 11.353 8.344 1.00 0.00 C ATOM 161 CG LYS A 11 7.838 10.333 8.732 1.00 0.00 C ATOM 162 CD LYS A 11 6.444 10.951 8.779 1.00 0.00 C ATOM 163 CE LYS A 11 5.467 10.209 7.878 1.00 0.00 C ATOM 164 NZ LYS A 11 4.576 11.124 7.164 1.00 0.00 N ATOM 165 H LYS A 11 10.496 13.082 7.286 1.00 0.00 H ATOM 166 HA LYS A 11 8.876 10.958 6.234 1.00 0.00 H ATOM 167 HB2 LYS A 11 9.876 10.906 8.519 1.00 0.00 H ATOM 168 HB3 LYS A 11 8.804 12.214 8.988 1.00 0.00 H ATOM 169 HG2 LYS A 11 7.839 9.534 8.006 1.00 0.00 H ATOM 170 HG3 LYS A 11 8.076 9.933 9.707 1.00 0.00 H ATOM 171 HD2 LYS A 11 6.080 10.908 9.794 1.00 0.00 H ATOM 172 HD3 LYS A 11 6.503 11.981 8.464 1.00 0.00 H ATOM 173 HE2 LYS A 11 6.027 9.633 7.156 1.00 0.00 H ATOM 174 HE3 LYS A 11 4.872 9.544 8.486 1.00 0.00 H ATOM 175 HZ1 LYS A 11 4.667 12.082 7.351 1.00 0.00 H ATOM 176 N ARG A 12 7.399 13.730 7.264 1.00 0.00 N ATOM 177 CA ARG A 12 6.210 14.558 7.095 1.00 0.00 C ATOM 178 C ARG A 12 5.957 14.826 5.614 1.00 0.00 C ATOM 179 O ARG A 12 4.807 14.903 5.179 1.00 0.00 O ATOM 180 CB ARG A 12 6.363 15.878 7.866 1.00 0.00 C ATOM 181 CG ARG A 12 5.123 16.764 7.854 1.00 0.00 C ATOM 182 CD ARG A 12 5.021 17.594 6.580 1.00 0.00 C ATOM 183 NE ARG A 12 3.782 18.371 6.527 1.00 0.00 N ATOM 184 CZ ARG A 12 2.562 17.836 6.395 1.00 0.00 C ATOM 185 NH1 ARG A 12 2.409 16.522 6.247 1.00 0.00 N ATOM 186 NH2 ARG A 12 1.491 18.624 6.396 1.00 0.00 N ATOM 187 H ARG A 12 8.115 14.035 7.864 1.00 0.00 H ATOM 188 HA ARG A 12 5.368 14.013 7.497 1.00 0.00 H ATOM 189 HB2 ARG A 12 6.601 15.652 8.894 1.00 0.00 H ATOM 190 HB3 ARG A 12 7.181 16.437 7.435 1.00 0.00 H ATOM 191 HG2 ARG A 12 4.247 16.139 7.933 1.00 0.00 H ATOM 192 HG3 ARG A 12 5.165 17.432 8.703 1.00 0.00 H ATOM 193 HD2 ARG A 12 5.859 18.273 6.541 1.00 0.00 H ATOM 194 HD3 ARG A 12 5.056 16.935 5.728 1.00 0.00 H ATOM 195 HE ARG A 12 3.859 19.345 6.609 1.00 0.00 H ATOM 196 HH11 ARG A 12 3.207 15.921 6.233 1.00 0.00 H ATOM 197 HH12 ARG A 12 1.492 16.134 6.151 1.00 0.00 H ATOM 198 HH21 ARG A 12 1.598 19.613 6.496 1.00 0.00 H ATOM 199 HH22 ARG A 12 0.578 18.227 6.298 1.00 0.00 H ATOM 200 N LYS A 13 7.039 14.958 4.842 1.00 0.00 N ATOM 201 CA LYS A 13 6.923 15.213 3.407 1.00 0.00 C ATOM 202 C LYS A 13 6.346 14.006 2.673 1.00 0.00 C ATOM 203 O LYS A 13 5.432 14.150 1.859 1.00 0.00 O ATOM 204 CB LYS A 13 8.282 15.601 2.813 1.00 0.00 C ATOM 205 CG LYS A 13 8.226 15.969 1.336 1.00 0.00 C ATOM 206 CD LYS A 13 7.295 17.147 1.087 1.00 0.00 C ATOM 207 CE LYS A 13 7.245 17.520 -0.386 1.00 0.00 C ATOM 208 NZ LYS A 13 6.315 18.656 -0.642 1.00 0.00 N ATOM 209 H LYS A 13 7.935 14.875 5.249 1.00 0.00 H ATOM 210 HA LYS A 13 6.239 16.033 3.284 1.00 0.00 H ATOM 211 HB2 LYS A 13 8.670 16.448 3.357 1.00 0.00 H ATOM 212 HB3 LYS A 13 8.962 14.769 2.928 1.00 0.00 H ATOM 213 HG2 LYS A 13 9.218 16.232 1.004 1.00 0.00 H ATOM 214 HG3 LYS A 13 7.871 15.116 0.776 1.00 0.00 H ATOM 215 HD2 LYS A 13 6.300 16.883 1.414 1.00 0.00 H ATOM 216 HD3 LYS A 13 7.647 17.997 1.653 1.00 0.00 H ATOM 217 HE2 LYS A 13 8.237 17.799 -0.708 1.00 0.00 H ATOM 218 HE3 LYS A 13 6.913 16.660 -0.951 1.00 0.00 H ATOM 219 HZ1 LYS A 13 6.277 18.863 -1.661 1.00 0.00 H ATOM 220 HZ2 LYS A 13 6.642 19.506 -0.140 1.00 0.00 H ATOM 221 HZ3 LYS A 13 5.358 18.417 -0.311 1.00 0.00 H ATOM 222 N LEU A 14 6.870 12.818 2.973 1.00 0.00 N ATOM 223 CA LEU A 14 6.386 11.588 2.349 1.00 0.00 C ATOM 224 C LEU A 14 4.904 11.349 2.656 1.00 0.00 C ATOM 225 O LEU A 14 4.237 10.592 1.949 1.00 0.00 O ATOM 226 CB LEU A 14 7.214 10.385 2.814 1.00 0.00 C ATOM 227 CG LEU A 14 8.664 10.358 2.321 1.00 0.00 C ATOM 228 CD1 LEU A 14 9.409 9.176 2.924 1.00 0.00 C ATOM 229 CD2 LEU A 14 8.713 10.297 0.800 1.00 0.00 C ATOM 230 H LEU A 14 7.588 12.766 3.638 1.00 0.00 H ATOM 231 HA LEU A 14 6.502 11.697 1.281 1.00 0.00 H ATOM 232 HB2 LEU A 14 7.224 10.380 3.894 1.00 0.00 H ATOM 233 HB3 LEU A 14 6.726 9.485 2.471 1.00 0.00 H ATOM 234 HG LEU A 14 9.163 11.262 2.635 1.00 0.00 H ATOM 235 HD11 LEU A 14 8.911 8.258 2.648 1.00 0.00 H ATOM 236 HD12 LEU A 14 9.420 9.269 4.000 1.00 0.00 H ATOM 237 HD13 LEU A 14 10.423 9.161 2.553 1.00 0.00 H ATOM 238 HD21 LEU A 14 8.312 11.213 0.390 1.00 0.00 H ATOM 239 HD22 LEU A 14 8.125 9.460 0.454 1.00 0.00 H ATOM 240 HD23 LEU A 14 9.736 10.176 0.477 1.00 0.00 H ATOM 241 N ASP A 15 4.391 11.995 3.712 1.00 0.00 N ATOM 242 CA ASP A 15 2.988 11.839 4.098 1.00 0.00 C ATOM 243 C ASP A 15 2.124 12.944 3.489 1.00 0.00 C ATOM 244 O ASP A 15 1.157 12.667 2.780 1.00 0.00 O ATOM 245 CB ASP A 15 2.845 11.831 5.625 1.00 0.00 C ATOM 246 CG ASP A 15 3.667 10.731 6.274 1.00 0.00 C ATOM 247 OD1 ASP A 15 3.490 9.550 5.970 1.00 0.00 O ATOM 248 H ASP A 15 4.969 12.594 4.239 1.00 0.00 H ATOM 249 HA ASP A 15 2.648 10.888 3.714 1.00 0.00 H ATOM 250 HB2 ASP A 15 3.175 12.782 6.017 1.00 0.00 H ATOM 251 HB3 ASP A 15 1.807 11.681 5.883 1.00 0.00 H HETATM 252 N NH2 A 16 2.472 14.198 3.764 1.00 0.00 N HETATM 253 HN1 NH2 A 16 3.254 14.349 4.337 1.00 0.00 H HETATM 254 HN2 NH2 A 16 1.932 14.921 3.383 1.00 0.00 H TER 255 NH2 A 16 ENDMDL CONECT 77 150 CONECT 150 77 CONECT 164 246 CONECT 246 164 CONECT 252 253 254 CONECT 253 252 CONECT 254 252 MASTER 99 0 1 1 0 0 0 6 123 1 7 2 END