HEADER VIRAL PROTEIN 09-APR-08 SMS20015 TITLE NMR STRUCTURE OF A V3 (SF2 ISOLATE) PEPTIDE COMPND MOL_ID: 1; COMPND 2 MOLECULE: ENVELOPE GLYCOPROTEIN; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: PND DOMAIN, UNP RESIDUES 36-48; COMPND 5 ENGINEERED: YES; COMPND 6 OTHER_DETAILS: V3 (SF2 ISOLATE) PEPTIDE SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; SOURCE 4 ORGANISM_COMMON: HIV; SOURCE 5 ORGANISM_TAXID: 11676; SOURCE 6 OTHER_DETAILS: CHEMICAL SYNTHESIS KEYWDS U-SHAPE LIKE PEPTIDE, GPGR TURN, VIRAL PROTEIN EXPDTA SOLUTION NMR NUMMDL 21 MDLTYP MINIMIZED AVERAGE AUTHOR P.A.GALANAKIS,N.G.KANDIAS,A.RIZOS,D.MORIKIS,E.KRAMBOVITIS, AUTHOR 2 G.A.SPYROULIAS JRNL AUTH P.A.GALANAKIS,N.G.KANDIAS,A.K.RIZOS,D.MORIKIS,E.KRAMBOVITIS, JRNL AUTH 2 G.A.SPYROULIAS JRNL TITL NMR EVIDENCE OF CHARGE-DEPENDENT INTERACTION BETWEEN VARIOUS JRNL TITL 2 PND V3 AND CCR5 N-TERMINAL PEPTIDES JRNL REF BIOPOLYMERS V. 92 94 2009 JRNL REFN ISSN 0006-3525 JRNL PMID 19117029 JRNL DOI 10.1002/BIP.21127 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : AMBER 5.0 REMARK 3 AUTHORS : CASE, DARDEN, CHEATHAM, III, SIMMERLING, WANG, REMARK 3 DUKE, LUO, ... AND KOLLM 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 02-SEP-10. REMARK 100 THE BMRB ID CODE IS SMS20015. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 278; 286 REMARK 210 PH : 7.85; 7.85 REMARK 210 IONIC STRENGTH : NULL; NULL REMARK 210 PRESSURE : NULL; NULL REMARK 210 SAMPLE CONTENTS : 2-2.5MM PEPTIDE; 90% H2O/10% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-15N HSQC; 2D 1H-13C HSQC; REMARK 210 2D 1H-1H TOCSY; 2D 1H-1H NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ; 700 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : DYANA, XEASY, XWINNMR REMARK 210 METHOD USED : ENERGY MINIMIZATION REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 400 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 21 REMARK 210 CONFORMERS, SELECTION CRITERIA : TARGET FUNCTION 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 ILE A 4 -143.52 -78.86 REMARK 500 1 ILE A 6 -107.91 -72.22 REMARK 500 2 ILE A 4 -137.52 -96.30 REMARK 500 2 ILE A 6 -118.08 -68.85 REMARK 500 3 LYS A 2 -44.46 -152.93 REMARK 500 3 ILE A 4 -139.09 -90.74 REMARK 500 3 ILE A 6 -124.54 -72.62 REMARK 500 3 PRO A 8 90.62 -69.52 REMARK 500 4 ILE A 4 -141.19 -90.05 REMARK 500 4 ILE A 6 -115.45 -69.71 REMARK 500 5 LYS A 2 -42.89 -177.86 REMARK 500 5 ILE A 4 -144.70 -91.52 REMARK 500 5 ILE A 6 -121.71 -68.69 REMARK 500 6 ILE A 4 -139.50 -90.70 REMARK 500 6 ILE A 6 -122.26 -69.97 REMARK 500 7 LYS A 2 178.36 60.61 REMARK 500 7 SER A 3 133.78 91.46 REMARK 500 7 ILE A 4 -145.44 -93.24 REMARK 500 7 ILE A 6 -128.98 -72.69 REMARK 500 8 ILE A 4 -140.23 -92.43 REMARK 500 8 ILE A 6 -122.67 -71.39 REMARK 500 9 SER A 3 135.22 70.21 REMARK 500 9 ILE A 4 -140.01 -93.39 REMARK 500 9 ILE A 6 -111.10 -69.29 REMARK 500 10 ILE A 4 -139.11 -91.51 REMARK 500 10 ILE A 6 -119.77 -70.97 REMARK 500 11 LYS A 2 -92.89 54.50 REMARK 500 11 SER A 3 135.47 83.14 REMARK 500 11 ILE A 4 -139.81 -96.94 REMARK 500 11 ILE A 6 -121.38 -69.87 REMARK 500 12 ILE A 4 -136.86 -96.88 REMARK 500 12 ILE A 6 -113.64 -68.28 REMARK 500 13 LYS A 2 146.89 -172.86 REMARK 500 13 ILE A 4 -139.39 -90.36 REMARK 500 13 ILE A 6 -108.62 -66.88 REMARK 500 14 LYS A 2 179.36 60.24 REMARK 500 14 SER A 3 127.76 71.87 REMARK 500 14 ILE A 4 -141.33 -89.85 REMARK 500 14 ILE A 6 -113.30 -66.62 REMARK 500 15 ILE A 4 -136.72 -95.53 REMARK 500 15 ILE A 6 -126.96 -71.17 REMARK 500 15 PHE A 12 74.40 -150.66 REMARK 500 16 ILE A 4 -137.81 -97.60 REMARK 500 16 ILE A 6 -96.54 -65.84 REMARK 500 16 PRO A 8 88.32 -69.05 REMARK 500 17 ILE A 4 -135.59 -90.39 REMARK 500 17 ILE A 6 -119.10 -72.97 REMARK 500 17 PRO A 8 89.79 -69.22 REMARK 500 17 PHE A 12 63.52 -153.74 REMARK 500 18 SER A 3 157.88 80.31 REMARK 500 REMARK 500 THIS ENTRY HAS 66 RAMACHANDRAN OUTLIERS. REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 20015 RELATED DB: BMRB REMARK 900 RELATED ID: 20019 RELATED DB: BMRB REMARK 900 V3 (MN ISOLATE) PEPTIDE REMARK 900 RELATED ID: 20020 RELATED DB: BMRB REMARK 900 V3 (LAI ISOLATE) PEPTIDE DBREF A 1 13 UNP Q9YSP7 Q9YSP7_9HIV1 36 48 SEQRES 1 A 13 ARG LYS SER ILE ASN ILE GLY PRO GLY ARG ALA PHE TYR 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 ARG A 1 -2.494 -0.853 12.631 1.00 4.19 N ATOM 2 CA ARG A 1 -3.217 -1.312 11.429 1.00 3.80 C ATOM 3 C ARG A 1 -3.106 -0.322 10.264 1.00 2.35 C ATOM 4 O ARG A 1 -4.090 -0.119 9.563 1.00 3.10 O ATOM 5 CB ARG A 1 -4.688 -1.627 11.774 1.00 5.09 C ATOM 6 CG ARG A 1 -5.569 -0.387 12.029 1.00 5.84 C ATOM 7 CD ARG A 1 -6.748 -0.684 12.962 1.00 7.25 C ATOM 8 NE ARG A 1 -6.350 -0.671 14.382 1.00 7.97 N ATOM 9 CZ ARG A 1 -6.767 0.195 15.320 1.00 9.10 C ATOM 10 NH1 ARG A 1 -7.591 1.202 15.025 1.00 10.00 N ATOM 11 NH2 ARG A 1 -6.353 0.053 16.579 1.00 9.75 N ATOM 12 H1 ARG A 1 -2.624 -1.526 13.374 1.00 4.52 H ATOM 13 H2 ARG A 1 -1.506 -0.777 12.438 1.00 5.22 H ATOM 14 H3 ARG A 1 -2.854 0.044 12.924 1.00 3.88 H ATOM 15 HA ARG A 1 -2.760 -2.246 11.097 1.00 4.72 H ATOM 16 HB2 ARG A 1 -5.126 -2.193 10.949 1.00 5.51 H ATOM 17 HB3 ARG A 1 -4.704 -2.273 12.652 1.00 5.87 H ATOM 18 HG2 ARG A 1 -4.979 0.428 12.447 1.00 5.82 H ATOM 19 HG3 ARG A 1 -5.988 -0.051 11.079 1.00 6.00 H ATOM 20 HD2 ARG A 1 -7.521 0.060 12.778 1.00 7.79 H ATOM 21 HD3 ARG A 1 -7.168 -1.660 12.716 1.00 7.80 H ATOM 22 HE ARG A 1 -5.784 -1.455 14.673 1.00 8.04 H ATOM 23 HH11 ARG A 1 -7.937 1.336 14.088 1.00 10.58 H ATOM 24 HH12 ARG A 1 -7.929 1.839 15.731 1.00 10.43 H ATOM 25 HH21 ARG A 1 -5.743 -0.700 16.859 1.00 10.39 H ATOM 26 HH22 ARG A 1 -6.667 0.679 17.306 1.00 9.99 H ATOM 27 N LYS A 2 -1.941 0.286 9.998 1.00 1.53 N ATOM 28 CA LYS A 2 -1.803 0.915 8.693 1.00 1.25 C ATOM 29 C LYS A 2 -1.546 -0.228 7.736 1.00 1.05 C ATOM 30 O LYS A 2 -0.405 -0.656 7.595 1.00 2.18 O ATOM 31 CB LYS A 2 -0.666 1.944 8.607 1.00 2.67 C ATOM 32 CG LYS A 2 -1.015 3.249 9.324 1.00 3.48 C ATOM 33 CD LYS A 2 -0.468 3.344 10.742 1.00 4.25 C ATOM 34 CE LYS A 2 -1.067 4.609 11.357 1.00 5.49 C ATOM 35 NZ LYS A 2 -0.392 4.980 12.619 1.00 6.71 N ATOM 36 H LYS A 2 -1.072 0.042 10.447 1.00 2.57 H ATOM 37 HA LYS A 2 -2.731 1.412 8.400 1.00 1.96 H ATOM 38 HB2 LYS A 2 0.274 1.536 8.981 1.00 3.20 H ATOM 39 HB3 LYS A 2 -0.532 2.189 7.551 1.00 3.72 H ATOM 40 HG2 LYS A 2 -0.575 4.075 8.767 1.00 4.42 H ATOM 41 HG3 LYS A 2 -2.098 3.370 9.343 1.00 3.72 H ATOM 42 HD2 LYS A 2 -0.755 2.470 11.323 1.00 4.01 H ATOM 43 HD3 LYS A 2 0.619 3.424 10.696 1.00 5.09 H ATOM 44 HE2 LYS A 2 -0.977 5.426 10.636 1.00 6.30 H ATOM 45 HE3 LYS A 2 -2.132 4.440 11.530 1.00 5.34 H ATOM 46 HZ1 LYS A 2 -0.393 4.201 13.262 1.00 6.95 H ATOM 47 HZ2 LYS A 2 -0.869 5.764 13.044 1.00 7.39 H ATOM 48 HZ3 LYS A 2 0.563 5.250 12.425 1.00 7.13 H ATOM 49 N SER A 3 -2.596 -0.773 7.136 1.00 0.85 N ATOM 50 CA SER A 3 -2.384 -1.660 6.018 1.00 0.79 C ATOM 51 C SER A 3 -1.868 -0.785 4.895 1.00 0.74 C ATOM 52 O SER A 3 -2.571 0.094 4.400 1.00 1.08 O ATOM 53 CB SER A 3 -3.680 -2.379 5.657 1.00 0.83 C ATOM 54 OG SER A 3 -4.171 -3.032 6.812 1.00 1.89 O ATOM 55 H SER A 3 -3.539 -0.473 7.345 1.00 1.81 H ATOM 56 HA SER A 3 -1.603 -2.380 6.275 1.00 0.78 H ATOM 57 HB2 SER A 3 -4.419 -1.659 5.303 1.00 1.84 H ATOM 58 HB3 SER A 3 -3.483 -3.111 4.873 1.00 1.34 H ATOM 59 HG SER A 3 -4.946 -3.544 6.565 1.00 2.43 H ATOM 60 N ILE A 4 -0.589 -0.975 4.595 1.00 0.39 N ATOM 61 CA ILE A 4 0.125 -0.208 3.606 1.00 0.28 C ATOM 62 C ILE A 4 -0.265 -0.769 2.246 1.00 0.26 C ATOM 63 O ILE A 4 -1.399 -1.174 2.002 1.00 0.39 O ATOM 64 CB ILE A 4 1.646 -0.245 3.882 1.00 0.38 C ATOM 65 CG1 ILE A 4 1.980 -0.234 5.377 1.00 0.55 C ATOM 66 CG2 ILE A 4 2.299 1.019 3.282 1.00 0.45 C ATOM 67 CD1 ILE A 4 2.291 -1.610 5.980 1.00 1.35 C ATOM 68 H ILE A 4 -0.081 -1.678 5.101 1.00 0.49 H ATOM 69 HA ILE A 4 -0.200 0.827 3.652 1.00 0.32 H ATOM 70 HB ILE A 4 2.093 -1.143 3.452 1.00 0.40 H ATOM 71 HG12 ILE A 4 2.871 0.358 5.505 1.00 0.98 H ATOM 72 HG13 ILE A 4 1.190 0.273 5.920 1.00 1.13 H ATOM 73 HG21 ILE A 4 2.035 1.888 3.887 1.00 1.57 H ATOM 74 HG22 ILE A 4 3.385 0.908 3.282 1.00 1.34 H ATOM 75 HG23 ILE A 4 1.969 1.220 2.265 1.00 1.26 H ATOM 76 HD11 ILE A 4 3.135 -2.058 5.454 1.00 2.04 H ATOM 77 HD12 ILE A 4 2.560 -1.485 7.030 1.00 2.04 H ATOM 78 HD13 ILE A 4 1.440 -2.283 5.920 1.00 2.05 H ATOM 79 N ASN A 5 0.697 -0.797 1.345 1.00 0.33 N ATOM 80 CA ASN A 5 0.510 -1.253 0.003 1.00 0.41 C ATOM 81 C ASN A 5 1.196 -2.604 -0.161 1.00 0.30 C ATOM 82 O ASN A 5 2.128 -2.914 0.574 1.00 0.31 O ATOM 83 CB ASN A 5 1.051 -0.164 -0.903 1.00 0.63 C ATOM 84 CG ASN A 5 0.938 -0.672 -2.303 1.00 0.55 C ATOM 85 OD1 ASN A 5 -0.114 -0.607 -2.918 1.00 0.55 O ATOM 86 ND2 ASN A 5 1.992 -1.305 -2.752 1.00 0.49 N ATOM 87 H ASN A 5 1.635 -0.551 1.612 1.00 0.37 H ATOM 88 HA ASN A 5 -0.539 -1.379 -0.243 1.00 0.46 H ATOM 89 HB2 ASN A 5 0.446 0.732 -0.805 1.00 0.80 H ATOM 90 HB3 ASN A 5 2.090 0.063 -0.661 1.00 0.71 H ATOM 91 HD21 ASN A 5 2.786 -1.502 -2.160 1.00 0.53 H ATOM 92 HD22 ASN A 5 1.986 -1.615 -3.699 1.00 0.43 H ATOM 93 N ILE A 6 0.713 -3.389 -1.127 1.00 0.24 N ATOM 94 CA ILE A 6 1.303 -4.641 -1.567 1.00 0.21 C ATOM 95 C ILE A 6 2.582 -4.294 -2.349 1.00 0.26 C ATOM 96 O ILE A 6 3.560 -3.837 -1.767 1.00 0.54 O ATOM 97 CB ILE A 6 0.236 -5.430 -2.363 1.00 0.28 C ATOM 98 CG1 ILE A 6 -1.050 -5.613 -1.530 1.00 0.41 C ATOM 99 CG2 ILE A 6 0.744 -6.817 -2.791 1.00 0.40 C ATOM 100 CD1 ILE A 6 -2.200 -6.162 -2.377 1.00 1.31 C ATOM 101 H ILE A 6 -0.048 -3.028 -1.684 1.00 0.31 H ATOM 102 HA ILE A 6 1.593 -5.226 -0.697 1.00 0.26 H ATOM 103 HB ILE A 6 -0.033 -4.856 -3.251 1.00 0.25 H ATOM 104 HG12 ILE A 6 -0.859 -6.283 -0.691 1.00 1.04 H ATOM 105 HG13 ILE A 6 -1.385 -4.657 -1.132 1.00 1.12 H ATOM 106 HG21 ILE A 6 1.730 -6.764 -3.246 1.00 1.16 H ATOM 107 HG22 ILE A 6 0.803 -7.474 -1.923 1.00 1.53 H ATOM 108 HG23 ILE A 6 0.065 -7.247 -3.526 1.00 1.37 H ATOM 109 HD11 ILE A 6 -3.117 -6.152 -1.787 1.00 2.14 H ATOM 110 HD12 ILE A 6 -1.996 -7.186 -2.685 1.00 1.99 H ATOM 111 HD13 ILE A 6 -2.334 -5.529 -3.256 1.00 2.26 H ATOM 112 N GLY A 7 2.580 -4.448 -3.674 1.00 0.18 N ATOM 113 CA GLY A 7 3.722 -4.142 -4.523 1.00 0.21 C ATOM 114 C GLY A 7 3.364 -2.972 -5.429 1.00 0.15 C ATOM 115 O GLY A 7 3.549 -1.822 -5.041 1.00 0.19 O ATOM 116 H GLY A 7 1.749 -4.806 -4.114 1.00 0.34 H ATOM 117 HA2 GLY A 7 4.585 -3.864 -3.918 1.00 0.29 H ATOM 118 HA3 GLY A 7 3.987 -5.017 -5.115 1.00 0.30 H ATOM 119 N PRO A 8 2.805 -3.224 -6.616 1.00 0.13 N ATOM 120 CA PRO A 8 2.395 -2.167 -7.521 1.00 0.20 C ATOM 121 C PRO A 8 1.156 -1.452 -6.972 1.00 0.24 C ATOM 122 O PRO A 8 0.030 -1.868 -7.228 1.00 0.31 O ATOM 123 CB PRO A 8 2.128 -2.878 -8.851 1.00 0.27 C ATOM 124 CG PRO A 8 1.689 -4.279 -8.421 1.00 0.24 C ATOM 125 CD PRO A 8 2.529 -4.536 -7.171 1.00 0.18 C ATOM 126 HA PRO A 8 3.203 -1.444 -7.650 1.00 0.24 H ATOM 127 HB2 PRO A 8 1.367 -2.375 -9.449 1.00 0.34 H ATOM 128 HB3 PRO A 8 3.061 -2.952 -9.411 1.00 0.31 H ATOM 129 HG2 PRO A 8 0.631 -4.271 -8.155 1.00 0.24 H ATOM 130 HG3 PRO A 8 1.882 -5.021 -9.196 1.00 0.31 H ATOM 131 HD2 PRO A 8 1.979 -5.160 -6.466 1.00 0.21 H ATOM 132 HD3 PRO A 8 3.469 -5.015 -7.450 1.00 0.23 H ATOM 133 N GLY A 9 1.354 -0.369 -6.219 1.00 0.23 N ATOM 134 CA GLY A 9 0.268 0.436 -5.682 1.00 0.25 C ATOM 135 C GLY A 9 0.821 1.461 -4.696 1.00 0.22 C ATOM 136 O GLY A 9 2.037 1.584 -4.546 1.00 0.29 O ATOM 137 H GLY A 9 2.293 -0.107 -5.938 1.00 0.21 H ATOM 138 HA2 GLY A 9 -0.241 0.955 -6.491 1.00 0.31 H ATOM 139 HA3 GLY A 9 -0.450 -0.212 -5.176 1.00 0.28 H ATOM 140 N ARG A 10 -0.062 2.191 -4.011 1.00 0.22 N ATOM 141 CA ARG A 10 0.281 3.035 -2.871 1.00 0.24 C ATOM 142 C ARG A 10 -0.899 3.014 -1.911 1.00 0.23 C ATOM 143 O ARG A 10 -2.002 2.642 -2.303 1.00 0.27 O ATOM 144 CB ARG A 10 0.584 4.477 -3.306 1.00 0.40 C ATOM 145 CG ARG A 10 1.833 4.562 -4.188 1.00 1.45 C ATOM 146 CD ARG A 10 2.257 6.017 -4.385 1.00 1.91 C ATOM 147 NE ARG A 10 3.427 6.098 -5.274 1.00 2.96 N ATOM 148 CZ ARG A 10 4.522 6.852 -5.106 1.00 3.67 C ATOM 149 NH1 ARG A 10 4.644 7.659 -4.051 1.00 4.01 N ATOM 150 NH2 ARG A 10 5.505 6.797 -6.006 1.00 4.83 N ATOM 151 H ARG A 10 -1.050 1.990 -4.114 1.00 0.27 H ATOM 152 HA ARG A 10 1.149 2.612 -2.363 1.00 0.24 H ATOM 153 HB2 ARG A 10 -0.272 4.886 -3.845 1.00 1.34 H ATOM 154 HB3 ARG A 10 0.750 5.081 -2.413 1.00 1.29 H ATOM 155 HG2 ARG A 10 2.650 4.021 -3.709 1.00 2.26 H ATOM 156 HG3 ARG A 10 1.623 4.117 -5.161 1.00 2.41 H ATOM 157 HD2 ARG A 10 1.431 6.573 -4.832 1.00 2.38 H ATOM 158 HD3 ARG A 10 2.477 6.443 -3.407 1.00 2.17 H ATOM 159 HE ARG A 10 3.371 5.495 -6.083 1.00 3.75 H ATOM 160 HH11 ARG A 10 3.906 7.713 -3.368 1.00 3.80 H ATOM 161 HH12 ARG A 10 5.462 8.229 -3.902 1.00 4.98 H ATOM 162 HH21 ARG A 10 5.439 6.193 -6.812 1.00 5.30 H ATOM 163 HH22 ARG A 10 6.343 7.350 -5.910 1.00 5.67 H ATOM 164 N ALA A 11 -0.674 3.427 -0.666 1.00 0.25 N ATOM 165 CA ALA A 11 -1.706 3.494 0.347 1.00 0.29 C ATOM 166 C ALA A 11 -1.416 4.708 1.218 1.00 0.36 C ATOM 167 O ALA A 11 -0.249 5.045 1.406 1.00 0.62 O ATOM 168 CB ALA A 11 -1.662 2.218 1.189 1.00 0.33 C ATOM 169 H ALA A 11 0.227 3.782 -0.378 1.00 0.28 H ATOM 170 HA ALA A 11 -2.680 3.593 -0.132 1.00 0.30 H ATOM 171 HB1 ALA A 11 -0.667 2.111 1.623 1.00 1.35 H ATOM 172 HB2 ALA A 11 -2.397 2.275 1.992 1.00 1.39 H ATOM 173 HB3 ALA A 11 -1.878 1.354 0.560 1.00 1.36 H ATOM 174 N PHE A 12 -2.456 5.345 1.757 1.00 0.40 N ATOM 175 CA PHE A 12 -2.303 6.483 2.647 1.00 0.46 C ATOM 176 C PHE A 12 -3.356 6.368 3.741 1.00 0.89 C ATOM 177 O PHE A 12 -4.451 6.912 3.620 1.00 1.17 O ATOM 178 CB PHE A 12 -2.438 7.796 1.868 1.00 0.74 C ATOM 179 CG PHE A 12 -1.317 8.052 0.880 1.00 1.27 C ATOM 180 CD1 PHE A 12 -0.128 8.668 1.313 1.00 2.49 C ATOM 181 CD2 PHE A 12 -1.453 7.673 -0.468 1.00 1.90 C ATOM 182 CE1 PHE A 12 0.915 8.910 0.403 1.00 3.05 C ATOM 183 CE2 PHE A 12 -0.409 7.912 -1.379 1.00 2.43 C ATOM 184 CZ PHE A 12 0.775 8.533 -0.944 1.00 2.64 C ATOM 185 H PHE A 12 -3.401 5.025 1.596 1.00 0.57 H ATOM 186 HA PHE A 12 -1.314 6.452 3.105 1.00 0.66 H ATOM 187 HB2 PHE A 12 -3.392 7.790 1.343 1.00 1.09 H ATOM 188 HB3 PHE A 12 -2.463 8.621 2.581 1.00 0.75 H ATOM 189 HD1 PHE A 12 -0.015 8.959 2.348 1.00 3.36 H ATOM 190 HD2 PHE A 12 -2.363 7.199 -0.806 1.00 2.68 H ATOM 191 HE1 PHE A 12 1.823 9.390 0.741 1.00 4.15 H ATOM 192 HE2 PHE A 12 -0.523 7.626 -2.414 1.00 3.27 H ATOM 193 HZ PHE A 12 1.574 8.730 -1.642 1.00 3.19 H ATOM 194 N TYR A 13 -3.014 5.624 4.790 1.00 1.36 N ATOM 195 CA TYR A 13 -3.818 5.387 5.979 1.00 1.92 C ATOM 196 C TYR A 13 -2.852 5.262 7.153 1.00 2.44 C ATOM 197 O TYR A 13 -1.647 5.091 6.860 1.00 2.75 O ATOM 198 CB TYR A 13 -4.632 4.095 5.823 1.00 2.49 C ATOM 199 CG TYR A 13 -5.601 4.095 4.657 1.00 2.03 C ATOM 200 CD1 TYR A 13 -6.881 4.657 4.807 1.00 2.78 C ATOM 201 CD2 TYR A 13 -5.219 3.539 3.422 1.00 2.40 C ATOM 202 CE1 TYR A 13 -7.782 4.661 3.728 1.00 3.18 C ATOM 203 CE2 TYR A 13 -6.109 3.548 2.333 1.00 2.55 C ATOM 204 CZ TYR A 13 -7.399 4.110 2.486 1.00 2.70 C ATOM 205 OH TYR A 13 -8.283 4.117 1.449 1.00 3.52 O ATOM 206 OXT TYR A 13 -3.321 5.312 8.310 1.00 3.12 O ATOM 207 H TYR A 13 -2.074 5.258 4.862 1.00 1.50 H ATOM 208 HA TYR A 13 -4.487 6.230 6.152 1.00 1.80 H ATOM 209 HB2 TYR A 13 -3.941 3.257 5.713 1.00 3.09 H ATOM 210 HB3 TYR A 13 -5.193 3.930 6.744 1.00 3.27 H ATOM 211 HD1 TYR A 13 -7.169 5.092 5.753 1.00 3.69 H ATOM 212 HD2 TYR A 13 -4.237 3.103 3.320 1.00 3.35 H ATOM 213 HE1 TYR A 13 -8.767 5.089 3.842 1.00 4.35 H ATOM 214 HE2 TYR A 13 -5.804 3.117 1.392 1.00 3.40 H ATOM 215 HH TYR A 13 -7.941 3.719 0.647 1.00 3.76 H TER 216 TYR A 13 ENDMDL MODEL 2 ATOM 1 N ARG A 1 -0.691 -1.819 13.888 1.00 5.44 N ATOM 2 CA ARG A 1 -0.054 -1.433 12.613 1.00 4.98 C ATOM 3 C ARG A 1 -1.167 -1.100 11.631 1.00 3.11 C ATOM 4 O ARG A 1 -2.198 -1.764 11.675 1.00 3.26 O ATOM 5 CB ARG A 1 0.861 -2.550 12.076 1.00 6.39 C ATOM 6 CG ARG A 1 2.181 -2.591 12.863 1.00 8.34 C ATOM 7 CD ARG A 1 3.266 -3.412 12.151 1.00 9.92 C ATOM 8 NE ARG A 1 3.134 -4.864 12.366 1.00 11.19 N ATOM 9 CZ ARG A 1 3.752 -5.806 11.635 1.00 12.75 C ATOM 10 NH1 ARG A 1 4.438 -5.469 10.542 1.00 13.22 N ATOM 11 NH2 ARG A 1 3.690 -7.086 12.003 1.00 14.12 N ATOM 12 H1 ARG A 1 -1.324 -2.589 13.709 1.00 5.39 H ATOM 13 H2 ARG A 1 0.001 -2.083 14.572 1.00 6.67 H ATOM 14 H3 ARG A 1 -1.238 -1.045 14.236 1.00 5.00 H ATOM 15 HA ARG A 1 0.545 -0.536 12.766 1.00 5.50 H ATOM 16 HB2 ARG A 1 0.357 -3.516 12.137 1.00 6.70 H ATOM 17 HB3 ARG A 1 1.086 -2.341 11.029 1.00 6.21 H ATOM 18 HG2 ARG A 1 2.552 -1.569 12.953 1.00 8.41 H ATOM 19 HG3 ARG A 1 2.015 -2.984 13.867 1.00 9.02 H ATOM 20 HD2 ARG A 1 3.236 -3.183 11.086 1.00 9.97 H ATOM 21 HD3 ARG A 1 4.238 -3.104 12.540 1.00 10.48 H ATOM 22 HE ARG A 1 2.631 -5.145 13.193 1.00 11.15 H ATOM 23 HH11 ARG A 1 4.497 -4.505 10.255 1.00 12.49 H ATOM 24 HH12 ARG A 1 4.910 -6.154 9.970 1.00 14.47 H ATOM 25 HH21 ARG A 1 3.202 -7.375 12.837 1.00 14.12 H ATOM 26 HH22 ARG A 1 4.156 -7.809 11.472 1.00 15.35 H ATOM 27 N LYS A 2 -1.017 -0.054 10.814 1.00 2.14 N ATOM 28 CA LYS A 2 -1.972 0.208 9.742 1.00 0.63 C ATOM 29 C LYS A 2 -1.619 -0.728 8.581 1.00 0.83 C ATOM 30 O LYS A 2 -0.537 -1.315 8.590 1.00 2.17 O ATOM 31 CB LYS A 2 -1.901 1.688 9.319 1.00 1.90 C ATOM 32 CG LYS A 2 -3.267 2.252 8.895 1.00 3.37 C ATOM 33 CD LYS A 2 -3.993 2.983 10.034 1.00 4.60 C ATOM 34 CE LYS A 2 -4.224 2.089 11.257 1.00 5.03 C ATOM 35 NZ LYS A 2 -5.025 2.782 12.292 1.00 6.59 N ATOM 36 H LYS A 2 -0.131 0.427 10.753 1.00 3.17 H ATOM 37 HA LYS A 2 -2.975 -0.038 10.092 1.00 1.61 H ATOM 38 HB2 LYS A 2 -1.512 2.296 10.138 1.00 2.41 H ATOM 39 HB3 LYS A 2 -1.204 1.785 8.484 1.00 2.86 H ATOM 40 HG2 LYS A 2 -3.109 2.970 8.090 1.00 4.22 H ATOM 41 HG3 LYS A 2 -3.901 1.453 8.513 1.00 4.01 H ATOM 42 HD2 LYS A 2 -3.403 3.854 10.327 1.00 4.99 H ATOM 43 HD3 LYS A 2 -4.954 3.337 9.655 1.00 5.76 H ATOM 44 HE2 LYS A 2 -4.746 1.183 10.942 1.00 5.48 H ATOM 45 HE3 LYS A 2 -3.255 1.806 11.673 1.00 4.60 H ATOM 46 HZ1 LYS A 2 -5.946 2.995 11.930 1.00 7.49 H ATOM 47 HZ2 LYS A 2 -5.127 2.195 13.109 1.00 6.90 H ATOM 48 HZ3 LYS A 2 -4.578 3.648 12.561 1.00 6.95 H ATOM 49 N SER A 3 -2.501 -0.871 7.594 1.00 0.62 N ATOM 50 CA SER A 3 -2.184 -1.615 6.386 1.00 0.55 C ATOM 51 C SER A 3 -1.634 -0.630 5.364 1.00 0.45 C ATOM 52 O SER A 3 -2.126 0.492 5.262 1.00 0.55 O ATOM 53 CB SER A 3 -3.441 -2.310 5.861 1.00 0.64 C ATOM 54 OG SER A 3 -3.096 -3.280 4.895 1.00 1.85 O ATOM 55 H SER A 3 -3.336 -0.305 7.566 1.00 1.67 H ATOM 56 HA SER A 3 -1.421 -2.366 6.601 1.00 0.59 H ATOM 57 HB2 SER A 3 -3.958 -2.806 6.684 1.00 1.35 H ATOM 58 HB3 SER A 3 -4.110 -1.572 5.416 1.00 1.55 H ATOM 59 HG SER A 3 -2.881 -4.108 5.332 1.00 2.16 H ATOM 60 N ILE A 4 -0.589 -1.041 4.649 1.00 0.39 N ATOM 61 CA ILE A 4 0.051 -0.259 3.612 1.00 0.31 C ATOM 62 C ILE A 4 -0.531 -0.690 2.263 1.00 0.28 C ATOM 63 O ILE A 4 -1.732 -0.892 2.116 1.00 0.41 O ATOM 64 CB ILE A 4 1.579 -0.429 3.724 1.00 0.36 C ATOM 65 CG1 ILE A 4 2.031 -0.512 5.183 1.00 0.49 C ATOM 66 CG2 ILE A 4 2.284 0.792 3.097 1.00 0.37 C ATOM 67 CD1 ILE A 4 2.053 -1.934 5.765 1.00 1.48 C ATOM 68 H ILE A 4 -0.175 -1.938 4.833 1.00 0.46 H ATOM 69 HA ILE A 4 -0.166 0.793 3.752 1.00 0.30 H ATOM 70 HB ILE A 4 1.903 -1.350 3.240 1.00 0.38 H ATOM 71 HG12 ILE A 4 3.041 -0.142 5.211 1.00 0.77 H ATOM 72 HG13 ILE A 4 1.421 0.149 5.797 1.00 0.96 H ATOM 73 HG21 ILE A 4 1.882 1.048 2.118 1.00 1.36 H ATOM 74 HG22 ILE A 4 2.153 1.661 3.743 1.00 1.46 H ATOM 75 HG23 ILE A 4 3.351 0.589 2.994 1.00 1.47 H ATOM 76 HD11 ILE A 4 1.627 -2.656 5.069 1.00 2.49 H ATOM 77 HD12 ILE A 4 3.085 -2.226 5.965 1.00 2.15 H ATOM 78 HD13 ILE A 4 1.495 -1.958 6.700 1.00 2.18 H ATOM 79 N ASN A 5 0.340 -0.833 1.275 1.00 0.22 N ATOM 80 CA ASN A 5 0.059 -1.310 -0.060 1.00 0.19 C ATOM 81 C ASN A 5 0.810 -2.625 -0.252 1.00 0.22 C ATOM 82 O ASN A 5 1.742 -2.907 0.496 1.00 0.29 O ATOM 83 CB ASN A 5 0.459 -0.200 -1.028 1.00 0.20 C ATOM 84 CG ASN A 5 0.486 -0.684 -2.451 1.00 0.19 C ATOM 85 OD1 ASN A 5 -0.477 -0.555 -3.194 1.00 0.27 O ATOM 86 ND2 ASN A 5 1.603 -1.267 -2.822 1.00 0.19 N ATOM 87 H ASN A 5 1.313 -0.694 1.488 1.00 0.26 H ATOM 88 HA ASN A 5 -0.990 -1.508 -0.217 1.00 0.23 H ATOM 89 HB2 ASN A 5 -0.268 0.602 -0.966 1.00 0.25 H ATOM 90 HB3 ASN A 5 1.441 0.193 -0.767 1.00 0.24 H ATOM 91 HD21 ASN A 5 2.303 -1.501 -2.131 1.00 0.23 H ATOM 92 HD22 ASN A 5 1.772 -1.456 -3.791 1.00 0.23 H ATOM 93 N ILE A 6 0.387 -3.417 -1.242 1.00 0.22 N ATOM 94 CA ILE A 6 1.065 -4.618 -1.714 1.00 0.27 C ATOM 95 C ILE A 6 2.368 -4.177 -2.408 1.00 0.24 C ATOM 96 O ILE A 6 3.223 -3.546 -1.792 1.00 0.37 O ATOM 97 CB ILE A 6 0.089 -5.399 -2.630 1.00 0.31 C ATOM 98 CG1 ILE A 6 -1.216 -5.757 -1.893 1.00 0.38 C ATOM 99 CG2 ILE A 6 0.704 -6.702 -3.183 1.00 0.39 C ATOM 100 CD1 ILE A 6 -2.350 -6.014 -2.893 1.00 1.51 C ATOM 101 H ILE A 6 -0.405 -3.114 -1.790 1.00 0.22 H ATOM 102 HA ILE A 6 1.324 -5.236 -0.852 1.00 0.34 H ATOM 103 HB ILE A 6 -0.176 -4.751 -3.468 1.00 0.30 H ATOM 104 HG12 ILE A 6 -1.052 -6.638 -1.276 1.00 0.91 H ATOM 105 HG13 ILE A 6 -1.537 -4.951 -1.235 1.00 0.98 H ATOM 106 HG21 ILE A 6 0.030 -7.546 -3.033 1.00 1.72 H ATOM 107 HG22 ILE A 6 0.877 -6.620 -4.256 1.00 1.84 H ATOM 108 HG23 ILE A 6 1.642 -6.931 -2.675 1.00 1.50 H ATOM 109 HD11 ILE A 6 -1.997 -6.610 -3.734 1.00 2.41 H ATOM 110 HD12 ILE A 6 -3.164 -6.542 -2.396 1.00 2.08 H ATOM 111 HD13 ILE A 6 -2.724 -5.060 -3.269 1.00 2.54 H ATOM 112 N GLY A 7 2.526 -4.451 -3.703 1.00 0.21 N ATOM 113 CA GLY A 7 3.712 -4.083 -4.456 1.00 0.21 C ATOM 114 C GLY A 7 3.368 -2.922 -5.378 1.00 0.15 C ATOM 115 O GLY A 7 3.503 -1.769 -4.979 1.00 0.19 O ATOM 116 H GLY A 7 1.778 -4.900 -4.202 1.00 0.30 H ATOM 117 HA2 GLY A 7 4.513 -3.772 -3.784 1.00 0.27 H ATOM 118 HA3 GLY A 7 4.063 -4.937 -5.034 1.00 0.25 H ATOM 119 N PRO A 8 2.886 -3.198 -6.595 1.00 0.16 N ATOM 120 CA PRO A 8 2.589 -2.170 -7.576 1.00 0.26 C ATOM 121 C PRO A 8 1.357 -1.367 -7.148 1.00 0.26 C ATOM 122 O PRO A 8 0.233 -1.699 -7.511 1.00 0.32 O ATOM 123 CB PRO A 8 2.383 -2.932 -8.890 1.00 0.33 C ATOM 124 CG PRO A 8 1.855 -4.292 -8.430 1.00 0.28 C ATOM 125 CD PRO A 8 2.596 -4.522 -7.114 1.00 0.18 C ATOM 126 HA PRO A 8 3.439 -1.493 -7.681 1.00 0.31 H ATOM 127 HB2 PRO A 8 1.689 -2.429 -9.563 1.00 0.41 H ATOM 128 HB3 PRO A 8 3.348 -3.070 -9.378 1.00 0.36 H ATOM 129 HG2 PRO A 8 0.782 -4.228 -8.241 1.00 0.31 H ATOM 130 HG3 PRO A 8 2.070 -5.077 -9.156 1.00 0.31 H ATOM 131 HD2 PRO A 8 1.970 -5.089 -6.425 1.00 0.19 H ATOM 132 HD3 PRO A 8 3.531 -5.052 -7.304 1.00 0.20 H ATOM 133 N GLY A 9 1.569 -0.302 -6.375 1.00 0.25 N ATOM 134 CA GLY A 9 0.515 0.575 -5.903 1.00 0.29 C ATOM 135 C GLY A 9 1.069 1.502 -4.826 1.00 0.25 C ATOM 136 O GLY A 9 2.281 1.618 -4.662 1.00 0.33 O ATOM 137 H GLY A 9 2.502 -0.112 -6.020 1.00 0.24 H ATOM 138 HA2 GLY A 9 0.142 1.176 -6.732 1.00 0.39 H ATOM 139 HA3 GLY A 9 -0.306 -0.014 -5.497 1.00 0.28 H ATOM 140 N ARG A 10 0.180 2.169 -4.093 1.00 0.22 N ATOM 141 CA ARG A 10 0.516 3.022 -2.962 1.00 0.21 C ATOM 142 C ARG A 10 -0.701 3.073 -2.052 1.00 0.19 C ATOM 143 O ARG A 10 -1.801 2.743 -2.490 1.00 0.23 O ATOM 144 CB ARG A 10 0.905 4.429 -3.448 1.00 0.34 C ATOM 145 CG ARG A 10 -0.190 5.062 -4.329 1.00 2.14 C ATOM 146 CD ARG A 10 -0.569 6.475 -3.876 1.00 3.16 C ATOM 147 NE ARG A 10 0.390 7.489 -4.341 1.00 3.67 N ATOM 148 CZ ARG A 10 0.154 8.809 -4.343 1.00 5.10 C ATOM 149 NH1 ARG A 10 -0.968 9.287 -3.804 1.00 6.25 N ATOM 150 NH2 ARG A 10 1.038 9.647 -4.884 1.00 5.91 N ATOM 151 H ARG A 10 -0.805 1.953 -4.203 1.00 0.27 H ATOM 152 HA ARG A 10 1.341 2.576 -2.404 1.00 0.23 H ATOM 153 HB2 ARG A 10 1.097 5.059 -2.579 1.00 1.70 H ATOM 154 HB3 ARG A 10 1.829 4.364 -4.022 1.00 1.72 H ATOM 155 HG2 ARG A 10 0.141 5.083 -5.368 1.00 2.88 H ATOM 156 HG3 ARG A 10 -1.096 4.461 -4.292 1.00 3.11 H ATOM 157 HD2 ARG A 10 -1.550 6.705 -4.294 1.00 3.98 H ATOM 158 HD3 ARG A 10 -0.642 6.497 -2.789 1.00 3.58 H ATOM 159 HE ARG A 10 1.251 7.131 -4.731 1.00 3.56 H ATOM 160 HH11 ARG A 10 -1.641 8.655 -3.400 1.00 6.13 H ATOM 161 HH12 ARG A 10 -1.179 10.273 -3.781 1.00 7.53 H ATOM 162 HH21 ARG A 10 1.886 9.307 -5.312 1.00 5.73 H ATOM 163 HH22 ARG A 10 0.875 10.643 -4.906 1.00 7.07 H ATOM 164 N ALA A 11 -0.525 3.503 -0.806 1.00 0.19 N ATOM 165 CA ALA A 11 -1.628 3.602 0.125 1.00 0.21 C ATOM 166 C ALA A 11 -1.426 4.832 0.985 1.00 0.26 C ATOM 167 O ALA A 11 -0.312 5.076 1.438 1.00 0.62 O ATOM 168 CB ALA A 11 -1.653 2.380 1.032 1.00 0.27 C ATOM 169 H ALA A 11 0.374 3.814 -0.462 1.00 0.24 H ATOM 170 HA ALA A 11 -2.570 3.670 -0.422 1.00 0.22 H ATOM 171 HB1 ALA A 11 -2.420 2.523 1.795 1.00 1.63 H ATOM 172 HB2 ALA A 11 -1.875 1.490 0.445 1.00 1.64 H ATOM 173 HB3 ALA A 11 -0.681 2.277 1.517 1.00 1.56 H ATOM 174 N PHE A 12 -2.510 5.559 1.233 1.00 0.45 N ATOM 175 CA PHE A 12 -2.554 6.648 2.187 1.00 0.36 C ATOM 176 C PHE A 12 -3.976 6.667 2.742 1.00 1.11 C ATOM 177 O PHE A 12 -4.869 7.261 2.145 1.00 1.66 O ATOM 178 CB PHE A 12 -2.177 7.966 1.502 1.00 0.78 C ATOM 179 CG PHE A 12 -0.723 8.045 1.066 1.00 1.54 C ATOM 180 CD1 PHE A 12 0.294 8.129 2.034 1.00 3.08 C ATOM 181 CD2 PHE A 12 -0.380 8.005 -0.298 1.00 2.44 C ATOM 182 CE1 PHE A 12 1.642 8.210 1.641 1.00 3.85 C ATOM 183 CE2 PHE A 12 0.968 8.088 -0.693 1.00 3.02 C ATOM 184 CZ PHE A 12 1.978 8.198 0.277 1.00 3.30 C ATOM 185 H PHE A 12 -3.397 5.285 0.835 1.00 0.81 H ATOM 186 HA PHE A 12 -1.853 6.458 3.000 1.00 0.67 H ATOM 187 HB2 PHE A 12 -2.827 8.108 0.639 1.00 1.32 H ATOM 188 HB3 PHE A 12 -2.367 8.787 2.195 1.00 0.63 H ATOM 189 HD1 PHE A 12 0.038 8.110 3.082 1.00 4.14 H ATOM 190 HD2 PHE A 12 -1.161 7.896 -1.033 1.00 3.52 H ATOM 191 HE1 PHE A 12 2.418 8.274 2.390 1.00 5.30 H ATOM 192 HE2 PHE A 12 1.238 8.063 -1.736 1.00 4.07 H ATOM 193 HZ PHE A 12 3.016 8.260 -0.021 1.00 4.00 H ATOM 194 N TYR A 13 -4.170 5.959 3.853 1.00 1.53 N ATOM 195 CA TYR A 13 -5.397 5.877 4.630 1.00 2.23 C ATOM 196 C TYR A 13 -4.985 6.007 6.093 1.00 2.75 C ATOM 197 O TYR A 13 -3.807 5.683 6.370 1.00 2.72 O ATOM 198 CB TYR A 13 -6.096 4.523 4.435 1.00 2.57 C ATOM 199 CG TYR A 13 -6.795 4.281 3.109 1.00 2.47 C ATOM 200 CD1 TYR A 13 -6.057 3.874 1.982 1.00 3.16 C ATOM 201 CD2 TYR A 13 -8.199 4.363 3.031 1.00 3.20 C ATOM 202 CE1 TYR A 13 -6.716 3.547 0.783 1.00 3.76 C ATOM 203 CE2 TYR A 13 -8.868 4.027 1.840 1.00 3.45 C ATOM 204 CZ TYR A 13 -8.124 3.613 0.710 1.00 3.44 C ATOM 205 OH TYR A 13 -8.756 3.256 -0.444 1.00 4.23 O ATOM 206 OXT TYR A 13 -5.853 6.388 6.904 1.00 3.69 O ATOM 207 H TYR A 13 -3.379 5.545 4.329 1.00 1.60 H ATOM 208 HA TYR A 13 -6.074 6.692 4.370 1.00 2.46 H ATOM 209 HB2 TYR A 13 -5.366 3.729 4.595 1.00 2.86 H ATOM 210 HB3 TYR A 13 -6.841 4.423 5.227 1.00 3.32 H ATOM 211 HD1 TYR A 13 -4.983 3.791 2.055 1.00 3.95 H ATOM 212 HD2 TYR A 13 -8.769 4.662 3.898 1.00 4.23 H ATOM 213 HE1 TYR A 13 -6.155 3.222 -0.081 1.00 4.98 H ATOM 214 HE2 TYR A 13 -9.946 4.078 1.806 1.00 4.37 H ATOM 215 HH TYR A 13 -9.712 3.263 -0.378 1.00 4.49 H TER 216 TYR A 13 ENDMDL MODEL 3 ATOM 1 N ARG A 1 -5.155 3.267 8.757 1.00 6.39 N ATOM 2 CA ARG A 1 -4.892 2.564 10.026 1.00 4.81 C ATOM 3 C ARG A 1 -3.429 2.141 10.098 1.00 3.03 C ATOM 4 O ARG A 1 -2.683 2.749 10.853 1.00 3.46 O ATOM 5 CB ARG A 1 -5.832 1.371 10.289 1.00 5.57 C ATOM 6 CG ARG A 1 -7.217 1.802 10.798 1.00 6.80 C ATOM 7 CD ARG A 1 -7.940 0.610 11.448 1.00 7.78 C ATOM 8 NE ARG A 1 -9.254 0.991 11.993 1.00 9.13 N ATOM 9 CZ ARG A 1 -10.437 0.908 11.366 1.00 10.56 C ATOM 10 NH1 ARG A 1 -10.508 0.457 10.113 1.00 11.11 N ATOM 11 NH2 ARG A 1 -11.552 1.278 11.996 1.00 11.76 N ATOM 12 H1 ARG A 1 -4.954 2.660 7.977 1.00 6.67 H ATOM 13 H2 ARG A 1 -6.108 3.592 8.711 1.00 7.59 H ATOM 14 H3 ARG A 1 -4.529 4.061 8.691 1.00 6.53 H ATOM 15 HA ARG A 1 -5.030 3.282 10.836 1.00 5.26 H ATOM 16 HB2 ARG A 1 -5.943 0.765 9.388 1.00 6.30 H ATOM 17 HB3 ARG A 1 -5.378 0.751 11.063 1.00 5.30 H ATOM 18 HG2 ARG A 1 -7.096 2.584 11.548 1.00 7.00 H ATOM 19 HG3 ARG A 1 -7.813 2.190 9.971 1.00 7.30 H ATOM 20 HD2 ARG A 1 -8.046 -0.200 10.727 1.00 8.11 H ATOM 21 HD3 ARG A 1 -7.329 0.240 12.274 1.00 7.60 H ATOM 22 HE ARG A 1 -9.235 1.314 12.951 1.00 9.20 H ATOM 23 HH11 ARG A 1 -9.675 0.154 9.635 1.00 10.47 H ATOM 24 HH12 ARG A 1 -11.385 0.383 9.620 1.00 12.38 H ATOM 25 HH21 ARG A 1 -11.532 1.619 12.947 1.00 11.75 H ATOM 26 HH22 ARG A 1 -12.456 1.227 11.548 1.00 12.88 H ATOM 27 N LYS A 2 -3.043 1.065 9.398 1.00 1.93 N ATOM 28 CA LYS A 2 -1.677 0.542 9.435 1.00 0.78 C ATOM 29 C LYS A 2 -1.323 -0.193 8.148 1.00 1.01 C ATOM 30 O LYS A 2 -0.214 -0.042 7.653 1.00 2.40 O ATOM 31 CB LYS A 2 -1.458 -0.392 10.637 1.00 2.02 C ATOM 32 CG LYS A 2 -0.948 0.368 11.871 1.00 3.01 C ATOM 33 CD LYS A 2 -0.564 -0.583 13.008 1.00 4.62 C ATOM 34 CE LYS A 2 0.706 -1.373 12.673 1.00 5.87 C ATOM 35 NZ LYS A 2 0.979 -2.419 13.682 1.00 7.54 N ATOM 36 H LYS A 2 -3.687 0.621 8.762 1.00 2.95 H ATOM 37 HA LYS A 2 -0.989 1.386 9.503 1.00 2.02 H ATOM 38 HB2 LYS A 2 -2.385 -0.917 10.878 1.00 2.88 H ATOM 39 HB3 LYS A 2 -0.712 -1.135 10.361 1.00 3.03 H ATOM 40 HG2 LYS A 2 -0.080 0.970 11.600 1.00 3.56 H ATOM 41 HG3 LYS A 2 -1.732 1.025 12.241 1.00 3.22 H ATOM 42 HD2 LYS A 2 -0.385 0.011 13.908 1.00 5.05 H ATOM 43 HD3 LYS A 2 -1.396 -1.261 13.196 1.00 5.36 H ATOM 44 HE2 LYS A 2 0.593 -1.843 11.696 1.00 6.05 H ATOM 45 HE3 LYS A 2 1.549 -0.679 12.623 1.00 6.10 H ATOM 46 HZ1 LYS A 2 1.828 -2.914 13.443 1.00 8.40 H ATOM 47 HZ2 LYS A 2 1.089 -2.003 14.596 1.00 7.95 H ATOM 48 HZ3 LYS A 2 0.214 -3.081 13.710 1.00 7.90 H ATOM 49 N SER A 3 -2.224 -1.037 7.642 1.00 0.49 N ATOM 50 CA SER A 3 -1.989 -1.765 6.406 1.00 0.45 C ATOM 51 C SER A 3 -1.607 -0.800 5.291 1.00 0.43 C ATOM 52 O SER A 3 -2.307 0.183 5.049 1.00 0.58 O ATOM 53 CB SER A 3 -3.249 -2.541 6.034 1.00 0.52 C ATOM 54 OG SER A 3 -3.624 -3.349 7.131 1.00 1.86 O ATOM 55 H SER A 3 -3.078 -1.253 8.129 1.00 1.59 H ATOM 56 HA SER A 3 -1.166 -2.462 6.565 1.00 0.47 H ATOM 57 HB2 SER A 3 -4.055 -1.841 5.813 1.00 1.41 H ATOM 58 HB3 SER A 3 -3.060 -3.159 5.154 1.00 1.30 H ATOM 59 HG SER A 3 -3.323 -4.248 6.964 1.00 2.34 H ATOM 60 N ILE A 4 -0.479 -1.090 4.645 1.00 0.32 N ATOM 61 CA ILE A 4 0.080 -0.290 3.585 1.00 0.28 C ATOM 62 C ILE A 4 -0.486 -0.815 2.266 1.00 0.24 C ATOM 63 O ILE A 4 -1.661 -1.162 2.160 1.00 0.30 O ATOM 64 CB ILE A 4 1.619 -0.324 3.669 1.00 0.31 C ATOM 65 CG1 ILE A 4 2.139 -0.315 5.110 1.00 0.40 C ATOM 66 CG2 ILE A 4 2.190 0.944 2.999 1.00 0.35 C ATOM 67 CD1 ILE A 4 2.258 -1.689 5.788 1.00 1.35 C ATOM 68 H ILE A 4 0.061 -1.896 4.906 1.00 0.32 H ATOM 69 HA ILE A 4 -0.216 0.745 3.709 1.00 0.31 H ATOM 70 HB ILE A 4 2.018 -1.218 3.187 1.00 0.30 H ATOM 71 HG12 ILE A 4 3.137 0.085 5.053 1.00 0.83 H ATOM 72 HG13 ILE A 4 1.547 0.366 5.717 1.00 0.90 H ATOM 73 HG21 ILE A 4 3.268 0.844 2.873 1.00 1.59 H ATOM 74 HG22 ILE A 4 1.744 1.139 2.025 1.00 1.81 H ATOM 75 HG23 ILE A 4 1.990 1.811 3.631 1.00 1.79 H ATOM 76 HD11 ILE A 4 2.511 -2.455 5.055 1.00 2.20 H ATOM 77 HD12 ILE A 4 3.051 -1.649 6.535 1.00 1.99 H ATOM 78 HD13 ILE A 4 1.336 -1.955 6.302 1.00 2.07 H ATOM 79 N ASN A 5 0.370 -0.888 1.261 1.00 0.21 N ATOM 80 CA ASN A 5 0.105 -1.390 -0.062 1.00 0.17 C ATOM 81 C ASN A 5 0.920 -2.665 -0.259 1.00 0.15 C ATOM 82 O ASN A 5 1.848 -2.922 0.504 1.00 0.22 O ATOM 83 CB ASN A 5 0.441 -0.257 -1.020 1.00 0.20 C ATOM 84 CG ASN A 5 0.399 -0.719 -2.446 1.00 0.19 C ATOM 85 OD1 ASN A 5 -0.622 -0.646 -3.110 1.00 0.23 O ATOM 86 ND2 ASN A 5 1.521 -1.226 -2.901 1.00 0.19 N ATOM 87 H ASN A 5 1.332 -0.649 1.435 1.00 0.23 H ATOM 88 HA ASN A 5 -0.937 -1.637 -0.214 1.00 0.19 H ATOM 89 HB2 ASN A 5 -0.298 0.527 -0.903 1.00 0.25 H ATOM 90 HB3 ASN A 5 1.429 0.148 -0.798 1.00 0.24 H ATOM 91 HD21 ASN A 5 2.279 -1.431 -2.261 1.00 0.20 H ATOM 92 HD22 ASN A 5 1.635 -1.418 -3.876 1.00 0.21 H ATOM 93 N ILE A 6 0.551 -3.457 -1.266 1.00 0.14 N ATOM 94 CA ILE A 6 1.297 -4.614 -1.737 1.00 0.18 C ATOM 95 C ILE A 6 2.537 -4.073 -2.478 1.00 0.19 C ATOM 96 O ILE A 6 3.286 -3.267 -1.933 1.00 0.41 O ATOM 97 CB ILE A 6 0.357 -5.472 -2.620 1.00 0.23 C ATOM 98 CG1 ILE A 6 -0.969 -5.806 -1.904 1.00 0.31 C ATOM 99 CG2 ILE A 6 0.998 -6.800 -3.063 1.00 0.28 C ATOM 100 CD1 ILE A 6 -1.993 -6.419 -2.864 1.00 1.45 C ATOM 101 H ILE A 6 -0.222 -3.157 -1.843 1.00 0.18 H ATOM 102 HA ILE A 6 1.626 -5.200 -0.877 1.00 0.23 H ATOM 103 HB ILE A 6 0.113 -4.886 -3.510 1.00 0.25 H ATOM 104 HG12 ILE A 6 -0.778 -6.498 -1.083 1.00 0.92 H ATOM 105 HG13 ILE A 6 -1.420 -4.907 -1.489 1.00 0.97 H ATOM 106 HG21 ILE A 6 0.642 -7.052 -4.062 1.00 1.42 H ATOM 107 HG22 ILE A 6 2.084 -6.750 -3.075 1.00 1.52 H ATOM 108 HG23 ILE A 6 0.726 -7.601 -2.376 1.00 1.48 H ATOM 109 HD11 ILE A 6 -1.611 -7.342 -3.299 1.00 2.53 H ATOM 110 HD12 ILE A 6 -2.912 -6.640 -2.320 1.00 1.97 H ATOM 111 HD13 ILE A 6 -2.217 -5.709 -3.661 1.00 2.41 H ATOM 112 N GLY A 7 2.747 -4.456 -3.739 1.00 0.21 N ATOM 113 CA GLY A 7 3.867 -3.984 -4.534 1.00 0.19 C ATOM 114 C GLY A 7 3.392 -2.851 -5.433 1.00 0.13 C ATOM 115 O GLY A 7 3.469 -1.689 -5.043 1.00 0.14 O ATOM 116 H GLY A 7 2.087 -5.074 -4.183 1.00 0.37 H ATOM 117 HA2 GLY A 7 4.663 -3.613 -3.887 1.00 0.22 H ATOM 118 HA3 GLY A 7 4.266 -4.801 -5.134 1.00 0.26 H ATOM 119 N PRO A 8 2.864 -3.162 -6.621 1.00 0.15 N ATOM 120 CA PRO A 8 2.448 -2.161 -7.588 1.00 0.18 C ATOM 121 C PRO A 8 1.209 -1.417 -7.084 1.00 0.18 C ATOM 122 O PRO A 8 0.082 -1.834 -7.337 1.00 0.24 O ATOM 123 CB PRO A 8 2.192 -2.947 -8.879 1.00 0.24 C ATOM 124 CG PRO A 8 1.778 -4.330 -8.375 1.00 0.23 C ATOM 125 CD PRO A 8 2.636 -4.506 -7.124 1.00 0.21 C ATOM 126 HA PRO A 8 3.254 -1.445 -7.755 1.00 0.21 H ATOM 127 HB2 PRO A 8 1.421 -2.491 -9.502 1.00 0.29 H ATOM 128 HB3 PRO A 8 3.124 -3.036 -9.436 1.00 0.27 H ATOM 129 HG2 PRO A 8 0.723 -4.324 -8.097 1.00 0.25 H ATOM 130 HG3 PRO A 8 1.975 -5.110 -9.113 1.00 0.27 H ATOM 131 HD2 PRO A 8 2.113 -5.123 -6.394 1.00 0.24 H ATOM 132 HD3 PRO A 8 3.591 -4.960 -7.393 1.00 0.26 H ATOM 133 N GLY A 9 1.411 -0.312 -6.364 1.00 0.16 N ATOM 134 CA GLY A 9 0.332 0.493 -5.818 1.00 0.17 C ATOM 135 C GLY A 9 0.881 1.485 -4.797 1.00 0.17 C ATOM 136 O GLY A 9 2.095 1.639 -4.662 1.00 0.29 O ATOM 137 H GLY A 9 2.352 -0.053 -6.085 1.00 0.18 H ATOM 138 HA2 GLY A 9 -0.164 1.039 -6.619 1.00 0.22 H ATOM 139 HA3 GLY A 9 -0.396 -0.164 -5.341 1.00 0.18 H ATOM 140 N ARG A 10 -0.010 2.148 -4.061 1.00 0.18 N ATOM 141 CA ARG A 10 0.316 2.918 -2.867 1.00 0.24 C ATOM 142 C ARG A 10 -0.895 2.896 -1.953 1.00 0.26 C ATOM 143 O ARG A 10 -1.991 2.536 -2.374 1.00 0.28 O ATOM 144 CB ARG A 10 0.666 4.378 -3.198 1.00 0.41 C ATOM 145 CG ARG A 10 2.139 4.606 -3.557 1.00 1.60 C ATOM 146 CD ARG A 10 2.555 5.957 -2.956 1.00 2.25 C ATOM 147 NE ARG A 10 3.790 6.491 -3.547 1.00 3.15 N ATOM 148 CZ ARG A 10 4.407 7.598 -3.113 1.00 4.16 C ATOM 149 NH1 ARG A 10 3.999 8.196 -1.992 1.00 4.88 N ATOM 150 NH2 ARG A 10 5.426 8.112 -3.803 1.00 5.16 N ATOM 151 H ARG A 10 -0.993 1.923 -4.168 1.00 0.25 H ATOM 152 HA ARG A 10 1.139 2.438 -2.334 1.00 0.26 H ATOM 153 HB2 ARG A 10 0.029 4.740 -4.006 1.00 1.22 H ATOM 154 HB3 ARG A 10 0.444 4.987 -2.320 1.00 1.42 H ATOM 155 HG2 ARG A 10 2.766 3.823 -3.129 1.00 2.52 H ATOM 156 HG3 ARG A 10 2.253 4.613 -4.641 1.00 2.41 H ATOM 157 HD2 ARG A 10 1.756 6.681 -3.125 1.00 2.54 H ATOM 158 HD3 ARG A 10 2.688 5.824 -1.881 1.00 2.85 H ATOM 159 HE ARG A 10 4.124 6.013 -4.371 1.00 3.65 H ATOM 160 HH11 ARG A 10 3.240 7.799 -1.458 1.00 4.70 H ATOM 161 HH12 ARG A 10 4.441 9.028 -1.630 1.00 6.00 H ATOM 162 HH21 ARG A 10 5.735 7.687 -4.664 1.00 5.39 H ATOM 163 HH22 ARG A 10 5.898 8.951 -3.503 1.00 6.08 H ATOM 164 N ALA A 11 -0.684 3.311 -0.709 1.00 0.29 N ATOM 165 CA ALA A 11 -1.727 3.479 0.275 1.00 0.27 C ATOM 166 C ALA A 11 -1.432 4.769 1.032 1.00 0.27 C ATOM 167 O ALA A 11 -0.321 5.292 0.938 1.00 0.58 O ATOM 168 CB ALA A 11 -1.727 2.271 1.210 1.00 0.33 C ATOM 169 H ALA A 11 0.217 3.675 -0.433 1.00 0.30 H ATOM 170 HA ALA A 11 -2.685 3.560 -0.237 1.00 0.26 H ATOM 171 HB1 ALA A 11 -2.476 2.400 1.991 1.00 1.72 H ATOM 172 HB2 ALA A 11 -1.954 1.371 0.638 1.00 1.60 H ATOM 173 HB3 ALA A 11 -0.741 2.171 1.664 1.00 1.55 H ATOM 174 N PHE A 12 -2.417 5.282 1.770 1.00 0.43 N ATOM 175 CA PHE A 12 -2.314 6.572 2.433 1.00 0.32 C ATOM 176 C PHE A 12 -3.020 6.458 3.785 1.00 0.98 C ATOM 177 O PHE A 12 -4.097 7.018 3.973 1.00 1.31 O ATOM 178 CB PHE A 12 -2.969 7.647 1.551 1.00 0.81 C ATOM 179 CG PHE A 12 -2.396 7.783 0.150 1.00 1.64 C ATOM 180 CD1 PHE A 12 -2.900 6.992 -0.902 1.00 3.49 C ATOM 181 CD2 PHE A 12 -1.378 8.719 -0.114 1.00 2.00 C ATOM 182 CE1 PHE A 12 -2.384 7.127 -2.203 1.00 4.36 C ATOM 183 CE2 PHE A 12 -0.871 8.863 -1.418 1.00 2.67 C ATOM 184 CZ PHE A 12 -1.371 8.066 -2.462 1.00 3.56 C ATOM 185 H PHE A 12 -3.301 4.801 1.846 1.00 0.75 H ATOM 186 HA PHE A 12 -1.265 6.816 2.587 1.00 0.61 H ATOM 187 HB2 PHE A 12 -4.030 7.414 1.463 1.00 1.36 H ATOM 188 HB3 PHE A 12 -2.889 8.610 2.058 1.00 0.61 H ATOM 189 HD1 PHE A 12 -3.691 6.281 -0.713 1.00 4.52 H ATOM 190 HD2 PHE A 12 -0.996 9.339 0.684 1.00 2.93 H ATOM 191 HE1 PHE A 12 -2.777 6.521 -3.006 1.00 5.92 H ATOM 192 HE2 PHE A 12 -0.104 9.599 -1.618 1.00 3.39 H ATOM 193 HZ PHE A 12 -0.990 8.186 -3.466 1.00 4.32 H ATOM 194 N TYR A 13 -2.465 5.654 4.693 1.00 1.52 N ATOM 195 CA TYR A 13 -3.186 5.139 5.848 1.00 2.12 C ATOM 196 C TYR A 13 -2.223 4.731 6.951 1.00 2.71 C ATOM 197 O TYR A 13 -1.003 4.879 6.728 1.00 3.10 O ATOM 198 CB TYR A 13 -3.982 3.900 5.413 1.00 2.57 C ATOM 199 CG TYR A 13 -5.279 4.194 4.697 1.00 2.07 C ATOM 200 CD1 TYR A 13 -6.206 5.091 5.260 1.00 2.93 C ATOM 201 CD2 TYR A 13 -5.570 3.547 3.484 1.00 2.30 C ATOM 202 CE1 TYR A 13 -7.418 5.357 4.604 1.00 3.59 C ATOM 203 CE2 TYR A 13 -6.780 3.809 2.819 1.00 2.45 C ATOM 204 CZ TYR A 13 -7.707 4.720 3.378 1.00 3.06 C ATOM 205 OH TYR A 13 -8.886 4.987 2.749 1.00 4.05 O ATOM 206 OXT TYR A 13 -2.755 4.232 7.973 1.00 3.30 O ATOM 207 H TYR A 13 -1.522 5.304 4.593 1.00 1.65 H ATOM 208 HA TYR A 13 -3.838 5.915 6.245 1.00 2.08 H ATOM 209 HB2 TYR A 13 -3.338 3.281 4.786 1.00 3.16 H ATOM 210 HB3 TYR A 13 -4.228 3.297 6.279 1.00 3.42 H ATOM 211 HD1 TYR A 13 -5.983 5.606 6.182 1.00 3.73 H ATOM 212 HD2 TYR A 13 -4.866 2.841 3.067 1.00 3.24 H ATOM 213 HE1 TYR A 13 -8.123 6.060 5.022 1.00 4.88 H ATOM 214 HE2 TYR A 13 -6.991 3.306 1.888 1.00 3.06 H ATOM 215 HH TYR A 13 -8.969 4.565 1.894 1.00 4.06 H TER 216 TYR A 13 ENDMDL MODEL 4 ATOM 1 N ARG A 1 -2.669 -0.560 14.307 1.00 4.65 N ATOM 2 CA ARG A 1 -2.047 -1.131 13.096 1.00 4.19 C ATOM 3 C ARG A 1 -2.320 -0.193 11.930 1.00 2.48 C ATOM 4 O ARG A 1 -3.183 0.665 12.069 1.00 2.60 O ATOM 5 CB ARG A 1 -2.526 -2.564 12.794 1.00 5.36 C ATOM 6 CG ARG A 1 -4.021 -2.721 12.451 1.00 6.27 C ATOM 7 CD ARG A 1 -4.863 -3.172 13.653 1.00 7.50 C ATOM 8 NE ARG A 1 -6.266 -3.407 13.275 1.00 8.45 N ATOM 9 CZ ARG A 1 -6.754 -4.514 12.694 1.00 9.79 C ATOM 10 NH1 ARG A 1 -5.948 -5.535 12.399 1.00 10.42 N ATOM 11 NH2 ARG A 1 -8.053 -4.598 12.405 1.00 10.85 N ATOM 12 H1 ARG A 1 -3.653 -0.412 14.131 1.00 4.57 H ATOM 13 H2 ARG A 1 -2.532 -1.166 15.103 1.00 5.75 H ATOM 14 H3 ARG A 1 -2.259 0.347 14.489 1.00 4.56 H ATOM 15 HA ARG A 1 -0.968 -1.165 13.253 1.00 4.99 H ATOM 16 HB2 ARG A 1 -1.952 -2.924 11.938 1.00 5.67 H ATOM 17 HB3 ARG A 1 -2.279 -3.211 13.635 1.00 6.12 H ATOM 18 HG2 ARG A 1 -4.428 -1.793 12.050 1.00 6.14 H ATOM 19 HG3 ARG A 1 -4.109 -3.481 11.672 1.00 6.82 H ATOM 20 HD2 ARG A 1 -4.442 -4.085 14.076 1.00 8.18 H ATOM 21 HD3 ARG A 1 -4.836 -2.400 14.422 1.00 7.53 H ATOM 22 HE ARG A 1 -6.905 -2.656 13.497 1.00 8.42 H ATOM 23 HH11 ARG A 1 -4.966 -5.489 12.623 1.00 9.98 H ATOM 24 HH12 ARG A 1 -6.289 -6.377 11.959 1.00 11.59 H ATOM 25 HH21 ARG A 1 -8.690 -3.843 12.616 1.00 10.80 H ATOM 26 HH22 ARG A 1 -8.446 -5.418 11.968 1.00 11.96 H ATOM 27 N LYS A 2 -1.620 -0.355 10.808 1.00 1.90 N ATOM 28 CA LYS A 2 -1.829 0.430 9.601 1.00 0.65 C ATOM 29 C LYS A 2 -1.536 -0.502 8.432 1.00 0.80 C ATOM 30 O LYS A 2 -0.469 -1.108 8.415 1.00 2.12 O ATOM 31 CB LYS A 2 -0.922 1.680 9.612 1.00 2.03 C ATOM 32 CG LYS A 2 0.572 1.369 9.822 1.00 3.42 C ATOM 33 CD LYS A 2 1.398 2.608 10.195 1.00 4.88 C ATOM 34 CE LYS A 2 1.692 3.488 8.976 1.00 6.31 C ATOM 35 NZ LYS A 2 2.631 4.582 9.312 1.00 7.80 N ATOM 36 H LYS A 2 -0.925 -1.086 10.714 1.00 3.07 H ATOM 37 HA LYS A 2 -2.870 0.758 9.554 1.00 1.33 H ATOM 38 HB2 LYS A 2 -1.050 2.225 8.675 1.00 2.97 H ATOM 39 HB3 LYS A 2 -1.262 2.328 10.422 1.00 3.03 H ATOM 40 HG2 LYS A 2 0.682 0.655 10.636 1.00 3.83 H ATOM 41 HG3 LYS A 2 0.991 0.925 8.919 1.00 4.24 H ATOM 42 HD2 LYS A 2 0.873 3.185 10.957 1.00 4.91 H ATOM 43 HD3 LYS A 2 2.345 2.264 10.615 1.00 5.74 H ATOM 44 HE2 LYS A 2 2.133 2.866 8.194 1.00 6.81 H ATOM 45 HE3 LYS A 2 0.757 3.907 8.598 1.00 6.38 H ATOM 46 HZ1 LYS A 2 2.226 5.186 10.014 1.00 8.10 H ATOM 47 HZ2 LYS A 2 3.500 4.202 9.663 1.00 8.45 H ATOM 48 HZ3 LYS A 2 2.829 5.133 8.486 1.00 8.31 H ATOM 49 N SER A 3 -2.481 -0.679 7.511 1.00 0.67 N ATOM 50 CA SER A 3 -2.219 -1.452 6.309 1.00 0.63 C ATOM 51 C SER A 3 -1.662 -0.507 5.261 1.00 0.51 C ATOM 52 O SER A 3 -2.218 0.561 5.019 1.00 0.60 O ATOM 53 CB SER A 3 -3.491 -2.123 5.790 1.00 0.76 C ATOM 54 OG SER A 3 -3.669 -3.350 6.468 1.00 1.58 O ATOM 55 H SER A 3 -3.333 -0.140 7.533 1.00 1.73 H ATOM 56 HA SER A 3 -1.474 -2.222 6.512 1.00 0.66 H ATOM 57 HB2 SER A 3 -4.356 -1.479 5.949 1.00 1.70 H ATOM 58 HB3 SER A 3 -3.383 -2.319 4.722 1.00 1.30 H ATOM 59 HG SER A 3 -4.073 -3.975 5.858 1.00 2.02 H ATOM 60 N ILE A 4 -0.547 -0.914 4.668 1.00 0.39 N ATOM 61 CA ILE A 4 0.117 -0.191 3.609 1.00 0.29 C ATOM 62 C ILE A 4 -0.460 -0.684 2.281 1.00 0.25 C ATOM 63 O ILE A 4 -1.653 -0.948 2.155 1.00 0.35 O ATOM 64 CB ILE A 4 1.646 -0.370 3.740 1.00 0.33 C ATOM 65 CG1 ILE A 4 2.089 -0.438 5.205 1.00 0.45 C ATOM 66 CG2 ILE A 4 2.352 0.842 3.099 1.00 0.35 C ATOM 67 CD1 ILE A 4 2.228 -1.867 5.752 1.00 1.43 C ATOM 68 H ILE A 4 -0.121 -1.778 4.957 1.00 0.44 H ATOM 69 HA ILE A 4 -0.102 0.868 3.703 1.00 0.30 H ATOM 70 HB ILE A 4 1.972 -1.299 3.268 1.00 0.34 H ATOM 71 HG12 ILE A 4 3.061 0.023 5.270 1.00 0.79 H ATOM 72 HG13 ILE A 4 1.410 0.148 5.820 1.00 0.97 H ATOM 73 HG21 ILE A 4 2.209 1.722 3.726 1.00 1.41 H ATOM 74 HG22 ILE A 4 3.421 0.642 3.012 1.00 1.45 H ATOM 75 HG23 ILE A 4 1.960 1.079 2.110 1.00 1.30 H ATOM 76 HD11 ILE A 4 1.529 -2.553 5.275 1.00 2.44 H ATOM 77 HD12 ILE A 4 3.238 -2.230 5.561 1.00 2.28 H ATOM 78 HD13 ILE A 4 2.051 -1.864 6.829 1.00 2.16 H ATOM 79 N ASN A 5 0.408 -0.816 1.292 1.00 0.19 N ATOM 80 CA ASN A 5 0.122 -1.298 -0.041 1.00 0.17 C ATOM 81 C ASN A 5 0.879 -2.607 -0.240 1.00 0.17 C ATOM 82 O ASN A 5 1.818 -2.883 0.500 1.00 0.24 O ATOM 83 CB ASN A 5 0.496 -0.185 -1.012 1.00 0.20 C ATOM 84 CG ASN A 5 0.544 -0.672 -2.433 1.00 0.21 C ATOM 85 OD1 ASN A 5 -0.414 -0.559 -3.184 1.00 0.29 O ATOM 86 ND2 ASN A 5 1.672 -1.240 -2.792 1.00 0.23 N ATOM 87 H ASN A 5 1.382 -0.663 1.506 1.00 0.23 H ATOM 88 HA ASN A 5 -0.927 -1.508 -0.185 1.00 0.20 H ATOM 89 HB2 ASN A 5 -0.253 0.596 -0.955 1.00 0.25 H ATOM 90 HB3 ASN A 5 1.466 0.238 -0.748 1.00 0.25 H ATOM 91 HD21 ASN A 5 2.365 -1.470 -2.093 1.00 0.25 H ATOM 92 HD22 ASN A 5 1.850 -1.431 -3.761 1.00 0.28 H ATOM 93 N ILE A 6 0.448 -3.396 -1.228 1.00 0.18 N ATOM 94 CA ILE A 6 1.109 -4.609 -1.685 1.00 0.23 C ATOM 95 C ILE A 6 2.412 -4.189 -2.389 1.00 0.22 C ATOM 96 O ILE A 6 3.294 -3.599 -1.772 1.00 0.37 O ATOM 97 CB ILE A 6 0.120 -5.401 -2.579 1.00 0.29 C ATOM 98 CG1 ILE A 6 -1.196 -5.706 -1.834 1.00 0.37 C ATOM 99 CG2 ILE A 6 0.721 -6.730 -3.076 1.00 0.35 C ATOM 100 CD1 ILE A 6 -2.346 -5.939 -2.822 1.00 1.49 C ATOM 101 H ILE A 6 -0.341 -3.087 -1.776 1.00 0.20 H ATOM 102 HA ILE A 6 1.370 -5.215 -0.817 1.00 0.31 H ATOM 103 HB ILE A 6 -0.133 -4.781 -3.442 1.00 0.26 H ATOM 104 HG12 ILE A 6 -1.062 -6.583 -1.201 1.00 0.90 H ATOM 105 HG13 ILE A 6 -1.489 -4.877 -1.195 1.00 1.01 H ATOM 106 HG21 ILE A 6 -0.030 -7.519 -3.078 1.00 1.76 H ATOM 107 HG22 ILE A 6 1.086 -6.635 -4.097 1.00 1.70 H ATOM 108 HG23 ILE A 6 1.538 -7.043 -2.424 1.00 1.55 H ATOM 109 HD11 ILE A 6 -2.523 -5.029 -3.396 1.00 2.43 H ATOM 110 HD12 ILE A 6 -2.110 -6.752 -3.508 1.00 2.14 H ATOM 111 HD13 ILE A 6 -3.253 -6.189 -2.272 1.00 2.36 H ATOM 112 N GLY A 7 2.538 -4.434 -3.692 1.00 0.20 N ATOM 113 CA GLY A 7 3.715 -4.072 -4.462 1.00 0.20 C ATOM 114 C GLY A 7 3.358 -2.923 -5.392 1.00 0.14 C ATOM 115 O GLY A 7 3.487 -1.765 -5.006 1.00 0.17 O ATOM 116 H GLY A 7 1.765 -4.847 -4.185 1.00 0.32 H ATOM 117 HA2 GLY A 7 4.523 -3.750 -3.801 1.00 0.25 H ATOM 118 HA3 GLY A 7 4.065 -4.931 -5.032 1.00 0.25 H ATOM 119 N PRO A 8 2.868 -3.215 -6.602 1.00 0.15 N ATOM 120 CA PRO A 8 2.555 -2.201 -7.592 1.00 0.23 C ATOM 121 C PRO A 8 1.317 -1.406 -7.164 1.00 0.23 C ATOM 122 O PRO A 8 0.193 -1.760 -7.506 1.00 0.27 O ATOM 123 CB PRO A 8 2.344 -2.979 -8.894 1.00 0.30 C ATOM 124 CG PRO A 8 1.828 -4.337 -8.414 1.00 0.25 C ATOM 125 CD PRO A 8 2.589 -4.547 -7.106 1.00 0.17 C ATOM 126 HA PRO A 8 3.397 -1.517 -7.710 1.00 0.28 H ATOM 127 HB2 PRO A 8 1.640 -2.489 -9.568 1.00 0.37 H ATOM 128 HB3 PRO A 8 3.306 -3.118 -9.388 1.00 0.33 H ATOM 129 HG2 PRO A 8 0.758 -4.275 -8.210 1.00 0.27 H ATOM 130 HG3 PRO A 8 2.036 -5.129 -9.133 1.00 0.28 H ATOM 131 HD2 PRO A 8 1.979 -5.118 -6.404 1.00 0.18 H ATOM 132 HD3 PRO A 8 3.528 -5.065 -7.304 1.00 0.20 H ATOM 133 N GLY A 9 1.523 -0.324 -6.414 1.00 0.22 N ATOM 134 CA GLY A 9 0.458 0.538 -5.936 1.00 0.25 C ATOM 135 C GLY A 9 1.012 1.497 -4.891 1.00 0.23 C ATOM 136 O GLY A 9 2.226 1.637 -4.751 1.00 0.33 O ATOM 137 H GLY A 9 2.456 -0.115 -6.072 1.00 0.21 H ATOM 138 HA2 GLY A 9 0.048 1.109 -6.768 1.00 0.32 H ATOM 139 HA3 GLY A 9 -0.336 -0.069 -5.498 1.00 0.25 H ATOM 140 N ARG A 10 0.127 2.162 -4.150 1.00 0.19 N ATOM 141 CA ARG A 10 0.486 2.957 -2.985 1.00 0.20 C ATOM 142 C ARG A 10 -0.721 3.003 -2.065 1.00 0.18 C ATOM 143 O ARG A 10 -1.821 2.650 -2.485 1.00 0.22 O ATOM 144 CB ARG A 10 0.932 4.365 -3.406 1.00 0.36 C ATOM 145 CG ARG A 10 -0.193 5.171 -4.075 1.00 2.12 C ATOM 146 CD ARG A 10 0.232 6.620 -4.332 1.00 2.61 C ATOM 147 NE ARG A 10 1.038 6.776 -5.551 1.00 3.27 N ATOM 148 CZ ARG A 10 2.375 6.816 -5.631 1.00 3.48 C ATOM 149 NH1 ARG A 10 3.129 6.609 -4.551 1.00 3.43 N ATOM 150 NH2 ARG A 10 2.958 7.071 -6.804 1.00 4.65 N ATOM 151 H ARG A 10 -0.858 1.938 -4.241 1.00 0.25 H ATOM 152 HA ARG A 10 1.300 2.459 -2.455 1.00 0.22 H ATOM 153 HB2 ARG A 10 1.267 4.899 -2.516 1.00 1.80 H ATOM 154 HB3 ARG A 10 1.772 4.277 -4.093 1.00 1.76 H ATOM 155 HG2 ARG A 10 -0.488 4.700 -5.014 1.00 3.07 H ATOM 156 HG3 ARG A 10 -1.060 5.198 -3.416 1.00 3.23 H ATOM 157 HD2 ARG A 10 -0.672 7.222 -4.447 1.00 3.42 H ATOM 158 HD3 ARG A 10 0.771 6.998 -3.466 1.00 2.63 H ATOM 159 HE ARG A 10 0.494 6.920 -6.390 1.00 4.28 H ATOM 160 HH11 ARG A 10 2.695 6.398 -3.667 1.00 3.24 H ATOM 161 HH12 ARG A 10 4.137 6.621 -4.587 1.00 4.22 H ATOM 162 HH21 ARG A 10 2.409 7.246 -7.631 1.00 5.49 H ATOM 163 HH22 ARG A 10 3.962 7.109 -6.898 1.00 5.08 H ATOM 164 N ALA A 11 -0.534 3.459 -0.831 1.00 0.19 N ATOM 165 CA ALA A 11 -1.624 3.585 0.111 1.00 0.21 C ATOM 166 C ALA A 11 -1.418 4.841 0.933 1.00 0.26 C ATOM 167 O ALA A 11 -0.277 5.234 1.171 1.00 0.53 O ATOM 168 CB ALA A 11 -1.630 2.380 1.042 1.00 0.27 C ATOM 169 H ALA A 11 0.366 3.785 -0.503 1.00 0.24 H ATOM 170 HA ALA A 11 -2.574 3.644 -0.425 1.00 0.23 H ATOM 171 HB1 ALA A 11 -1.864 1.481 0.474 1.00 1.60 H ATOM 172 HB2 ALA A 11 -0.648 2.288 1.505 1.00 1.57 H ATOM 173 HB3 ALA A 11 -2.380 2.530 1.818 1.00 1.56 H ATOM 174 N PHE A 12 -2.518 5.426 1.398 1.00 0.34 N ATOM 175 CA PHE A 12 -2.514 6.514 2.351 1.00 0.33 C ATOM 176 C PHE A 12 -3.773 6.361 3.192 1.00 0.87 C ATOM 177 O PHE A 12 -4.843 6.820 2.802 1.00 1.33 O ATOM 178 CB PHE A 12 -2.487 7.857 1.623 1.00 0.67 C ATOM 179 CG PHE A 12 -1.138 8.211 1.030 1.00 1.37 C ATOM 180 CD1 PHE A 12 -0.113 8.675 1.873 1.00 2.90 C ATOM 181 CD2 PHE A 12 -0.906 8.091 -0.352 1.00 2.37 C ATOM 182 CE1 PHE A 12 1.124 9.067 1.335 1.00 3.58 C ATOM 183 CE2 PHE A 12 0.322 8.513 -0.894 1.00 2.90 C ATOM 184 CZ PHE A 12 1.336 9.001 -0.052 1.00 3.00 C ATOM 185 H PHE A 12 -3.427 5.037 1.182 1.00 0.57 H ATOM 186 HA PHE A 12 -1.636 6.437 2.994 1.00 0.59 H ATOM 187 HB2 PHE A 12 -3.246 7.843 0.843 1.00 1.08 H ATOM 188 HB3 PHE A 12 -2.759 8.643 2.327 1.00 0.60 H ATOM 189 HD1 PHE A 12 -0.283 8.726 2.938 1.00 4.04 H ATOM 190 HD2 PHE A 12 -1.677 7.674 -0.984 1.00 3.52 H ATOM 191 HE1 PHE A 12 1.906 9.430 1.987 1.00 5.01 H ATOM 192 HE2 PHE A 12 0.487 8.478 -1.958 1.00 4.03 H ATOM 193 HZ PHE A 12 2.280 9.324 -0.468 1.00 3.65 H ATOM 194 N TYR A 13 -3.627 5.674 4.320 1.00 1.24 N ATOM 195 CA TYR A 13 -4.661 5.412 5.304 1.00 1.80 C ATOM 196 C TYR A 13 -3.980 5.428 6.670 1.00 2.27 C ATOM 197 O TYR A 13 -2.743 5.217 6.682 1.00 2.47 O ATOM 198 CB TYR A 13 -5.303 4.038 5.065 1.00 2.33 C ATOM 199 CG TYR A 13 -5.930 3.816 3.700 1.00 2.04 C ATOM 200 CD1 TYR A 13 -7.041 4.585 3.300 1.00 2.53 C ATOM 201 CD2 TYR A 13 -5.434 2.811 2.848 1.00 3.06 C ATOM 202 CE1 TYR A 13 -7.660 4.345 2.062 1.00 2.82 C ATOM 203 CE2 TYR A 13 -6.046 2.565 1.604 1.00 3.55 C ATOM 204 CZ TYR A 13 -7.169 3.330 1.210 1.00 3.00 C ATOM 205 OH TYR A 13 -7.789 3.095 0.020 1.00 3.84 O ATOM 206 OXT TYR A 13 -4.701 5.631 7.666 1.00 3.05 O ATOM 207 H TYR A 13 -2.708 5.383 4.622 1.00 1.37 H ATOM 208 HA TYR A 13 -5.419 6.194 5.268 1.00 1.83 H ATOM 209 HB2 TYR A 13 -4.545 3.272 5.236 1.00 2.89 H ATOM 210 HB3 TYR A 13 -6.078 3.894 5.820 1.00 3.11 H ATOM 211 HD1 TYR A 13 -7.414 5.362 3.950 1.00 3.56 H ATOM 212 HD2 TYR A 13 -4.588 2.213 3.158 1.00 4.10 H ATOM 213 HE1 TYR A 13 -8.515 4.931 1.757 1.00 3.79 H ATOM 214 HE2 TYR A 13 -5.661 1.782 0.970 1.00 4.86 H ATOM 215 HH TYR A 13 -7.423 2.357 -0.470 1.00 4.22 H TER 216 TYR A 13 ENDMDL MODEL 5 ATOM 1 N ARG A 1 -5.926 1.571 10.841 1.00 5.20 N ATOM 2 CA ARG A 1 -4.971 2.327 10.008 1.00 4.74 C ATOM 3 C ARG A 1 -3.589 1.772 10.308 1.00 2.81 C ATOM 4 O ARG A 1 -3.139 1.924 11.437 1.00 2.92 O ATOM 5 CB ARG A 1 -5.038 3.826 10.332 1.00 6.29 C ATOM 6 CG ARG A 1 -6.363 4.454 9.871 1.00 7.56 C ATOM 7 CD ARG A 1 -6.981 5.313 10.983 1.00 8.93 C ATOM 8 NE ARG A 1 -8.413 5.557 10.751 1.00 10.32 N ATOM 9 CZ ARG A 1 -9.220 6.217 11.593 1.00 11.59 C ATOM 10 NH1 ARG A 1 -8.713 6.820 12.668 1.00 11.92 N ATOM 11 NH2 ARG A 1 -10.533 6.263 11.363 1.00 12.80 N ATOM 12 H1 ARG A 1 -5.651 1.674 11.809 1.00 5.08 H ATOM 13 H2 ARG A 1 -6.863 1.918 10.711 1.00 6.53 H ATOM 14 H3 ARG A 1 -5.889 0.591 10.598 1.00 4.91 H ATOM 15 HA ARG A 1 -5.194 2.184 8.951 1.00 5.39 H ATOM 16 HB2 ARG A 1 -4.909 3.963 11.406 1.00 6.79 H ATOM 17 HB3 ARG A 1 -4.213 4.334 9.841 1.00 6.61 H ATOM 18 HG2 ARG A 1 -6.188 5.073 8.988 1.00 8.01 H ATOM 19 HG3 ARG A 1 -7.067 3.669 9.596 1.00 7.49 H ATOM 20 HD2 ARG A 1 -6.880 4.788 11.934 1.00 8.77 H ATOM 21 HD3 ARG A 1 -6.444 6.261 11.043 1.00 9.44 H ATOM 22 HE ARG A 1 -8.798 5.170 9.902 1.00 10.51 H ATOM 23 HH11 ARG A 1 -7.716 6.819 12.821 1.00 11.21 H ATOM 24 HH12 ARG A 1 -9.288 7.333 13.320 1.00 13.07 H ATOM 25 HH21 ARG A 1 -10.944 5.802 10.564 1.00 12.90 H ATOM 26 HH22 ARG A 1 -11.161 6.753 11.984 1.00 13.83 H ATOM 27 N LYS A 2 -2.990 1.034 9.368 1.00 1.92 N ATOM 28 CA LYS A 2 -1.643 0.477 9.505 1.00 0.78 C ATOM 29 C LYS A 2 -1.257 -0.262 8.230 1.00 1.02 C ATOM 30 O LYS A 2 -0.118 -0.174 7.790 1.00 2.39 O ATOM 31 CB LYS A 2 -1.485 -0.490 10.700 1.00 2.09 C ATOM 32 CG LYS A 2 -0.076 -0.296 11.285 1.00 3.38 C ATOM 33 CD LYS A 2 0.446 -1.522 12.041 1.00 5.05 C ATOM 34 CE LYS A 2 -0.234 -1.703 13.400 1.00 5.96 C ATOM 35 NZ LYS A 2 0.223 -2.945 14.066 1.00 7.74 N ATOM 36 H LYS A 2 -3.376 1.019 8.433 1.00 3.03 H ATOM 37 HA LYS A 2 -0.957 1.317 9.632 1.00 2.01 H ATOM 38 HB2 LYS A 2 -2.222 -0.312 11.481 1.00 2.68 H ATOM 39 HB3 LYS A 2 -1.606 -1.518 10.356 1.00 3.08 H ATOM 40 HG2 LYS A 2 0.621 -0.100 10.469 1.00 3.95 H ATOM 41 HG3 LYS A 2 -0.076 0.572 11.945 1.00 3.60 H ATOM 42 HD2 LYS A 2 0.300 -2.410 11.425 1.00 5.46 H ATOM 43 HD3 LYS A 2 1.517 -1.389 12.201 1.00 5.93 H ATOM 44 HE2 LYS A 2 0.009 -0.843 14.029 1.00 6.20 H ATOM 45 HE3 LYS A 2 -1.315 -1.735 13.263 1.00 5.76 H ATOM 46 HZ1 LYS A 2 -0.182 -3.016 14.989 1.00 8.43 H ATOM 47 HZ2 LYS A 2 -0.055 -3.752 13.524 1.00 8.24 H ATOM 48 HZ3 LYS A 2 1.230 -2.941 14.153 1.00 8.26 H ATOM 49 N SER A 3 -2.193 -1.040 7.675 1.00 0.49 N ATOM 50 CA SER A 3 -1.937 -1.791 6.458 1.00 0.45 C ATOM 51 C SER A 3 -1.534 -0.818 5.362 1.00 0.41 C ATOM 52 O SER A 3 -2.202 0.192 5.148 1.00 0.53 O ATOM 53 CB SER A 3 -3.175 -2.593 6.044 1.00 0.52 C ATOM 54 OG SER A 3 -2.807 -3.637 5.169 1.00 1.80 O ATOM 55 H SER A 3 -3.102 -1.125 8.098 1.00 1.55 H ATOM 56 HA SER A 3 -1.109 -2.477 6.642 1.00 0.46 H ATOM 57 HB2 SER A 3 -3.633 -3.031 6.931 1.00 1.50 H ATOM 58 HB3 SER A 3 -3.901 -1.940 5.556 1.00 1.24 H ATOM 59 HG SER A 3 -2.705 -3.287 4.276 1.00 2.59 H ATOM 60 N ILE A 4 -0.429 -1.136 4.698 1.00 0.32 N ATOM 61 CA ILE A 4 0.112 -0.360 3.613 1.00 0.29 C ATOM 62 C ILE A 4 -0.483 -0.917 2.320 1.00 0.28 C ATOM 63 O ILE A 4 -1.626 -1.371 2.278 1.00 0.40 O ATOM 64 CB ILE A 4 1.652 -0.421 3.657 1.00 0.32 C ATOM 65 CG1 ILE A 4 2.217 -0.464 5.082 1.00 0.40 C ATOM 66 CG2 ILE A 4 2.224 0.851 2.995 1.00 0.34 C ATOM 67 CD1 ILE A 4 2.518 -1.869 5.625 1.00 1.44 C ATOM 68 H ILE A 4 0.087 -1.961 4.945 1.00 0.33 H ATOM 69 HA ILE A 4 -0.185 0.680 3.728 1.00 0.32 H ATOM 70 HB ILE A 4 2.010 -1.313 3.143 1.00 0.31 H ATOM 71 HG12 ILE A 4 3.158 0.057 5.048 1.00 0.83 H ATOM 72 HG13 ILE A 4 1.568 0.086 5.758 1.00 0.87 H ATOM 73 HG21 ILE A 4 2.090 1.703 3.665 1.00 1.37 H ATOM 74 HG22 ILE A 4 3.290 0.720 2.804 1.00 1.37 H ATOM 75 HG23 ILE A 4 1.727 1.097 2.058 1.00 1.45 H ATOM 76 HD11 ILE A 4 3.108 -2.430 4.900 1.00 2.31 H ATOM 77 HD12 ILE A 4 3.096 -1.776 6.545 1.00 2.04 H ATOM 78 HD13 ILE A 4 1.611 -2.420 5.855 1.00 2.05 H ATOM 79 N ASN A 5 0.325 -0.907 1.268 1.00 0.23 N ATOM 80 CA ASN A 5 0.035 -1.436 -0.041 1.00 0.22 C ATOM 81 C ASN A 5 0.882 -2.693 -0.231 1.00 0.18 C ATOM 82 O ASN A 5 1.848 -2.896 0.498 1.00 0.21 O ATOM 83 CB ASN A 5 0.319 -0.316 -1.038 1.00 0.27 C ATOM 84 CG ASN A 5 0.295 -0.810 -2.457 1.00 0.26 C ATOM 85 OD1 ASN A 5 -0.699 -0.702 -3.158 1.00 0.27 O ATOM 86 ND2 ASN A 5 1.406 -1.368 -2.881 1.00 0.26 N ATOM 87 H ASN A 5 1.287 -0.648 1.421 1.00 0.25 H ATOM 88 HA ASN A 5 -1.004 -1.716 -0.151 1.00 0.25 H ATOM 89 HB2 ASN A 5 -0.444 0.450 -0.940 1.00 0.33 H ATOM 90 HB3 ASN A 5 1.294 0.130 -0.835 1.00 0.30 H ATOM 91 HD21 ASN A 5 2.161 -1.564 -2.234 1.00 0.28 H ATOM 92 HD22 ASN A 5 1.529 -1.527 -3.861 1.00 0.26 H ATOM 93 N ILE A 6 0.498 -3.521 -1.207 1.00 0.16 N ATOM 94 CA ILE A 6 1.250 -4.664 -1.708 1.00 0.17 C ATOM 95 C ILE A 6 2.491 -4.115 -2.443 1.00 0.17 C ATOM 96 O ILE A 6 3.272 -3.357 -1.873 1.00 0.36 O ATOM 97 CB ILE A 6 0.301 -5.492 -2.609 1.00 0.22 C ATOM 98 CG1 ILE A 6 -0.996 -5.900 -1.878 1.00 0.31 C ATOM 99 CG2 ILE A 6 0.964 -6.761 -3.186 1.00 0.31 C ATOM 100 CD1 ILE A 6 -2.126 -6.132 -2.885 1.00 1.44 C ATOM 101 H ILE A 6 -0.317 -3.263 -1.742 1.00 0.19 H ATOM 102 HA ILE A 6 1.579 -5.273 -0.863 1.00 0.23 H ATOM 103 HB ILE A 6 0.012 -4.850 -3.443 1.00 0.19 H ATOM 104 HG12 ILE A 6 -0.826 -6.803 -1.290 1.00 1.01 H ATOM 105 HG13 ILE A 6 -1.328 -5.124 -1.193 1.00 0.91 H ATOM 106 HG21 ILE A 6 1.996 -6.854 -2.843 1.00 1.37 H ATOM 107 HG22 ILE A 6 0.432 -7.659 -2.873 1.00 1.36 H ATOM 108 HG23 ILE A 6 0.939 -6.729 -4.276 1.00 1.57 H ATOM 109 HD11 ILE A 6 -2.370 -5.191 -3.379 1.00 2.33 H ATOM 110 HD12 ILE A 6 -1.824 -6.864 -3.634 1.00 2.25 H ATOM 111 HD13 ILE A 6 -3.011 -6.494 -2.363 1.00 2.25 H ATOM 112 N GLY A 7 2.668 -4.428 -3.727 1.00 0.17 N ATOM 113 CA GLY A 7 3.803 -3.965 -4.509 1.00 0.17 C ATOM 114 C GLY A 7 3.371 -2.815 -5.413 1.00 0.14 C ATOM 115 O GLY A 7 3.507 -1.654 -5.030 1.00 0.16 O ATOM 116 H GLY A 7 1.981 -5.000 -4.191 1.00 0.30 H ATOM 117 HA2 GLY A 7 4.598 -3.614 -3.851 1.00 0.20 H ATOM 118 HA3 GLY A 7 4.197 -4.785 -5.106 1.00 0.23 H ATOM 119 N PRO A 8 2.835 -3.114 -6.603 1.00 0.17 N ATOM 120 CA PRO A 8 2.470 -2.111 -7.589 1.00 0.21 C ATOM 121 C PRO A 8 1.198 -1.373 -7.160 1.00 0.18 C ATOM 122 O PRO A 8 0.093 -1.721 -7.563 1.00 0.26 O ATOM 123 CB PRO A 8 2.299 -2.890 -8.896 1.00 0.29 C ATOM 124 CG PRO A 8 1.832 -4.268 -8.424 1.00 0.27 C ATOM 125 CD PRO A 8 2.580 -4.453 -7.104 1.00 0.20 C ATOM 126 HA PRO A 8 3.280 -1.388 -7.707 1.00 0.24 H ATOM 127 HB2 PRO A 8 1.583 -2.424 -9.574 1.00 0.34 H ATOM 128 HB3 PRO A 8 3.270 -2.990 -9.383 1.00 0.33 H ATOM 129 HG2 PRO A 8 0.757 -4.250 -8.237 1.00 0.29 H ATOM 130 HG3 PRO A 8 2.084 -5.049 -9.141 1.00 0.33 H ATOM 131 HD2 PRO A 8 1.970 -5.026 -6.405 1.00 0.20 H ATOM 132 HD3 PRO A 8 3.528 -4.961 -7.287 1.00 0.23 H ATOM 133 N GLY A 9 1.366 -0.342 -6.336 1.00 0.16 N ATOM 134 CA GLY A 9 0.301 0.505 -5.823 1.00 0.17 C ATOM 135 C GLY A 9 0.873 1.345 -4.687 1.00 0.22 C ATOM 136 O GLY A 9 2.027 1.150 -4.313 1.00 0.56 O ATOM 137 H GLY A 9 2.292 -0.168 -5.960 1.00 0.19 H ATOM 138 HA2 GLY A 9 -0.066 1.157 -6.614 1.00 0.25 H ATOM 139 HA3 GLY A 9 -0.518 -0.113 -5.453 1.00 0.21 H ATOM 140 N ARG A 10 0.096 2.263 -4.114 1.00 0.19 N ATOM 141 CA ARG A 10 0.474 3.022 -2.925 1.00 0.19 C ATOM 142 C ARG A 10 -0.755 3.074 -2.026 1.00 0.16 C ATOM 143 O ARG A 10 -1.859 2.783 -2.479 1.00 0.22 O ATOM 144 CB ARG A 10 0.947 4.446 -3.291 1.00 0.37 C ATOM 145 CG ARG A 10 2.462 4.679 -3.159 1.00 1.91 C ATOM 146 CD ARG A 10 3.293 4.125 -4.328 1.00 2.90 C ATOM 147 NE ARG A 10 4.073 2.934 -3.962 1.00 4.44 N ATOM 148 CZ ARG A 10 5.173 2.872 -3.209 1.00 5.50 C ATOM 149 NH1 ARG A 10 5.707 3.986 -2.709 1.00 5.41 N ATOM 150 NH2 ARG A 10 5.730 1.686 -2.960 1.00 7.19 N ATOM 151 H ARG A 10 -0.884 2.309 -4.368 1.00 0.41 H ATOM 152 HA ARG A 10 1.260 2.492 -2.384 1.00 0.20 H ATOM 153 HB2 ARG A 10 0.617 4.706 -4.298 1.00 1.25 H ATOM 154 HB3 ARG A 10 0.466 5.153 -2.612 1.00 1.29 H ATOM 155 HG2 ARG A 10 2.621 5.757 -3.134 1.00 2.71 H ATOM 156 HG3 ARG A 10 2.814 4.274 -2.210 1.00 3.31 H ATOM 157 HD2 ARG A 10 2.625 3.869 -5.150 1.00 3.52 H ATOM 158 HD3 ARG A 10 3.974 4.900 -4.684 1.00 3.26 H ATOM 159 HE ARG A 10 3.696 2.068 -4.324 1.00 5.18 H ATOM 160 HH11 ARG A 10 5.271 4.874 -2.907 1.00 4.58 H ATOM 161 HH12 ARG A 10 6.536 3.978 -2.135 1.00 6.53 H ATOM 162 HH21 ARG A 10 5.313 0.840 -3.327 1.00 7.78 H ATOM 163 HH22 ARG A 10 6.564 1.591 -2.400 1.00 8.16 H ATOM 164 N ALA A 11 -0.567 3.450 -0.764 1.00 0.19 N ATOM 165 CA ALA A 11 -1.644 3.568 0.197 1.00 0.20 C ATOM 166 C ALA A 11 -1.387 4.808 1.040 1.00 0.26 C ATOM 167 O ALA A 11 -0.240 5.223 1.193 1.00 0.53 O ATOM 168 CB ALA A 11 -1.693 2.316 1.078 1.00 0.28 C ATOM 169 H ALA A 11 0.334 3.775 -0.442 1.00 0.24 H ATOM 170 HA ALA A 11 -2.592 3.681 -0.328 1.00 0.20 H ATOM 171 HB1 ALA A 11 -0.685 2.058 1.404 1.00 1.31 H ATOM 172 HB2 ALA A 11 -2.312 2.502 1.958 1.00 1.37 H ATOM 173 HB3 ALA A 11 -2.117 1.487 0.511 1.00 1.39 H ATOM 174 N PHE A 12 -2.460 5.377 1.586 1.00 0.32 N ATOM 175 CA PHE A 12 -2.422 6.576 2.400 1.00 0.30 C ATOM 176 C PHE A 12 -3.346 6.308 3.586 1.00 0.85 C ATOM 177 O PHE A 12 -4.540 6.585 3.521 1.00 1.30 O ATOM 178 CB PHE A 12 -2.871 7.783 1.561 1.00 0.74 C ATOM 179 CG PHE A 12 -2.046 8.022 0.306 1.00 1.41 C ATOM 180 CD1 PHE A 12 -2.336 7.314 -0.878 1.00 2.45 C ATOM 181 CD2 PHE A 12 -0.989 8.950 0.315 1.00 2.31 C ATOM 182 CE1 PHE A 12 -1.572 7.525 -2.038 1.00 3.09 C ATOM 183 CE2 PHE A 12 -0.231 9.170 -0.849 1.00 2.97 C ATOM 184 CZ PHE A 12 -0.520 8.457 -2.025 1.00 3.00 C ATOM 185 H PHE A 12 -3.374 4.985 1.420 1.00 0.53 H ATOM 186 HA PHE A 12 -1.406 6.752 2.757 1.00 0.51 H ATOM 187 HB2 PHE A 12 -3.910 7.633 1.264 1.00 1.21 H ATOM 188 HB3 PHE A 12 -2.837 8.676 2.186 1.00 0.58 H ATOM 189 HD1 PHE A 12 -3.148 6.602 -0.896 1.00 3.25 H ATOM 190 HD2 PHE A 12 -0.759 9.499 1.216 1.00 3.07 H ATOM 191 HE1 PHE A 12 -1.798 6.977 -2.942 1.00 4.10 H ATOM 192 HE2 PHE A 12 0.574 9.892 -0.840 1.00 3.94 H ATOM 193 HZ PHE A 12 0.063 8.628 -2.919 1.00 3.63 H ATOM 194 N TYR A 13 -2.803 5.670 4.622 1.00 1.34 N ATOM 195 CA TYR A 13 -3.502 5.233 5.824 1.00 1.97 C ATOM 196 C TYR A 13 -2.600 5.557 7.005 1.00 2.47 C ATOM 197 O TYR A 13 -1.382 5.700 6.758 1.00 2.91 O ATOM 198 CB TYR A 13 -3.758 3.715 5.803 1.00 2.83 C ATOM 199 CG TYR A 13 -4.991 3.240 5.054 1.00 2.51 C ATOM 200 CD1 TYR A 13 -5.069 3.370 3.658 1.00 2.50 C ATOM 201 CD2 TYR A 13 -6.042 2.616 5.753 1.00 3.44 C ATOM 202 CE1 TYR A 13 -6.190 2.894 2.954 1.00 2.62 C ATOM 203 CE2 TYR A 13 -7.159 2.120 5.059 1.00 3.82 C ATOM 204 CZ TYR A 13 -7.239 2.260 3.657 1.00 3.11 C ATOM 205 OH TYR A 13 -8.327 1.773 2.998 1.00 3.80 O ATOM 206 OXT TYR A 13 -3.145 5.601 8.127 1.00 3.07 O ATOM 207 H TYR A 13 -1.802 5.537 4.672 1.00 1.53 H ATOM 208 HA TYR A 13 -4.441 5.774 5.941 1.00 1.86 H ATOM 209 HB2 TYR A 13 -2.879 3.212 5.396 1.00 3.45 H ATOM 210 HB3 TYR A 13 -3.850 3.383 6.837 1.00 3.72 H ATOM 211 HD1 TYR A 13 -4.259 3.837 3.126 1.00 3.23 H ATOM 212 HD2 TYR A 13 -5.989 2.505 6.821 1.00 4.35 H ATOM 213 HE1 TYR A 13 -6.234 3.013 1.883 1.00 3.18 H ATOM 214 HE2 TYR A 13 -7.963 1.626 5.587 1.00 5.01 H ATOM 215 HH TYR A 13 -8.293 1.904 2.049 1.00 3.76 H TER 216 TYR A 13 ENDMDL MODEL 6 ATOM 1 N ARG A 1 1.461 0.230 12.749 1.00 6.19 N ATOM 2 CA ARG A 1 1.166 0.881 11.457 1.00 5.43 C ATOM 3 C ARG A 1 -0.159 0.312 10.966 1.00 3.37 C ATOM 4 O ARG A 1 -0.572 -0.717 11.492 1.00 3.51 O ATOM 5 CB ARG A 1 2.291 0.650 10.427 1.00 6.86 C ATOM 6 CG ARG A 1 2.856 1.970 9.878 1.00 8.44 C ATOM 7 CD ARG A 1 4.089 2.454 10.655 1.00 10.15 C ATOM 8 NE ARG A 1 5.260 1.600 10.390 1.00 11.84 N ATOM 9 CZ ARG A 1 6.388 1.555 11.114 1.00 13.37 C ATOM 10 NH1 ARG A 1 6.527 2.319 12.197 1.00 13.52 N ATOM 11 NH2 ARG A 1 7.377 0.737 10.753 1.00 15.02 N ATOM 12 H1 ARG A 1 1.501 -0.771 12.604 1.00 6.26 H ATOM 13 H2 ARG A 1 2.329 0.566 13.139 1.00 7.51 H ATOM 14 H3 ARG A 1 0.698 0.406 13.388 1.00 5.68 H ATOM 15 HA ARG A 1 1.042 1.952 11.621 1.00 5.80 H ATOM 16 HB2 ARG A 1 3.096 0.064 10.873 1.00 7.57 H ATOM 17 HB3 ARG A 1 1.897 0.071 9.589 1.00 6.49 H ATOM 18 HG2 ARG A 1 3.139 1.830 8.834 1.00 8.81 H ATOM 19 HG3 ARG A 1 2.082 2.739 9.909 1.00 8.41 H ATOM 20 HD2 ARG A 1 4.324 3.471 10.339 1.00 10.83 H ATOM 21 HD3 ARG A 1 3.861 2.462 11.722 1.00 9.85 H ATOM 22 HE ARG A 1 5.205 1.048 9.545 1.00 12.06 H ATOM 23 HH11 ARG A 1 5.809 2.981 12.446 1.00 12.60 H ATOM 24 HH12 ARG A 1 7.364 2.301 12.761 1.00 14.75 H ATOM 25 HH21 ARG A 1 7.307 0.156 9.929 1.00 15.26 H ATOM 26 HH22 ARG A 1 8.239 0.683 11.275 1.00 16.24 H ATOM 27 N LYS A 2 -0.835 0.960 10.016 1.00 2.23 N ATOM 28 CA LYS A 2 -2.040 0.387 9.424 1.00 0.59 C ATOM 29 C LYS A 2 -1.633 -0.413 8.189 1.00 0.79 C ATOM 30 O LYS A 2 -0.445 -0.489 7.875 1.00 2.13 O ATOM 31 CB LYS A 2 -3.037 1.510 9.110 1.00 2.26 C ATOM 32 CG LYS A 2 -3.554 2.119 10.425 1.00 3.11 C ATOM 33 CD LYS A 2 -3.357 3.633 10.450 1.00 4.58 C ATOM 34 CE LYS A 2 -3.732 4.193 11.822 1.00 5.63 C ATOM 35 NZ LYS A 2 -4.076 5.627 11.731 1.00 7.30 N ATOM 36 H LYS A 2 -0.445 1.768 9.550 1.00 3.22 H ATOM 37 HA LYS A 2 -2.503 -0.306 10.128 1.00 1.65 H ATOM 38 HB2 LYS A 2 -2.552 2.272 8.496 1.00 3.15 H ATOM 39 HB3 LYS A 2 -3.885 1.114 8.552 1.00 3.33 H ATOM 40 HG2 LYS A 2 -4.618 1.899 10.528 1.00 3.98 H ATOM 41 HG3 LYS A 2 -3.035 1.683 11.279 1.00 3.08 H ATOM 42 HD2 LYS A 2 -2.311 3.870 10.247 1.00 4.71 H ATOM 43 HD3 LYS A 2 -3.986 4.077 9.677 1.00 5.58 H ATOM 44 HE2 LYS A 2 -4.585 3.636 12.216 1.00 6.08 H ATOM 45 HE3 LYS A 2 -2.887 4.055 12.500 1.00 5.35 H ATOM 46 HZ1 LYS A 2 -4.912 5.739 11.174 1.00 8.03 H ATOM 47 HZ2 LYS A 2 -4.238 6.009 12.653 1.00 7.85 H ATOM 48 HZ3 LYS A 2 -3.326 6.132 11.276 1.00 7.54 H ATOM 49 N SER A 3 -2.596 -1.038 7.511 1.00 0.68 N ATOM 50 CA SER A 3 -2.304 -1.722 6.263 1.00 0.62 C ATOM 51 C SER A 3 -1.839 -0.709 5.227 1.00 0.56 C ATOM 52 O SER A 3 -2.484 0.315 5.014 1.00 0.67 O ATOM 53 CB SER A 3 -3.536 -2.475 5.760 1.00 0.68 C ATOM 54 OG SER A 3 -3.649 -3.699 6.455 1.00 1.63 O ATOM 55 H SER A 3 -3.561 -0.901 7.767 1.00 1.74 H ATOM 56 HA SER A 3 -1.496 -2.437 6.431 1.00 0.64 H ATOM 57 HB2 SER A 3 -4.432 -1.872 5.913 1.00 1.52 H ATOM 58 HB3 SER A 3 -3.426 -2.681 4.694 1.00 1.30 H ATOM 59 HG SER A 3 -3.660 -3.537 7.400 1.00 2.40 H ATOM 60 N ILE A 4 -0.703 -1.017 4.608 1.00 0.45 N ATOM 61 CA ILE A 4 -0.099 -0.242 3.550 1.00 0.40 C ATOM 62 C ILE A 4 -0.643 -0.778 2.227 1.00 0.34 C ATOM 63 O ILE A 4 -1.820 -1.102 2.098 1.00 0.39 O ATOM 64 CB ILE A 4 1.442 -0.309 3.673 1.00 0.42 C ATOM 65 CG1 ILE A 4 1.907 -0.347 5.133 1.00 0.51 C ATOM 66 CG2 ILE A 4 2.058 0.947 3.026 1.00 0.43 C ATOM 67 CD1 ILE A 4 2.223 -1.757 5.652 1.00 1.38 C ATOM 68 H ILE A 4 -0.205 -1.844 4.883 1.00 0.46 H ATOM 69 HA ILE A 4 -0.397 0.798 3.642 1.00 0.43 H ATOM 70 HB ILE A 4 1.836 -1.210 3.200 1.00 0.39 H ATOM 71 HG12 ILE A 4 2.821 0.220 5.195 1.00 0.87 H ATOM 72 HG13 ILE A 4 1.176 0.150 5.766 1.00 1.10 H ATOM 73 HG21 ILE A 4 1.659 1.138 2.032 1.00 1.47 H ATOM 74 HG22 ILE A 4 1.841 1.820 3.642 1.00 1.62 H ATOM 75 HG23 ILE A 4 3.141 0.829 2.948 1.00 1.28 H ATOM 76 HD11 ILE A 4 2.313 -1.730 6.739 1.00 2.13 H ATOM 77 HD12 ILE A 4 1.451 -2.472 5.379 1.00 2.48 H ATOM 78 HD13 ILE A 4 3.167 -2.095 5.226 1.00 2.30 H ATOM 79 N ASN A 5 0.234 -0.877 1.241 1.00 0.29 N ATOM 80 CA ASN A 5 -0.018 -1.396 -0.081 1.00 0.24 C ATOM 81 C ASN A 5 0.805 -2.671 -0.254 1.00 0.22 C ATOM 82 O ASN A 5 1.737 -2.901 0.511 1.00 0.28 O ATOM 83 CB ASN A 5 0.325 -0.275 -1.054 1.00 0.26 C ATOM 84 CG ASN A 5 0.320 -0.766 -2.471 1.00 0.23 C ATOM 85 OD1 ASN A 5 -0.678 -0.688 -3.170 1.00 0.26 O ATOM 86 ND2 ASN A 5 1.446 -1.302 -2.881 1.00 0.22 N ATOM 87 H ASN A 5 1.194 -0.648 1.440 1.00 0.31 H ATOM 88 HA ASN A 5 -1.056 -1.650 -0.237 1.00 0.26 H ATOM 89 HB2 ASN A 5 -0.421 0.510 -0.973 1.00 0.30 H ATOM 90 HB3 ASN A 5 1.305 0.143 -0.822 1.00 0.29 H ATOM 91 HD21 ASN A 5 2.192 -1.484 -2.220 1.00 0.24 H ATOM 92 HD22 ASN A 5 1.595 -1.486 -3.852 1.00 0.22 H ATOM 93 N ILE A 6 0.444 -3.493 -1.245 1.00 0.17 N ATOM 94 CA ILE A 6 1.222 -4.637 -1.702 1.00 0.17 C ATOM 95 C ILE A 6 2.479 -4.099 -2.413 1.00 0.18 C ATOM 96 O ILE A 6 3.238 -3.322 -1.841 1.00 0.38 O ATOM 97 CB ILE A 6 0.318 -5.514 -2.588 1.00 0.22 C ATOM 98 CG1 ILE A 6 -1.004 -5.841 -1.872 1.00 0.29 C ATOM 99 CG2 ILE A 6 0.959 -6.844 -3.032 1.00 0.28 C ATOM 100 CD1 ILE A 6 -0.847 -6.339 -0.430 1.00 2.49 C ATOM 101 H ILE A 6 -0.348 -3.238 -1.816 1.00 0.20 H ATOM 102 HA ILE A 6 1.520 -5.234 -0.842 1.00 0.22 H ATOM 103 HB ILE A 6 0.069 -4.947 -3.486 1.00 0.24 H ATOM 104 HG12 ILE A 6 -1.652 -4.964 -1.871 1.00 1.84 H ATOM 105 HG13 ILE A 6 -1.500 -6.613 -2.445 1.00 1.95 H ATOM 106 HG21 ILE A 6 2.034 -6.764 -3.170 1.00 1.34 H ATOM 107 HG22 ILE A 6 0.791 -7.624 -2.292 1.00 1.36 H ATOM 108 HG23 ILE A 6 0.504 -7.155 -3.973 1.00 1.35 H ATOM 109 HD11 ILE A 6 -1.814 -6.688 -0.066 1.00 3.02 H ATOM 110 HD12 ILE A 6 -0.137 -7.162 -0.380 1.00 3.52 H ATOM 111 HD13 ILE A 6 -0.504 -5.532 0.216 1.00 3.65 H ATOM 112 N GLY A 7 2.694 -4.453 -3.681 1.00 0.18 N ATOM 113 CA GLY A 7 3.852 -4.020 -4.443 1.00 0.20 C ATOM 114 C GLY A 7 3.449 -2.868 -5.352 1.00 0.19 C ATOM 115 O GLY A 7 3.528 -1.714 -4.943 1.00 0.20 O ATOM 116 H GLY A 7 2.024 -5.047 -4.143 1.00 0.33 H ATOM 117 HA2 GLY A 7 4.641 -3.678 -3.769 1.00 0.24 H ATOM 118 HA3 GLY A 7 4.242 -4.851 -5.029 1.00 0.25 H ATOM 119 N PRO A 8 2.987 -3.155 -6.575 1.00 0.24 N ATOM 120 CA PRO A 8 2.655 -2.133 -7.553 1.00 0.31 C ATOM 121 C PRO A 8 1.374 -1.398 -7.142 1.00 0.26 C ATOM 122 O PRO A 8 0.276 -1.765 -7.550 1.00 0.33 O ATOM 123 CB PRO A 8 2.516 -2.892 -8.877 1.00 0.44 C ATOM 124 CG PRO A 8 2.043 -4.279 -8.440 1.00 0.41 C ATOM 125 CD PRO A 8 2.768 -4.486 -7.110 1.00 0.31 C ATOM 126 HA PRO A 8 3.469 -1.413 -7.635 1.00 0.35 H ATOM 127 HB2 PRO A 8 1.814 -2.416 -9.563 1.00 0.50 H ATOM 128 HB3 PRO A 8 3.499 -2.980 -9.343 1.00 0.50 H ATOM 129 HG2 PRO A 8 0.966 -4.266 -8.271 1.00 0.42 H ATOM 130 HG3 PRO A 8 2.309 -5.046 -9.167 1.00 0.49 H ATOM 131 HD2 PRO A 8 2.155 -5.087 -6.438 1.00 0.28 H ATOM 132 HD3 PRO A 8 3.729 -4.971 -7.286 1.00 0.35 H ATOM 133 N GLY A 9 1.519 -0.352 -6.329 1.00 0.20 N ATOM 134 CA GLY A 9 0.422 0.447 -5.810 1.00 0.19 C ATOM 135 C GLY A 9 0.965 1.384 -4.734 1.00 0.19 C ATOM 136 O GLY A 9 2.156 1.341 -4.439 1.00 0.36 O ATOM 137 H GLY A 9 2.436 -0.149 -5.942 1.00 0.22 H ATOM 138 HA2 GLY A 9 -0.025 1.030 -6.613 1.00 0.24 H ATOM 139 HA3 GLY A 9 -0.333 -0.217 -5.387 1.00 0.20 H ATOM 140 N ARG A 10 0.113 2.220 -4.134 1.00 0.18 N ATOM 141 CA ARG A 10 0.437 3.013 -2.948 1.00 0.17 C ATOM 142 C ARG A 10 -0.815 3.073 -2.081 1.00 0.17 C ATOM 143 O ARG A 10 -1.908 2.786 -2.564 1.00 0.25 O ATOM 144 CB ARG A 10 0.912 4.432 -3.316 1.00 0.34 C ATOM 145 CG ARG A 10 2.366 4.469 -3.819 1.00 1.70 C ATOM 146 CD ARG A 10 2.484 4.935 -5.276 1.00 2.46 C ATOM 147 NE ARG A 10 2.698 6.390 -5.353 1.00 2.85 N ATOM 148 CZ ARG A 10 2.890 7.087 -6.478 1.00 3.82 C ATOM 149 NH1 ARG A 10 2.741 6.498 -7.665 1.00 4.57 N ATOM 150 NH2 ARG A 10 3.239 8.374 -6.415 1.00 4.90 N ATOM 151 H ARG A 10 -0.876 2.150 -4.347 1.00 0.30 H ATOM 152 HA ARG A 10 1.214 2.502 -2.377 1.00 0.21 H ATOM 153 HB2 ARG A 10 0.236 4.866 -4.056 1.00 1.17 H ATOM 154 HB3 ARG A 10 0.860 5.059 -2.424 1.00 1.27 H ATOM 155 HG2 ARG A 10 2.951 5.131 -3.180 1.00 2.59 H ATOM 156 HG3 ARG A 10 2.819 3.487 -3.722 1.00 2.89 H ATOM 157 HD2 ARG A 10 3.345 4.436 -5.725 1.00 3.69 H ATOM 158 HD3 ARG A 10 1.589 4.649 -5.830 1.00 3.37 H ATOM 159 HE ARG A 10 2.783 6.860 -4.462 1.00 3.33 H ATOM 160 HH11 ARG A 10 2.468 5.528 -7.707 1.00 4.62 H ATOM 161 HH12 ARG A 10 2.876 6.991 -8.534 1.00 5.60 H ATOM 162 HH21 ARG A 10 3.382 8.830 -5.525 1.00 5.30 H ATOM 163 HH22 ARG A 10 3.401 8.922 -7.247 1.00 5.74 H ATOM 164 N ALA A 11 -0.656 3.444 -0.812 1.00 0.20 N ATOM 165 CA ALA A 11 -1.744 3.556 0.142 1.00 0.24 C ATOM 166 C ALA A 11 -1.511 4.808 0.982 1.00 0.29 C ATOM 167 O ALA A 11 -0.419 5.372 0.943 1.00 0.61 O ATOM 168 CB ALA A 11 -1.779 2.311 1.030 1.00 0.33 C ATOM 169 H ALA A 11 0.238 3.777 -0.479 1.00 0.25 H ATOM 170 HA ALA A 11 -2.685 3.647 -0.401 1.00 0.23 H ATOM 171 HB1 ALA A 11 -0.792 2.147 1.463 1.00 1.25 H ATOM 172 HB2 ALA A 11 -2.502 2.447 1.835 1.00 1.41 H ATOM 173 HB3 ALA A 11 -2.069 1.444 0.437 1.00 1.43 H ATOM 174 N PHE A 12 -2.529 5.242 1.731 1.00 0.44 N ATOM 175 CA PHE A 12 -2.505 6.531 2.406 1.00 0.34 C ATOM 176 C PHE A 12 -3.180 6.407 3.775 1.00 0.93 C ATOM 177 O PHE A 12 -4.208 7.034 4.016 1.00 1.33 O ATOM 178 CB PHE A 12 -3.227 7.570 1.529 1.00 1.01 C ATOM 179 CG PHE A 12 -2.641 7.772 0.141 1.00 1.80 C ATOM 180 CD1 PHE A 12 -3.020 6.927 -0.921 1.00 3.02 C ATOM 181 CD2 PHE A 12 -1.731 8.818 -0.097 1.00 2.48 C ATOM 182 CE1 PHE A 12 -2.483 7.117 -2.206 1.00 3.79 C ATOM 183 CE2 PHE A 12 -1.205 9.019 -1.386 1.00 3.32 C ATOM 184 CZ PHE A 12 -1.578 8.166 -2.440 1.00 3.66 C ATOM 185 H PHE A 12 -3.394 4.725 1.766 1.00 0.74 H ATOM 186 HA PHE A 12 -1.472 6.843 2.551 1.00 0.58 H ATOM 187 HB2 PHE A 12 -4.268 7.266 1.420 1.00 1.54 H ATOM 188 HB3 PHE A 12 -3.223 8.528 2.049 1.00 0.84 H ATOM 189 HD1 PHE A 12 -3.725 6.127 -0.750 1.00 3.75 H ATOM 190 HD2 PHE A 12 -1.440 9.476 0.709 1.00 3.04 H ATOM 191 HE1 PHE A 12 -2.775 6.463 -3.015 1.00 4.87 H ATOM 192 HE2 PHE A 12 -0.517 9.832 -1.565 1.00 4.19 H ATOM 193 HZ PHE A 12 -1.177 8.325 -3.431 1.00 4.40 H ATOM 194 N TYR A 13 -2.618 5.584 4.666 1.00 1.44 N ATOM 195 CA TYR A 13 -3.189 5.288 5.975 1.00 2.13 C ATOM 196 C TYR A 13 -2.058 5.052 6.968 1.00 2.73 C ATOM 197 O TYR A 13 -0.968 4.662 6.497 1.00 3.14 O ATOM 198 CB TYR A 13 -4.075 4.039 5.886 1.00 2.65 C ATOM 199 CG TYR A 13 -5.263 4.183 4.955 1.00 2.17 C ATOM 200 CD1 TYR A 13 -6.315 5.051 5.300 1.00 2.95 C ATOM 201 CD2 TYR A 13 -5.307 3.475 3.739 1.00 2.39 C ATOM 202 CE1 TYR A 13 -7.411 5.214 4.437 1.00 3.45 C ATOM 203 CE2 TYR A 13 -6.399 3.636 2.864 1.00 2.46 C ATOM 204 CZ TYR A 13 -7.458 4.509 3.214 1.00 2.88 C ATOM 205 OH TYR A 13 -8.527 4.677 2.387 1.00 3.74 O ATOM 206 OXT TYR A 13 -2.314 5.240 8.179 1.00 3.34 O ATOM 207 H TYR A 13 -1.723 5.146 4.495 1.00 1.53 H ATOM 208 HA TYR A 13 -3.781 6.136 6.318 1.00 2.08 H ATOM 209 HB2 TYR A 13 -3.461 3.194 5.567 1.00 3.22 H ATOM 210 HB3 TYR A 13 -4.449 3.810 6.885 1.00 3.44 H ATOM 211 HD1 TYR A 13 -6.268 5.610 6.223 1.00 3.78 H ATOM 212 HD2 TYR A 13 -4.502 2.803 3.481 1.00 3.33 H ATOM 213 HE1 TYR A 13 -8.216 5.886 4.697 1.00 4.69 H ATOM 214 HE2 TYR A 13 -6.423 3.085 1.937 1.00 3.12 H ATOM 215 HH TYR A 13 -8.483 4.156 1.584 1.00 3.78 H TER 216 TYR A 13 ENDMDL MODEL 7 ATOM 1 N ARG A 1 -7.049 0.836 11.251 1.00 5.67 N ATOM 2 CA ARG A 1 -6.542 0.506 9.905 1.00 5.25 C ATOM 3 C ARG A 1 -5.092 0.051 10.048 1.00 3.33 C ATOM 4 O ARG A 1 -4.915 -1.063 10.520 1.00 3.46 O ATOM 5 CB ARG A 1 -6.779 1.626 8.875 1.00 6.58 C ATOM 6 CG ARG A 1 -8.285 1.860 8.654 1.00 7.98 C ATOM 7 CD ARG A 1 -8.561 3.021 7.684 1.00 9.59 C ATOM 8 NE ARG A 1 -9.204 2.581 6.435 1.00 11.03 N ATOM 9 CZ ARG A 1 -9.803 3.393 5.551 1.00 12.67 C ATOM 10 NH1 ARG A 1 -9.843 4.709 5.768 1.00 13.25 N ATOM 11 NH2 ARG A 1 -10.373 2.890 4.456 1.00 14.00 N ATOM 12 H1 ARG A 1 -6.605 1.677 11.589 1.00 5.62 H ATOM 13 H2 ARG A 1 -8.050 0.965 11.232 1.00 6.97 H ATOM 14 H3 ARG A 1 -6.825 0.070 11.875 1.00 5.23 H ATOM 15 HA ARG A 1 -7.087 -0.373 9.556 1.00 6.03 H ATOM 16 HB2 ARG A 1 -6.317 2.552 9.219 1.00 7.04 H ATOM 17 HB3 ARG A 1 -6.329 1.337 7.923 1.00 6.66 H ATOM 18 HG2 ARG A 1 -8.743 0.942 8.281 1.00 8.42 H ATOM 19 HG3 ARG A 1 -8.753 2.107 9.606 1.00 7.94 H ATOM 20 HD2 ARG A 1 -9.222 3.728 8.187 1.00 10.19 H ATOM 21 HD3 ARG A 1 -7.627 3.532 7.446 1.00 9.56 H ATOM 22 HE ARG A 1 -9.168 1.591 6.238 1.00 10.96 H ATOM 23 HH11 ARG A 1 -9.430 5.100 6.599 1.00 12.49 H ATOM 24 HH12 ARG A 1 -10.274 5.345 5.114 1.00 14.61 H ATOM 25 HH21 ARG A 1 -10.354 1.901 4.260 1.00 13.96 H ATOM 26 HH22 ARG A 1 -10.797 3.487 3.763 1.00 15.23 H ATOM 27 N LYS A 2 -4.086 0.890 9.754 1.00 2.36 N ATOM 28 CA LYS A 2 -2.728 0.433 9.432 1.00 0.82 C ATOM 29 C LYS A 2 -2.786 -0.456 8.182 1.00 1.14 C ATOM 30 O LYS A 2 -3.862 -0.666 7.627 1.00 3.01 O ATOM 31 CB LYS A 2 -1.994 -0.260 10.611 1.00 1.90 C ATOM 32 CG LYS A 2 -1.435 0.669 11.699 1.00 2.75 C ATOM 33 CD LYS A 2 -2.415 0.991 12.836 1.00 4.08 C ATOM 34 CE LYS A 2 -3.073 2.366 12.696 1.00 4.89 C ATOM 35 NZ LYS A 2 -2.097 3.475 12.823 1.00 5.95 N ATOM 36 H LYS A 2 -4.317 1.783 9.345 1.00 3.43 H ATOM 37 HA LYS A 2 -2.142 1.308 9.147 1.00 1.51 H ATOM 38 HB2 LYS A 2 -2.601 -1.041 11.061 1.00 3.05 H ATOM 39 HB3 LYS A 2 -1.122 -0.774 10.207 1.00 2.67 H ATOM 40 HG2 LYS A 2 -0.586 0.153 12.149 1.00 3.71 H ATOM 41 HG3 LYS A 2 -1.051 1.581 11.243 1.00 2.88 H ATOM 42 HD2 LYS A 2 -3.185 0.220 12.884 1.00 4.53 H ATOM 43 HD3 LYS A 2 -1.870 0.962 13.783 1.00 5.11 H ATOM 44 HE2 LYS A 2 -3.569 2.423 11.727 1.00 5.12 H ATOM 45 HE3 LYS A 2 -3.824 2.464 13.482 1.00 5.35 H ATOM 46 HZ1 LYS A 2 -1.429 3.451 12.063 1.00 6.23 H ATOM 47 HZ2 LYS A 2 -2.574 4.366 12.794 1.00 6.58 H ATOM 48 HZ3 LYS A 2 -1.598 3.404 13.700 1.00 6.44 H ATOM 49 N SER A 3 -1.615 -0.924 7.742 1.00 0.75 N ATOM 50 CA SER A 3 -1.357 -1.669 6.518 1.00 0.73 C ATOM 51 C SER A 3 -1.009 -0.669 5.431 1.00 0.62 C ATOM 52 O SER A 3 -1.673 0.353 5.266 1.00 0.66 O ATOM 53 CB SER A 3 -2.519 -2.569 6.082 1.00 0.85 C ATOM 54 OG SER A 3 -2.076 -3.434 5.052 1.00 2.15 O ATOM 55 H SER A 3 -0.786 -0.643 8.241 1.00 2.22 H ATOM 56 HA SER A 3 -0.483 -2.299 6.689 1.00 0.80 H ATOM 57 HB2 SER A 3 -2.848 -3.170 6.930 1.00 1.79 H ATOM 58 HB3 SER A 3 -3.351 -1.973 5.708 1.00 1.15 H ATOM 59 HG SER A 3 -2.067 -2.952 4.214 1.00 2.94 H ATOM 60 N ILE A 4 0.054 -0.981 4.697 1.00 0.55 N ATOM 61 CA ILE A 4 0.485 -0.215 3.559 1.00 0.41 C ATOM 62 C ILE A 4 -0.160 -0.850 2.326 1.00 0.34 C ATOM 63 O ILE A 4 -1.273 -1.375 2.384 1.00 0.54 O ATOM 64 CB ILE A 4 2.019 -0.193 3.513 1.00 0.48 C ATOM 65 CG1 ILE A 4 2.647 -0.142 4.910 1.00 0.66 C ATOM 66 CG2 ILE A 4 2.484 1.086 2.784 1.00 0.46 C ATOM 67 CD1 ILE A 4 2.868 -1.491 5.611 1.00 1.44 C ATOM 68 H ILE A 4 0.585 -1.816 4.879 1.00 0.60 H ATOM 69 HA ILE A 4 0.151 0.813 3.661 1.00 0.39 H ATOM 70 HB ILE A 4 2.398 -1.082 3.008 1.00 0.51 H ATOM 71 HG12 ILE A 4 3.620 0.285 4.761 1.00 1.20 H ATOM 72 HG13 ILE A 4 2.082 0.536 5.546 1.00 0.91 H ATOM 73 HG21 ILE A 4 3.552 1.022 2.570 1.00 1.78 H ATOM 74 HG22 ILE A 4 1.952 1.256 1.850 1.00 1.82 H ATOM 75 HG23 ILE A 4 2.308 1.954 3.422 1.00 1.66 H ATOM 76 HD11 ILE A 4 3.692 -1.392 6.319 1.00 2.28 H ATOM 77 HD12 ILE A 4 1.988 -1.795 6.175 1.00 1.91 H ATOM 78 HD13 ILE A 4 3.127 -2.260 4.882 1.00 2.42 H ATOM 79 N ASN A 5 0.572 -0.822 1.222 1.00 0.24 N ATOM 80 CA ASN A 5 0.230 -1.381 -0.062 1.00 0.18 C ATOM 81 C ASN A 5 1.118 -2.603 -0.290 1.00 0.23 C ATOM 82 O ASN A 5 2.133 -2.753 0.387 1.00 0.32 O ATOM 83 CB ASN A 5 0.423 -0.269 -1.085 1.00 0.22 C ATOM 84 CG ASN A 5 0.261 -0.794 -2.479 1.00 0.28 C ATOM 85 OD1 ASN A 5 -0.829 -0.820 -3.028 1.00 0.41 O ATOM 86 ND2 ASN A 5 1.356 -1.250 -3.041 1.00 0.33 N ATOM 87 H ASN A 5 1.531 -0.520 1.298 1.00 0.31 H ATOM 88 HA ASN A 5 -0.801 -1.701 -0.119 1.00 0.24 H ATOM 89 HB2 ASN A 5 -0.334 0.493 -0.941 1.00 0.27 H ATOM 90 HB3 ASN A 5 1.409 0.183 -0.976 1.00 0.29 H ATOM 91 HD21 ASN A 5 2.195 -1.371 -2.485 1.00 0.36 H ATOM 92 HD22 ASN A 5 1.346 -1.553 -3.989 1.00 0.43 H ATOM 93 N ILE A 6 0.725 -3.466 -1.229 1.00 0.24 N ATOM 94 CA ILE A 6 1.531 -4.577 -1.714 1.00 0.34 C ATOM 95 C ILE A 6 2.661 -3.997 -2.589 1.00 0.32 C ATOM 96 O ILE A 6 3.345 -3.060 -2.182 1.00 0.64 O ATOM 97 CB ILE A 6 0.595 -5.567 -2.430 1.00 0.42 C ATOM 98 CG1 ILE A 6 -0.584 -5.950 -1.519 1.00 0.61 C ATOM 99 CG2 ILE A 6 1.314 -6.846 -2.895 1.00 0.53 C ATOM 100 CD1 ILE A 6 -0.183 -6.439 -0.121 1.00 3.09 C ATOM 101 H ILE A 6 -0.126 -3.278 -1.736 1.00 0.24 H ATOM 102 HA ILE A 6 1.967 -5.097 -0.864 1.00 0.49 H ATOM 103 HB ILE A 6 0.180 -5.073 -3.312 1.00 0.36 H ATOM 104 HG12 ILE A 6 -1.266 -5.106 -1.413 1.00 1.51 H ATOM 105 HG13 ILE A 6 -1.133 -6.743 -2.010 1.00 1.85 H ATOM 106 HG21 ILE A 6 1.198 -6.954 -3.975 1.00 1.24 H ATOM 107 HG22 ILE A 6 2.372 -6.817 -2.637 1.00 1.73 H ATOM 108 HG23 ILE A 6 0.880 -7.729 -2.426 1.00 1.50 H ATOM 109 HD11 ILE A 6 -1.066 -6.824 0.391 1.00 3.60 H ATOM 110 HD12 ILE A 6 0.558 -7.234 -0.190 1.00 4.11 H ATOM 111 HD13 ILE A 6 0.222 -5.616 0.469 1.00 4.19 H ATOM 112 N GLY A 7 2.854 -4.500 -3.809 1.00 0.31 N ATOM 113 CA GLY A 7 3.882 -4.005 -4.710 1.00 0.28 C ATOM 114 C GLY A 7 3.302 -2.909 -5.595 1.00 0.20 C ATOM 115 O GLY A 7 3.421 -1.731 -5.268 1.00 0.24 O ATOM 116 H GLY A 7 2.255 -5.235 -4.144 1.00 0.56 H ATOM 117 HA2 GLY A 7 4.713 -3.591 -4.137 1.00 0.36 H ATOM 118 HA3 GLY A 7 4.262 -4.821 -5.322 1.00 0.34 H ATOM 119 N PRO A 8 2.655 -3.272 -6.710 1.00 0.23 N ATOM 120 CA PRO A 8 2.138 -2.315 -7.672 1.00 0.37 C ATOM 121 C PRO A 8 0.946 -1.563 -7.077 1.00 0.34 C ATOM 122 O PRO A 8 -0.198 -1.980 -7.233 1.00 0.44 O ATOM 123 CB PRO A 8 1.762 -3.154 -8.899 1.00 0.52 C ATOM 124 CG PRO A 8 1.413 -4.519 -8.302 1.00 0.43 C ATOM 125 CD PRO A 8 2.393 -4.636 -7.134 1.00 0.24 C ATOM 126 HA PRO A 8 2.913 -1.599 -7.947 1.00 0.45 H ATOM 127 HB2 PRO A 8 0.929 -2.730 -9.462 1.00 0.63 H ATOM 128 HB3 PRO A 8 2.636 -3.260 -9.543 1.00 0.60 H ATOM 129 HG2 PRO A 8 0.391 -4.507 -7.923 1.00 0.46 H ATOM 130 HG3 PRO A 8 1.547 -5.325 -9.023 1.00 0.51 H ATOM 131 HD2 PRO A 8 1.948 -5.226 -6.332 1.00 0.22 H ATOM 132 HD3 PRO A 8 3.320 -5.095 -7.477 1.00 0.29 H ATOM 133 N GLY A 9 1.207 -0.454 -6.384 1.00 0.27 N ATOM 134 CA GLY A 9 0.164 0.348 -5.773 1.00 0.29 C ATOM 135 C GLY A 9 0.754 1.394 -4.830 1.00 0.24 C ATOM 136 O GLY A 9 1.970 1.602 -4.779 1.00 0.35 O ATOM 137 H GLY A 9 2.165 -0.189 -6.185 1.00 0.27 H ATOM 138 HA2 GLY A 9 -0.408 0.852 -6.551 1.00 0.44 H ATOM 139 HA3 GLY A 9 -0.511 -0.309 -5.228 1.00 0.30 H ATOM 140 N ARG A 10 -0.126 2.067 -4.088 1.00 0.27 N ATOM 141 CA ARG A 10 0.194 3.089 -3.099 1.00 0.33 C ATOM 142 C ARG A 10 -0.891 3.030 -2.033 1.00 0.20 C ATOM 143 O ARG A 10 -1.974 2.514 -2.291 1.00 0.33 O ATOM 144 CB ARG A 10 0.198 4.483 -3.754 1.00 0.79 C ATOM 145 CG ARG A 10 1.457 4.778 -4.575 1.00 1.49 C ATOM 146 CD ARG A 10 2.666 5.006 -3.659 1.00 2.16 C ATOM 147 NE ARG A 10 3.814 4.164 -4.026 1.00 3.52 N ATOM 148 CZ ARG A 10 5.102 4.499 -3.849 1.00 4.38 C ATOM 149 NH1 ARG A 10 5.431 5.679 -3.318 1.00 4.44 N ATOM 150 NH2 ARG A 10 6.070 3.651 -4.199 1.00 5.81 N ATOM 151 H ARG A 10 -1.100 1.786 -4.114 1.00 0.38 H ATOM 152 HA ARG A 10 1.150 2.864 -2.627 1.00 0.45 H ATOM 153 HB2 ARG A 10 -0.676 4.569 -4.403 1.00 1.81 H ATOM 154 HB3 ARG A 10 0.110 5.249 -2.981 1.00 1.42 H ATOM 155 HG2 ARG A 10 1.647 3.976 -5.285 1.00 2.37 H ATOM 156 HG3 ARG A 10 1.290 5.687 -5.154 1.00 2.62 H ATOM 157 HD2 ARG A 10 2.929 6.062 -3.726 1.00 2.61 H ATOM 158 HD3 ARG A 10 2.394 4.789 -2.626 1.00 2.66 H ATOM 159 HE ARG A 10 3.565 3.254 -4.405 1.00 4.29 H ATOM 160 HH11 ARG A 10 4.711 6.322 -3.029 1.00 3.96 H ATOM 161 HH12 ARG A 10 6.389 5.962 -3.180 1.00 5.41 H ATOM 162 HH21 ARG A 10 5.846 2.748 -4.591 1.00 6.44 H ATOM 163 HH22 ARG A 10 7.045 3.878 -4.073 1.00 6.56 H ATOM 164 N ALA A 11 -0.605 3.559 -0.846 1.00 0.21 N ATOM 165 CA ALA A 11 -1.561 3.630 0.238 1.00 0.23 C ATOM 166 C ALA A 11 -1.344 4.941 0.983 1.00 0.28 C ATOM 167 O ALA A 11 -0.318 5.591 0.781 1.00 0.75 O ATOM 168 CB ALA A 11 -1.341 2.441 1.171 1.00 0.41 C ATOM 169 H ALA A 11 0.274 4.022 -0.663 1.00 0.36 H ATOM 170 HA ALA A 11 -2.571 3.603 -0.172 1.00 0.27 H ATOM 171 HB1 ALA A 11 -0.331 2.490 1.579 1.00 1.61 H ATOM 172 HB2 ALA A 11 -2.067 2.466 1.980 1.00 1.29 H ATOM 173 HB3 ALA A 11 -1.466 1.515 0.617 1.00 1.28 H ATOM 174 N PHE A 12 -2.284 5.314 1.853 1.00 0.49 N ATOM 175 CA PHE A 12 -2.240 6.583 2.562 1.00 0.39 C ATOM 176 C PHE A 12 -2.679 6.351 4.010 1.00 1.29 C ATOM 177 O PHE A 12 -3.773 6.752 4.400 1.00 1.74 O ATOM 178 CB PHE A 12 -3.142 7.602 1.843 1.00 0.99 C ATOM 179 CG PHE A 12 -2.921 7.722 0.342 1.00 1.96 C ATOM 180 CD1 PHE A 12 -1.697 8.198 -0.160 1.00 1.92 C ATOM 181 CD2 PHE A 12 -3.939 7.344 -0.555 1.00 3.98 C ATOM 182 CE1 PHE A 12 -1.488 8.292 -1.548 1.00 2.84 C ATOM 183 CE2 PHE A 12 -3.733 7.441 -1.942 1.00 5.09 C ATOM 184 CZ PHE A 12 -2.507 7.914 -2.441 1.00 4.27 C ATOM 185 H PHE A 12 -3.089 4.728 2.019 1.00 0.93 H ATOM 186 HA PHE A 12 -1.217 6.958 2.558 1.00 0.68 H ATOM 187 HB2 PHE A 12 -4.181 7.318 2.012 1.00 1.73 H ATOM 188 HB3 PHE A 12 -2.994 8.583 2.297 1.00 0.70 H ATOM 189 HD1 PHE A 12 -0.906 8.481 0.520 1.00 2.51 H ATOM 190 HD2 PHE A 12 -4.886 6.982 -0.184 1.00 4.89 H ATOM 191 HE1 PHE A 12 -0.545 8.656 -1.928 1.00 3.18 H ATOM 192 HE2 PHE A 12 -4.518 7.155 -2.628 1.00 6.75 H ATOM 193 HZ PHE A 12 -2.351 7.991 -3.507 1.00 5.19 H ATOM 194 N TYR A 13 -1.845 5.664 4.796 1.00 1.96 N ATOM 195 CA TYR A 13 -2.141 5.252 6.165 1.00 2.85 C ATOM 196 C TYR A 13 -0.848 5.225 6.970 1.00 3.54 C ATOM 197 O TYR A 13 0.215 5.347 6.321 1.00 3.95 O ATOM 198 CB TYR A 13 -2.755 3.846 6.184 1.00 3.48 C ATOM 199 CG TYR A 13 -4.026 3.704 5.374 1.00 2.94 C ATOM 200 CD1 TYR A 13 -5.175 4.420 5.750 1.00 3.35 C ATOM 201 CD2 TYR A 13 -4.043 2.893 4.225 1.00 3.42 C ATOM 202 CE1 TYR A 13 -6.339 4.342 4.968 1.00 3.44 C ATOM 203 CE2 TYR A 13 -5.201 2.817 3.430 1.00 3.36 C ATOM 204 CZ TYR A 13 -6.356 3.544 3.803 1.00 2.98 C ATOM 205 OH TYR A 13 -7.491 3.485 3.051 1.00 3.53 O ATOM 206 OXT TYR A 13 -0.957 5.034 8.202 1.00 4.14 O ATOM 207 H TYR A 13 -0.900 5.451 4.501 1.00 2.07 H ATOM 208 HA TYR A 13 -2.822 5.967 6.624 1.00 2.80 H ATOM 209 HB2 TYR A 13 -2.009 3.140 5.816 1.00 4.09 H ATOM 210 HB3 TYR A 13 -2.973 3.578 7.218 1.00 4.24 H ATOM 211 HD1 TYR A 13 -5.139 5.069 6.611 1.00 4.35 H ATOM 212 HD2 TYR A 13 -3.160 2.329 3.963 1.00 4.52 H ATOM 213 HE1 TYR A 13 -7.206 4.924 5.231 1.00 4.54 H ATOM 214 HE2 TYR A 13 -5.194 2.197 2.546 1.00 4.38 H ATOM 215 HH TYR A 13 -7.349 3.067 2.198 1.00 3.67 H TER 216 TYR A 13 ENDMDL MODEL 8 ATOM 1 N ARG A 1 -6.289 -0.818 11.337 1.00 5.23 N ATOM 2 CA ARG A 1 -5.341 -0.114 12.227 1.00 4.32 C ATOM 3 C ARG A 1 -4.202 0.479 11.409 1.00 2.68 C ATOM 4 O ARG A 1 -4.182 1.688 11.240 1.00 3.06 O ATOM 5 CB ARG A 1 -4.859 -1.000 13.389 1.00 5.40 C ATOM 6 CG ARG A 1 -5.453 -0.526 14.726 1.00 6.67 C ATOM 7 CD ARG A 1 -5.566 -1.694 15.718 1.00 7.93 C ATOM 8 NE ARG A 1 -5.409 -1.263 17.117 1.00 9.00 N ATOM 9 CZ ARG A 1 -5.834 -1.937 18.197 1.00 10.41 C ATOM 10 NH1 ARG A 1 -6.605 -3.017 18.063 1.00 11.05 N ATOM 11 NH2 ARG A 1 -5.477 -1.533 19.417 1.00 11.54 N ATOM 12 H1 ARG A 1 -5.836 -1.612 10.906 1.00 5.27 H ATOM 13 H2 ARG A 1 -7.090 -1.136 11.865 1.00 6.35 H ATOM 14 H3 ARG A 1 -6.601 -0.186 10.610 1.00 5.35 H ATOM 15 HA ARG A 1 -5.864 0.743 12.656 1.00 5.01 H ATOM 16 HB2 ARG A 1 -5.149 -2.035 13.201 1.00 6.09 H ATOM 17 HB3 ARG A 1 -3.772 -0.963 13.471 1.00 5.34 H ATOM 18 HG2 ARG A 1 -4.810 0.255 15.134 1.00 6.87 H ATOM 19 HG3 ARG A 1 -6.449 -0.109 14.569 1.00 6.98 H ATOM 20 HD2 ARG A 1 -6.540 -2.164 15.574 1.00 8.50 H ATOM 21 HD3 ARG A 1 -4.790 -2.428 15.502 1.00 7.97 H ATOM 22 HE ARG A 1 -4.865 -0.424 17.256 1.00 8.93 H ATOM 23 HH11 ARG A 1 -6.899 -3.325 17.150 1.00 10.63 H ATOM 24 HH12 ARG A 1 -6.943 -3.536 18.860 1.00 12.22 H ATOM 25 HH21 ARG A 1 -4.881 -0.729 19.555 1.00 11.53 H ATOM 26 HH22 ARG A 1 -5.775 -2.027 20.245 1.00 12.69 H ATOM 27 N LYS A 2 -3.293 -0.338 10.869 1.00 2.00 N ATOM 28 CA LYS A 2 -2.243 0.133 9.975 1.00 0.74 C ATOM 29 C LYS A 2 -2.157 -0.866 8.831 1.00 0.97 C ATOM 30 O LYS A 2 -2.297 -2.059 9.094 1.00 2.56 O ATOM 31 CB LYS A 2 -0.915 0.262 10.742 1.00 1.97 C ATOM 32 CG LYS A 2 -0.295 -1.090 11.141 1.00 3.67 C ATOM 33 CD LYS A 2 0.878 -0.902 12.114 1.00 4.97 C ATOM 34 CE LYS A 2 0.402 -0.840 13.570 1.00 5.85 C ATOM 35 NZ LYS A 2 0.109 -2.188 14.111 1.00 7.33 N ATOM 36 H LYS A 2 -3.328 -1.345 10.965 1.00 3.20 H ATOM 37 HA LYS A 2 -2.512 1.116 9.577 1.00 1.32 H ATOM 38 HB2 LYS A 2 -0.201 0.794 10.111 1.00 2.49 H ATOM 39 HB3 LYS A 2 -1.085 0.863 11.636 1.00 3.09 H ATOM 40 HG2 LYS A 2 -1.047 -1.732 11.597 1.00 4.29 H ATOM 41 HG3 LYS A 2 0.082 -1.581 10.243 1.00 4.47 H ATOM 42 HD2 LYS A 2 1.582 -1.728 12.000 1.00 5.76 H ATOM 43 HD3 LYS A 2 1.404 0.022 11.866 1.00 5.28 H ATOM 44 HE2 LYS A 2 1.186 -0.379 14.175 1.00 6.59 H ATOM 45 HE3 LYS A 2 -0.488 -0.209 13.626 1.00 5.37 H ATOM 46 HZ1 LYS A 2 0.960 -2.733 14.149 1.00 8.22 H ATOM 47 HZ2 LYS A 2 -0.264 -2.113 15.048 1.00 7.82 H ATOM 48 HZ3 LYS A 2 -0.556 -2.668 13.522 1.00 7.47 H ATOM 49 N SER A 3 -1.980 -0.404 7.595 1.00 0.75 N ATOM 50 CA SER A 3 -1.748 -1.272 6.453 1.00 0.64 C ATOM 51 C SER A 3 -1.319 -0.387 5.298 1.00 0.55 C ATOM 52 O SER A 3 -1.947 0.638 5.051 1.00 0.62 O ATOM 53 CB SER A 3 -3.024 -2.039 6.078 1.00 0.70 C ATOM 54 OG SER A 3 -2.694 -3.383 5.804 1.00 1.59 O ATOM 55 H SER A 3 -1.921 0.590 7.407 1.00 2.00 H ATOM 56 HA SER A 3 -0.941 -1.972 6.682 1.00 0.66 H ATOM 57 HB2 SER A 3 -3.738 -2.011 6.901 1.00 1.44 H ATOM 58 HB3 SER A 3 -3.487 -1.588 5.198 1.00 1.41 H ATOM 59 HG SER A 3 -3.496 -3.853 5.559 1.00 1.93 H ATOM 60 N ILE A 4 -0.235 -0.761 4.628 1.00 0.46 N ATOM 61 CA ILE A 4 0.308 -0.007 3.525 1.00 0.40 C ATOM 62 C ILE A 4 -0.302 -0.557 2.234 1.00 0.33 C ATOM 63 O ILE A 4 -1.482 -0.893 2.169 1.00 0.38 O ATOM 64 CB ILE A 4 1.846 -0.084 3.570 1.00 0.42 C ATOM 65 CG1 ILE A 4 2.410 -0.077 4.996 1.00 0.52 C ATOM 66 CG2 ILE A 4 2.433 1.147 2.842 1.00 0.44 C ATOM 67 CD1 ILE A 4 2.741 -1.467 5.560 1.00 1.39 C ATOM 68 H ILE A 4 0.267 -1.593 4.883 1.00 0.48 H ATOM 69 HA ILE A 4 0.025 1.038 3.617 1.00 0.42 H ATOM 70 HB ILE A 4 2.187 -1.010 3.106 1.00 0.40 H ATOM 71 HG12 ILE A 4 3.342 0.460 4.956 1.00 1.07 H ATOM 72 HG13 ILE A 4 1.747 0.469 5.662 1.00 0.87 H ATOM 73 HG21 ILE A 4 1.915 1.370 1.911 1.00 1.44 H ATOM 74 HG22 ILE A 4 2.335 2.029 3.479 1.00 1.45 H ATOM 75 HG23 ILE A 4 3.489 0.982 2.627 1.00 1.41 H ATOM 76 HD11 ILE A 4 3.259 -1.349 6.512 1.00 2.15 H ATOM 77 HD12 ILE A 4 1.846 -2.059 5.728 1.00 2.09 H ATOM 78 HD13 ILE A 4 3.399 -1.998 4.870 1.00 2.50 H ATOM 79 N ASN A 5 0.523 -0.653 1.203 1.00 0.29 N ATOM 80 CA ASN A 5 0.215 -1.202 -0.093 1.00 0.23 C ATOM 81 C ASN A 5 1.023 -2.485 -0.261 1.00 0.21 C ATOM 82 O ASN A 5 1.995 -2.696 0.459 1.00 0.26 O ATOM 83 CB ASN A 5 0.518 -0.118 -1.122 1.00 0.25 C ATOM 84 CG ASN A 5 0.494 -0.657 -2.524 1.00 0.22 C ATOM 85 OD1 ASN A 5 -0.515 -0.617 -3.211 1.00 0.25 O ATOM 86 ND2 ASN A 5 1.620 -1.186 -2.940 1.00 0.21 N ATOM 87 H ASN A 5 1.493 -0.431 1.358 1.00 0.32 H ATOM 88 HA ASN A 5 -0.830 -1.459 -0.196 1.00 0.23 H ATOM 89 HB2 ASN A 5 -0.241 0.651 -1.054 1.00 0.29 H ATOM 90 HB3 ASN A 5 1.492 0.328 -0.924 1.00 0.29 H ATOM 91 HD21 ASN A 5 2.361 -1.379 -2.275 1.00 0.21 H ATOM 92 HD22 ASN A 5 1.731 -1.454 -3.897 1.00 0.22 H ATOM 93 N ILE A 6 0.599 -3.329 -1.204 1.00 0.18 N ATOM 94 CA ILE A 6 1.302 -4.523 -1.649 1.00 0.21 C ATOM 95 C ILE A 6 2.529 -4.047 -2.453 1.00 0.20 C ATOM 96 O ILE A 6 3.334 -3.262 -1.959 1.00 0.41 O ATOM 97 CB ILE A 6 0.308 -5.386 -2.465 1.00 0.24 C ATOM 98 CG1 ILE A 6 -0.990 -5.684 -1.684 1.00 0.32 C ATOM 99 CG2 ILE A 6 0.911 -6.726 -2.932 1.00 0.29 C ATOM 100 CD1 ILE A 6 -2.112 -6.120 -2.631 1.00 1.35 C ATOM 101 H ILE A 6 -0.211 -3.061 -1.742 1.00 0.20 H ATOM 102 HA ILE A 6 1.644 -5.083 -0.777 1.00 0.28 H ATOM 103 HB ILE A 6 0.030 -4.806 -3.348 1.00 0.21 H ATOM 104 HG12 ILE A 6 -0.807 -6.462 -0.942 1.00 0.94 H ATOM 105 HG13 ILE A 6 -1.343 -4.802 -1.156 1.00 1.04 H ATOM 106 HG21 ILE A 6 0.643 -6.900 -3.976 1.00 1.39 H ATOM 107 HG22 ILE A 6 1.994 -6.740 -2.826 1.00 1.45 H ATOM 108 HG23 ILE A 6 0.523 -7.554 -2.338 1.00 1.52 H ATOM 109 HD11 ILE A 6 -3.003 -6.356 -2.051 1.00 2.07 H ATOM 110 HD12 ILE A 6 -2.345 -5.304 -3.317 1.00 2.29 H ATOM 111 HD13 ILE A 6 -1.812 -6.998 -3.201 1.00 2.33 H ATOM 112 N GLY A 7 2.667 -4.459 -3.714 1.00 0.17 N ATOM 113 CA GLY A 7 3.776 -4.054 -4.561 1.00 0.18 C ATOM 114 C GLY A 7 3.317 -2.948 -5.503 1.00 0.15 C ATOM 115 O GLY A 7 3.436 -1.771 -5.169 1.00 0.17 O ATOM 116 H GLY A 7 1.967 -5.065 -4.113 1.00 0.32 H ATOM 117 HA2 GLY A 7 4.600 -3.679 -3.953 1.00 0.21 H ATOM 118 HA3 GLY A 7 4.137 -4.910 -5.130 1.00 0.22 H ATOM 119 N PRO A 8 2.767 -3.299 -6.672 1.00 0.18 N ATOM 120 CA PRO A 8 2.379 -2.334 -7.685 1.00 0.24 C ATOM 121 C PRO A 8 1.148 -1.548 -7.226 1.00 0.23 C ATOM 122 O PRO A 8 0.016 -1.926 -7.510 1.00 0.25 O ATOM 123 CB PRO A 8 2.120 -3.169 -8.943 1.00 0.30 C ATOM 124 CG PRO A 8 1.664 -4.517 -8.382 1.00 0.27 C ATOM 125 CD PRO A 8 2.494 -4.657 -7.107 1.00 0.20 C ATOM 126 HA PRO A 8 3.198 -1.639 -7.876 1.00 0.28 H ATOM 127 HB2 PRO A 8 1.371 -2.722 -9.597 1.00 0.35 H ATOM 128 HB3 PRO A 8 3.059 -3.306 -9.481 1.00 0.34 H ATOM 129 HG2 PRO A 8 0.604 -4.471 -8.127 1.00 0.27 H ATOM 130 HG3 PRO A 8 1.856 -5.333 -9.080 1.00 0.32 H ATOM 131 HD2 PRO A 8 1.934 -5.210 -6.354 1.00 0.20 H ATOM 132 HD3 PRO A 8 3.433 -5.163 -7.332 1.00 0.23 H ATOM 133 N GLY A 9 1.370 -0.443 -6.514 1.00 0.23 N ATOM 134 CA GLY A 9 0.311 0.412 -6.014 1.00 0.25 C ATOM 135 C GLY A 9 0.891 1.428 -5.039 1.00 0.29 C ATOM 136 O GLY A 9 2.104 1.649 -5.010 1.00 0.48 O ATOM 137 H GLY A 9 2.313 -0.217 -6.218 1.00 0.23 H ATOM 138 HA2 GLY A 9 -0.159 0.939 -6.843 1.00 0.32 H ATOM 139 HA3 GLY A 9 -0.444 -0.194 -5.511 1.00 0.22 H ATOM 140 N ARG A 10 0.023 2.058 -4.249 1.00 0.24 N ATOM 141 CA ARG A 10 0.386 2.957 -3.162 1.00 0.26 C ATOM 142 C ARG A 10 -0.805 3.015 -2.210 1.00 0.24 C ATOM 143 O ARG A 10 -1.904 2.610 -2.583 1.00 0.26 O ATOM 144 CB ARG A 10 0.731 4.348 -3.726 1.00 0.45 C ATOM 145 CG ARG A 10 2.138 4.829 -3.328 1.00 1.67 C ATOM 146 CD ARG A 10 2.923 5.308 -4.555 1.00 2.23 C ATOM 147 NE ARG A 10 3.442 4.171 -5.328 1.00 3.50 N ATOM 148 CZ ARG A 10 4.133 4.251 -6.470 1.00 4.39 C ATOM 149 NH1 ARG A 10 4.244 5.418 -7.105 1.00 4.44 N ATOM 150 NH2 ARG A 10 4.718 3.160 -6.967 1.00 5.88 N ATOM 151 H ARG A 10 -0.952 1.775 -4.270 1.00 0.32 H ATOM 152 HA ARG A 10 1.234 2.526 -2.630 1.00 0.27 H ATOM 153 HB2 ARG A 10 0.657 4.324 -4.815 1.00 1.67 H ATOM 154 HB3 ARG A 10 0.002 5.082 -3.378 1.00 1.46 H ATOM 155 HG2 ARG A 10 2.039 5.656 -2.624 1.00 2.73 H ATOM 156 HG3 ARG A 10 2.703 4.035 -2.839 1.00 2.95 H ATOM 157 HD2 ARG A 10 2.275 5.925 -5.179 1.00 2.54 H ATOM 158 HD3 ARG A 10 3.766 5.910 -4.215 1.00 2.78 H ATOM 159 HE ARG A 10 3.268 3.256 -4.927 1.00 4.25 H ATOM 160 HH11 ARG A 10 3.773 6.229 -6.733 1.00 3.98 H ATOM 161 HH12 ARG A 10 4.747 5.517 -7.973 1.00 5.40 H ATOM 162 HH21 ARG A 10 4.638 2.280 -6.477 1.00 6.54 H ATOM 163 HH22 ARG A 10 5.271 3.185 -7.810 1.00 6.61 H ATOM 164 N ALA A 11 -0.596 3.495 -0.986 1.00 0.26 N ATOM 165 CA ALA A 11 -1.639 3.583 0.019 1.00 0.26 C ATOM 166 C ALA A 11 -1.428 4.862 0.818 1.00 0.32 C ATOM 167 O ALA A 11 -0.369 5.480 0.712 1.00 0.75 O ATOM 168 CB ALA A 11 -1.570 2.357 0.935 1.00 0.31 C ATOM 169 H ALA A 11 0.290 3.899 -0.717 1.00 0.32 H ATOM 170 HA ALA A 11 -2.611 3.621 -0.474 1.00 0.25 H ATOM 171 HB1 ALA A 11 -1.852 1.465 0.378 1.00 1.65 H ATOM 172 HB2 ALA A 11 -0.554 2.250 1.316 1.00 1.64 H ATOM 173 HB3 ALA A 11 -2.255 2.473 1.774 1.00 1.47 H ATOM 174 N PHE A 12 -2.423 5.245 1.621 1.00 0.37 N ATOM 175 CA PHE A 12 -2.403 6.494 2.364 1.00 0.32 C ATOM 176 C PHE A 12 -2.962 6.236 3.764 1.00 1.06 C ATOM 177 O PHE A 12 -4.013 6.758 4.126 1.00 1.49 O ATOM 178 CB PHE A 12 -3.214 7.550 1.598 1.00 0.98 C ATOM 179 CG PHE A 12 -2.801 7.724 0.147 1.00 1.89 C ATOM 180 CD1 PHE A 12 -1.614 8.407 -0.174 1.00 1.93 C ATOM 181 CD2 PHE A 12 -3.591 7.179 -0.884 1.00 3.85 C ATOM 182 CE1 PHE A 12 -1.232 8.566 -1.518 1.00 2.72 C ATOM 183 CE2 PHE A 12 -3.206 7.332 -2.227 1.00 4.82 C ATOM 184 CZ PHE A 12 -2.030 8.032 -2.545 1.00 3.96 C ATOM 185 H PHE A 12 -3.257 4.683 1.699 1.00 0.72 H ATOM 186 HA PHE A 12 -1.374 6.842 2.455 1.00 0.64 H ATOM 187 HB2 PHE A 12 -4.270 7.277 1.626 1.00 1.58 H ATOM 188 HB3 PHE A 12 -3.112 8.510 2.108 1.00 0.74 H ATOM 189 HD1 PHE A 12 -0.989 8.801 0.614 1.00 2.64 H ATOM 190 HD2 PHE A 12 -4.495 6.640 -0.645 1.00 4.84 H ATOM 191 HE1 PHE A 12 -0.324 9.099 -1.761 1.00 3.21 H ATOM 192 HE2 PHE A 12 -3.819 6.918 -3.015 1.00 6.43 H ATOM 193 HZ PHE A 12 -1.740 8.159 -3.579 1.00 4.78 H ATOM 194 N TYR A 13 -2.265 5.395 4.528 1.00 1.65 N ATOM 195 CA TYR A 13 -2.633 4.959 5.869 1.00 2.49 C ATOM 196 C TYR A 13 -1.348 4.665 6.638 1.00 3.20 C ATOM 197 O TYR A 13 -1.460 4.382 7.849 1.00 3.26 O ATOM 198 CB TYR A 13 -3.469 3.676 5.799 1.00 2.98 C ATOM 199 CG TYR A 13 -4.786 3.787 5.062 1.00 2.41 C ATOM 200 CD1 TYR A 13 -5.861 4.476 5.652 1.00 3.01 C ATOM 201 CD2 TYR A 13 -4.945 3.182 3.802 1.00 2.62 C ATOM 202 CE1 TYR A 13 -7.097 4.557 4.988 1.00 3.46 C ATOM 203 CE2 TYR A 13 -6.175 3.266 3.125 1.00 2.56 C ATOM 204 CZ TYR A 13 -7.259 3.953 3.722 1.00 2.90 C ATOM 205 OH TYR A 13 -8.465 4.032 3.092 1.00 3.71 O ATOM 206 OXT TYR A 13 -0.283 4.680 5.978 1.00 4.57 O ATOM 207 H TYR A 13 -1.348 5.071 4.246 1.00 1.76 H ATOM 208 HA TYR A 13 -3.188 5.744 6.381 1.00 2.52 H ATOM 209 HB2 TYR A 13 -2.861 2.908 5.325 1.00 3.55 H ATOM 210 HB3 TYR A 13 -3.674 3.343 6.817 1.00 3.79 H ATOM 211 HD1 TYR A 13 -5.729 4.946 6.615 1.00 3.80 H ATOM 212 HD2 TYR A 13 -4.120 2.639 3.364 1.00 3.57 H ATOM 213 HE1 TYR A 13 -7.925 5.083 5.440 1.00 4.65 H ATOM 214 HE2 TYR A 13 -6.285 2.793 2.161 1.00 3.18 H ATOM 215 HH TYR A 13 -8.482 3.602 2.236 1.00 3.73 H TER 216 TYR A 13 ENDMDL MODEL 9 ATOM 1 N ARG A 1 -5.525 -2.512 11.695 1.00 5.40 N ATOM 2 CA ARG A 1 -4.153 -1.961 11.674 1.00 4.31 C ATOM 3 C ARG A 1 -4.025 -1.085 10.437 1.00 2.92 C ATOM 4 O ARG A 1 -4.820 -1.260 9.524 1.00 3.79 O ATOM 5 CB ARG A 1 -3.087 -3.071 11.663 1.00 5.43 C ATOM 6 CG ARG A 1 -2.804 -3.606 13.073 1.00 6.88 C ATOM 7 CD ARG A 1 -1.755 -4.725 13.024 1.00 8.27 C ATOM 8 NE ARG A 1 -1.338 -5.136 14.374 1.00 9.51 N ATOM 9 CZ ARG A 1 -0.726 -6.287 14.688 1.00 11.12 C ATOM 10 NH1 ARG A 1 -0.461 -7.192 13.745 1.00 11.78 N ATOM 11 NH2 ARG A 1 -0.376 -6.531 15.953 1.00 12.38 N ATOM 12 H1 ARG A 1 -5.686 -3.010 10.828 1.00 5.82 H ATOM 13 H2 ARG A 1 -5.659 -3.125 12.484 1.00 6.37 H ATOM 14 H3 ARG A 1 -6.189 -1.750 11.730 1.00 5.29 H ATOM 15 HA ARG A 1 -4.005 -1.333 12.552 1.00 4.51 H ATOM 16 HB2 ARG A 1 -3.412 -3.888 11.014 1.00 6.23 H ATOM 17 HB3 ARG A 1 -2.155 -2.671 11.264 1.00 5.13 H ATOM 18 HG2 ARG A 1 -2.428 -2.787 13.690 1.00 6.94 H ATOM 19 HG3 ARG A 1 -3.723 -3.993 13.516 1.00 7.44 H ATOM 20 HD2 ARG A 1 -2.183 -5.577 12.492 1.00 8.83 H ATOM 21 HD3 ARG A 1 -0.878 -4.372 12.480 1.00 8.27 H ATOM 22 HE ARG A 1 -1.510 -4.463 15.107 1.00 9.35 H ATOM 23 HH11 ARG A 1 -0.708 -7.011 12.785 1.00 11.23 H ATOM 24 HH12 ARG A 1 -0.009 -8.069 13.956 1.00 13.05 H ATOM 25 HH21 ARG A 1 -0.556 -5.864 16.688 1.00 12.29 H ATOM 26 HH22 ARG A 1 0.086 -7.389 16.217 1.00 13.64 H ATOM 27 N LYS A 2 -3.044 -0.174 10.423 1.00 1.71 N ATOM 28 CA LYS A 2 -2.785 0.779 9.344 1.00 0.98 C ATOM 29 C LYS A 2 -2.753 0.058 7.995 1.00 1.29 C ATOM 30 O LYS A 2 -3.646 0.233 7.178 1.00 3.13 O ATOM 31 CB LYS A 2 -1.480 1.527 9.692 1.00 1.75 C ATOM 32 CG LYS A 2 -1.141 2.758 8.842 1.00 3.35 C ATOM 33 CD LYS A 2 -0.826 2.440 7.380 1.00 5.07 C ATOM 34 CE LYS A 2 0.039 3.539 6.762 1.00 6.78 C ATOM 35 NZ LYS A 2 1.484 3.291 6.931 1.00 7.77 N ATOM 36 H LYS A 2 -2.443 -0.098 11.229 1.00 2.60 H ATOM 37 HA LYS A 2 -3.603 1.503 9.308 1.00 1.98 H ATOM 38 HB2 LYS A 2 -1.568 1.881 10.720 1.00 2.21 H ATOM 39 HB3 LYS A 2 -0.637 0.836 9.662 1.00 2.48 H ATOM 40 HG2 LYS A 2 -1.967 3.467 8.887 1.00 3.92 H ATOM 41 HG3 LYS A 2 -0.267 3.233 9.288 1.00 3.84 H ATOM 42 HD2 LYS A 2 -0.310 1.486 7.299 1.00 5.32 H ATOM 43 HD3 LYS A 2 -1.769 2.398 6.832 1.00 5.66 H ATOM 44 HE2 LYS A 2 -0.204 3.617 5.700 1.00 7.54 H ATOM 45 HE3 LYS A 2 -0.224 4.490 7.230 1.00 7.05 H ATOM 46 HZ1 LYS A 2 1.749 2.457 6.428 1.00 8.34 H ATOM 47 HZ2 LYS A 2 2.000 4.079 6.563 1.00 8.86 H ATOM 48 HZ3 LYS A 2 1.700 3.186 7.912 1.00 7.29 H ATOM 49 N SER A 3 -1.738 -0.789 7.806 1.00 0.69 N ATOM 50 CA SER A 3 -1.489 -1.533 6.581 1.00 0.65 C ATOM 51 C SER A 3 -1.027 -0.617 5.446 1.00 0.62 C ATOM 52 O SER A 3 -1.521 0.490 5.260 1.00 0.78 O ATOM 53 CB SER A 3 -2.709 -2.377 6.199 1.00 0.72 C ATOM 54 OG SER A 3 -2.248 -3.619 5.711 1.00 1.87 O ATOM 55 H SER A 3 -1.061 -0.889 8.542 1.00 2.09 H ATOM 56 HA SER A 3 -0.673 -2.223 6.795 1.00 0.68 H ATOM 57 HB2 SER A 3 -3.321 -2.564 7.083 1.00 1.52 H ATOM 58 HB3 SER A 3 -3.310 -1.863 5.447 1.00 1.19 H ATOM 59 HG SER A 3 -2.996 -4.218 5.633 1.00 2.13 H ATOM 60 N ILE A 4 0.004 -1.050 4.726 1.00 0.50 N ATOM 61 CA ILE A 4 0.588 -0.288 3.644 1.00 0.49 C ATOM 62 C ILE A 4 -0.082 -0.730 2.344 1.00 0.40 C ATOM 63 O ILE A 4 -1.287 -0.958 2.283 1.00 0.44 O ATOM 64 CB ILE A 4 2.122 -0.471 3.660 1.00 0.53 C ATOM 65 CG1 ILE A 4 2.677 -0.539 5.087 1.00 0.63 C ATOM 66 CG2 ILE A 4 2.794 0.729 2.959 1.00 0.60 C ATOM 67 CD1 ILE A 4 2.915 -1.963 5.607 1.00 1.60 C ATOM 68 H ILE A 4 0.431 -1.937 4.923 1.00 0.47 H ATOM 69 HA ILE A 4 0.375 0.769 3.777 1.00 0.56 H ATOM 70 HB ILE A 4 2.398 -1.405 3.167 1.00 0.47 H ATOM 71 HG12 ILE A 4 3.637 -0.054 5.082 1.00 1.03 H ATOM 72 HG13 ILE A 4 2.032 0.018 5.762 1.00 0.82 H ATOM 73 HG21 ILE A 4 2.268 1.033 2.055 1.00 1.36 H ATOM 74 HG22 ILE A 4 2.808 1.591 3.627 1.00 1.27 H ATOM 75 HG23 ILE A 4 3.822 0.471 2.697 1.00 1.77 H ATOM 76 HD11 ILE A 4 3.812 -2.371 5.139 1.00 2.50 H ATOM 77 HD12 ILE A 4 3.066 -1.933 6.686 1.00 2.10 H ATOM 78 HD13 ILE A 4 2.081 -2.624 5.383 1.00 2.13 H ATOM 79 N ASN A 5 0.719 -0.845 1.299 1.00 0.34 N ATOM 80 CA ASN A 5 0.349 -1.303 -0.017 1.00 0.26 C ATOM 81 C ASN A 5 1.079 -2.618 -0.264 1.00 0.19 C ATOM 82 O ASN A 5 2.067 -2.896 0.410 1.00 0.26 O ATOM 83 CB ASN A 5 0.692 -0.188 -0.996 1.00 0.30 C ATOM 84 CG ASN A 5 0.627 -0.669 -2.418 1.00 0.26 C ATOM 85 OD1 ASN A 5 -0.381 -0.532 -3.094 1.00 0.31 O ATOM 86 ND2 ASN A 5 1.712 -1.265 -2.858 1.00 0.23 N ATOM 87 H ASN A 5 1.707 -0.721 1.453 1.00 0.39 H ATOM 88 HA ASN A 5 -0.711 -1.496 -0.106 1.00 0.28 H ATOM 89 HB2 ASN A 5 -0.025 0.617 -0.880 1.00 0.35 H ATOM 90 HB3 ASN A 5 1.693 0.198 -0.795 1.00 0.33 H ATOM 91 HD21 ASN A 5 2.457 -1.494 -2.216 1.00 0.25 H ATOM 92 HD22 ASN A 5 1.822 -1.430 -3.841 1.00 0.25 H ATOM 93 N ILE A 6 0.577 -3.407 -1.216 1.00 0.14 N ATOM 94 CA ILE A 6 1.195 -4.631 -1.699 1.00 0.18 C ATOM 95 C ILE A 6 2.465 -4.241 -2.476 1.00 0.21 C ATOM 96 O ILE A 6 3.421 -3.734 -1.898 1.00 0.42 O ATOM 97 CB ILE A 6 0.145 -5.420 -2.520 1.00 0.25 C ATOM 98 CG1 ILE A 6 -1.113 -5.721 -1.679 1.00 0.32 C ATOM 99 CG2 ILE A 6 0.717 -6.751 -3.046 1.00 0.33 C ATOM 100 CD1 ILE A 6 -2.335 -5.972 -2.570 1.00 1.39 C ATOM 101 H ILE A 6 -0.246 -3.097 -1.712 1.00 0.17 H ATOM 102 HA ILE A 6 1.499 -5.232 -0.844 1.00 0.23 H ATOM 103 HB ILE A 6 -0.169 -4.808 -3.367 1.00 0.27 H ATOM 104 HG12 ILE A 6 -0.927 -6.585 -1.044 1.00 0.92 H ATOM 105 HG13 ILE A 6 -1.360 -4.881 -1.033 1.00 1.04 H ATOM 106 HG21 ILE A 6 1.139 -6.628 -4.042 1.00 1.33 H ATOM 107 HG22 ILE A 6 1.486 -7.121 -2.367 1.00 1.25 H ATOM 108 HG23 ILE A 6 -0.065 -7.504 -3.119 1.00 1.46 H ATOM 109 HD11 ILE A 6 -2.543 -5.083 -3.166 1.00 2.30 H ATOM 110 HD12 ILE A 6 -2.166 -6.817 -3.237 1.00 2.03 H ATOM 111 HD13 ILE A 6 -3.202 -6.184 -1.943 1.00 2.36 H ATOM 112 N GLY A 7 2.478 -4.420 -3.795 1.00 0.24 N ATOM 113 CA GLY A 7 3.614 -4.087 -4.636 1.00 0.27 C ATOM 114 C GLY A 7 3.221 -2.936 -5.548 1.00 0.21 C ATOM 115 O GLY A 7 3.388 -1.779 -5.173 1.00 0.19 O ATOM 116 H GLY A 7 1.647 -4.772 -4.237 1.00 0.41 H ATOM 117 HA2 GLY A 7 4.465 -3.777 -4.029 1.00 0.30 H ATOM 118 HA3 GLY A 7 3.911 -4.956 -5.221 1.00 0.35 H ATOM 119 N PRO A 8 2.657 -3.224 -6.726 1.00 0.23 N ATOM 120 CA PRO A 8 2.283 -2.203 -7.688 1.00 0.24 C ATOM 121 C PRO A 8 1.078 -1.406 -7.180 1.00 0.21 C ATOM 122 O PRO A 8 -0.067 -1.757 -7.449 1.00 0.26 O ATOM 123 CB PRO A 8 1.990 -2.975 -8.979 1.00 0.32 C ATOM 124 CG PRO A 8 1.509 -4.337 -8.476 1.00 0.33 C ATOM 125 CD PRO A 8 2.349 -4.554 -7.218 1.00 0.28 C ATOM 126 HA PRO A 8 3.118 -1.522 -7.857 1.00 0.26 H ATOM 127 HB2 PRO A 8 1.244 -2.482 -9.603 1.00 0.36 H ATOM 128 HB3 PRO A 8 2.919 -3.108 -9.534 1.00 0.35 H ATOM 129 HG2 PRO A 8 0.453 -4.281 -8.206 1.00 0.33 H ATOM 130 HG3 PRO A 8 1.676 -5.125 -9.212 1.00 0.39 H ATOM 131 HD2 PRO A 8 1.785 -5.130 -6.483 1.00 0.28 H ATOM 132 HD3 PRO A 8 3.275 -5.069 -7.477 1.00 0.32 H ATOM 133 N GLY A 9 1.337 -0.326 -6.442 1.00 0.19 N ATOM 134 CA GLY A 9 0.310 0.539 -5.888 1.00 0.19 C ATOM 135 C GLY A 9 0.935 1.465 -4.844 1.00 0.17 C ATOM 136 O GLY A 9 2.150 1.448 -4.657 1.00 0.26 O ATOM 137 H GLY A 9 2.289 -0.132 -6.152 1.00 0.19 H ATOM 138 HA2 GLY A 9 -0.137 1.132 -6.685 1.00 0.24 H ATOM 139 HA3 GLY A 9 -0.461 -0.078 -5.424 1.00 0.20 H ATOM 140 N ARG A 10 0.119 2.257 -4.144 1.00 0.20 N ATOM 141 CA ARG A 10 0.502 2.944 -2.915 1.00 0.21 C ATOM 142 C ARG A 10 -0.732 3.039 -2.024 1.00 0.16 C ATOM 143 O ARG A 10 -1.844 2.804 -2.489 1.00 0.23 O ATOM 144 CB ARG A 10 1.085 4.340 -3.194 1.00 0.49 C ATOM 145 CG ARG A 10 2.558 4.249 -3.617 1.00 1.89 C ATOM 146 CD ARG A 10 3.378 5.411 -3.048 1.00 2.61 C ATOM 147 NE ARG A 10 3.053 6.708 -3.661 1.00 2.90 N ATOM 148 CZ ARG A 10 3.573 7.172 -4.805 1.00 3.43 C ATOM 149 NH1 ARG A 10 4.356 6.392 -5.549 1.00 3.71 N ATOM 150 NH2 ARG A 10 3.313 8.420 -5.198 1.00 4.70 N ATOM 151 H ARG A 10 -0.880 2.191 -4.294 1.00 0.30 H ATOM 152 HA ARG A 10 1.241 2.336 -2.392 1.00 0.28 H ATOM 153 HB2 ARG A 10 0.501 4.849 -3.963 1.00 1.12 H ATOM 154 HB3 ARG A 10 1.026 4.930 -2.280 1.00 1.34 H ATOM 155 HG2 ARG A 10 2.994 3.336 -3.213 1.00 2.77 H ATOM 156 HG3 ARG A 10 2.632 4.217 -4.705 1.00 2.63 H ATOM 157 HD2 ARG A 10 3.194 5.469 -1.975 1.00 3.61 H ATOM 158 HD3 ARG A 10 4.438 5.197 -3.186 1.00 3.34 H ATOM 159 HE ARG A 10 2.454 7.304 -3.108 1.00 3.70 H ATOM 160 HH11 ARG A 10 4.531 5.441 -5.260 1.00 3.76 H ATOM 161 HH12 ARG A 10 4.775 6.707 -6.411 1.00 4.56 H ATOM 162 HH21 ARG A 10 2.733 9.034 -4.645 1.00 5.42 H ATOM 163 HH22 ARG A 10 3.702 8.795 -6.051 1.00 5.36 H ATOM 164 N ALA A 11 -0.535 3.382 -0.751 1.00 0.22 N ATOM 165 CA ALA A 11 -1.604 3.490 0.221 1.00 0.23 C ATOM 166 C ALA A 11 -1.350 4.719 1.076 1.00 0.30 C ATOM 167 O ALA A 11 -0.196 5.034 1.362 1.00 0.61 O ATOM 168 CB ALA A 11 -1.622 2.244 1.108 1.00 0.30 C ATOM 169 H ALA A 11 0.382 3.638 -0.412 1.00 0.31 H ATOM 170 HA ALA A 11 -2.565 3.587 -0.289 1.00 0.22 H ATOM 171 HB1 ALA A 11 -0.650 2.122 1.586 1.00 1.35 H ATOM 172 HB2 ALA A 11 -2.382 2.355 1.881 1.00 1.35 H ATOM 173 HB3 ALA A 11 -1.852 1.362 0.510 1.00 1.38 H ATOM 174 N PHE A 12 -2.425 5.376 1.507 1.00 0.31 N ATOM 175 CA PHE A 12 -2.380 6.478 2.449 1.00 0.35 C ATOM 176 C PHE A 12 -3.566 6.301 3.391 1.00 0.83 C ATOM 177 O PHE A 12 -4.643 6.845 3.169 1.00 1.18 O ATOM 178 CB PHE A 12 -2.408 7.819 1.712 1.00 0.68 C ATOM 179 CG PHE A 12 -1.097 8.165 1.030 1.00 1.36 C ATOM 180 CD1 PHE A 12 -0.086 8.825 1.753 1.00 2.70 C ATOM 181 CD2 PHE A 12 -0.881 7.825 -0.319 1.00 1.82 C ATOM 182 CE1 PHE A 12 1.127 9.161 1.128 1.00 3.39 C ATOM 183 CE2 PHE A 12 0.330 8.167 -0.947 1.00 2.37 C ATOM 184 CZ PHE A 12 1.334 8.838 -0.225 1.00 2.89 C ATOM 185 H PHE A 12 -3.348 5.053 1.251 1.00 0.54 H ATOM 186 HA PHE A 12 -1.460 6.426 3.032 1.00 0.61 H ATOM 187 HB2 PHE A 12 -3.214 7.803 0.979 1.00 1.05 H ATOM 188 HB3 PHE A 12 -2.635 8.608 2.430 1.00 0.63 H ATOM 189 HD1 PHE A 12 -0.243 9.076 2.791 1.00 3.49 H ATOM 190 HD2 PHE A 12 -1.646 7.297 -0.868 1.00 2.52 H ATOM 191 HE1 PHE A 12 1.896 9.672 1.688 1.00 4.57 H ATOM 192 HE2 PHE A 12 0.477 7.920 -1.986 1.00 3.03 H ATOM 193 HZ PHE A 12 2.265 9.110 -0.699 1.00 3.51 H ATOM 194 N TYR A 13 -3.332 5.499 4.423 1.00 1.25 N ATOM 195 CA TYR A 13 -4.183 5.259 5.576 1.00 1.79 C ATOM 196 C TYR A 13 -3.256 5.215 6.787 1.00 2.26 C ATOM 197 O TYR A 13 -2.024 5.223 6.550 1.00 2.59 O ATOM 198 CB TYR A 13 -4.932 3.925 5.431 1.00 2.40 C ATOM 199 CG TYR A 13 -6.147 3.961 4.527 1.00 2.08 C ATOM 200 CD1 TYR A 13 -7.311 4.620 4.965 1.00 3.07 C ATOM 201 CD2 TYR A 13 -6.144 3.293 3.289 1.00 2.67 C ATOM 202 CE1 TYR A 13 -8.474 4.606 4.175 1.00 3.52 C ATOM 203 CE2 TYR A 13 -7.304 3.274 2.490 1.00 3.02 C ATOM 204 CZ TYR A 13 -8.476 3.929 2.935 1.00 3.05 C ATOM 205 OH TYR A 13 -9.617 3.904 2.190 1.00 3.92 O ATOM 206 OXT TYR A 13 -3.776 5.147 7.918 1.00 2.95 O ATOM 207 H TYR A 13 -2.391 5.157 4.560 1.00 1.36 H ATOM 208 HA TYR A 13 -4.892 6.077 5.704 1.00 1.72 H ATOM 209 HB2 TYR A 13 -4.235 3.158 5.090 1.00 2.95 H ATOM 210 HB3 TYR A 13 -5.276 3.618 6.420 1.00 3.22 H ATOM 211 HD1 TYR A 13 -7.310 5.128 5.918 1.00 4.16 H ATOM 212 HD2 TYR A 13 -5.255 2.776 2.959 1.00 3.75 H ATOM 213 HE1 TYR A 13 -9.370 5.103 4.515 1.00 4.83 H ATOM 214 HE2 TYR A 13 -7.291 2.749 1.548 1.00 4.11 H ATOM 215 HH TYR A 13 -9.536 3.402 1.378 1.00 3.97 H TER 216 TYR A 13 ENDMDL MODEL 10 ATOM 1 N ARG A 1 -0.878 -0.859 14.507 1.00 5.32 N ATOM 2 CA ARG A 1 -0.403 -1.204 13.151 1.00 4.87 C ATOM 3 C ARG A 1 -1.427 -0.658 12.168 1.00 3.00 C ATOM 4 O ARG A 1 -2.536 -0.358 12.596 1.00 2.90 O ATOM 5 CB ARG A 1 -0.232 -2.726 12.990 1.00 6.09 C ATOM 6 CG ARG A 1 1.098 -3.098 12.322 1.00 7.79 C ATOM 7 CD ARG A 1 1.155 -4.619 12.114 1.00 9.18 C ATOM 8 NE ARG A 1 2.534 -5.131 12.091 1.00 10.94 N ATOM 9 CZ ARG A 1 2.860 -6.431 12.149 1.00 12.52 C ATOM 10 NH1 ARG A 1 1.907 -7.362 12.096 1.00 12.68 N ATOM 11 NH2 ARG A 1 4.136 -6.799 12.266 1.00 14.22 N ATOM 12 H1 ARG A 1 -1.794 -1.267 14.640 1.00 5.13 H ATOM 13 H2 ARG A 1 -0.237 -1.194 15.212 1.00 6.54 H ATOM 14 H3 ARG A 1 -0.982 0.144 14.577 1.00 5.07 H ATOM 15 HA ARG A 1 0.555 -0.712 12.978 1.00 5.60 H ATOM 16 HB2 ARG A 1 -0.253 -3.197 13.975 1.00 6.77 H ATOM 17 HB3 ARG A 1 -1.059 -3.136 12.407 1.00 5.81 H ATOM 18 HG2 ARG A 1 1.193 -2.596 11.358 1.00 7.73 H ATOM 19 HG3 ARG A 1 1.915 -2.783 12.972 1.00 8.66 H ATOM 20 HD2 ARG A 1 0.626 -5.103 12.935 1.00 9.40 H ATOM 21 HD3 ARG A 1 0.653 -4.871 11.178 1.00 9.12 H ATOM 22 HE ARG A 1 3.268 -4.438 12.079 1.00 11.18 H ATOM 23 HH11 ARG A 1 0.943 -7.090 11.976 1.00 11.79 H ATOM 24 HH12 ARG A 1 2.112 -8.348 12.143 1.00 13.92 H ATOM 25 HH21 ARG A 1 4.878 -6.118 12.322 1.00 14.53 H ATOM 26 HH22 ARG A 1 4.401 -7.772 12.320 1.00 15.43 H ATOM 27 N LYS A 2 -1.089 -0.519 10.886 1.00 2.26 N ATOM 28 CA LYS A 2 -2.050 -0.102 9.874 1.00 0.80 C ATOM 29 C LYS A 2 -1.672 -0.805 8.571 1.00 0.83 C ATOM 30 O LYS A 2 -0.629 -1.457 8.529 1.00 2.15 O ATOM 31 CB LYS A 2 -2.050 1.431 9.770 1.00 1.67 C ATOM 32 CG LYS A 2 -3.425 1.949 9.335 1.00 3.18 C ATOM 33 CD LYS A 2 -3.468 3.473 9.345 1.00 4.75 C ATOM 34 CE LYS A 2 -3.575 4.097 10.737 1.00 5.48 C ATOM 35 NZ LYS A 2 -3.883 5.538 10.611 1.00 7.18 N ATOM 36 H LYS A 2 -0.188 -0.808 10.526 1.00 3.31 H ATOM 37 HA LYS A 2 -3.042 -0.440 10.181 1.00 1.88 H ATOM 38 HB2 LYS A 2 -1.824 1.860 10.747 1.00 2.21 H ATOM 39 HB3 LYS A 2 -1.284 1.758 9.065 1.00 2.64 H ATOM 40 HG2 LYS A 2 -3.629 1.620 8.318 1.00 3.88 H ATOM 41 HG3 LYS A 2 -4.200 1.561 9.997 1.00 3.69 H ATOM 42 HD2 LYS A 2 -2.565 3.838 8.859 1.00 5.12 H ATOM 43 HD3 LYS A 2 -4.338 3.787 8.771 1.00 5.83 H ATOM 44 HE2 LYS A 2 -4.366 3.597 11.300 1.00 5.82 H ATOM 45 HE3 LYS A 2 -2.626 3.965 11.260 1.00 5.13 H ATOM 46 HZ1 LYS A 2 -4.823 5.666 10.267 1.00 8.00 H ATOM 47 HZ2 LYS A 2 -3.767 6.020 11.490 1.00 7.61 H ATOM 48 HZ3 LYS A 2 -3.274 5.953 9.908 1.00 7.49 H ATOM 49 N SER A 3 -2.509 -0.720 7.537 1.00 0.67 N ATOM 50 CA SER A 3 -2.267 -1.411 6.282 1.00 0.68 C ATOM 51 C SER A 3 -1.761 -0.423 5.245 1.00 0.60 C ATOM 52 O SER A 3 -2.360 0.631 5.037 1.00 0.68 O ATOM 53 CB SER A 3 -3.554 -2.082 5.811 1.00 0.81 C ATOM 54 OG SER A 3 -3.914 -3.078 6.746 1.00 1.75 O ATOM 55 H SER A 3 -3.307 -0.105 7.560 1.00 1.72 H ATOM 56 HA SER A 3 -1.507 -2.182 6.426 1.00 0.71 H ATOM 57 HB2 SER A 3 -4.352 -1.342 5.731 1.00 1.83 H ATOM 58 HB3 SER A 3 -3.391 -2.541 4.835 1.00 1.21 H ATOM 59 HG SER A 3 -4.041 -2.670 7.605 1.00 2.67 H ATOM 60 N ILE A 4 -0.638 -0.776 4.626 1.00 0.51 N ATOM 61 CA ILE A 4 0.004 -0.024 3.573 1.00 0.41 C ATOM 62 C ILE A 4 -0.543 -0.542 2.242 1.00 0.37 C ATOM 63 O ILE A 4 -1.730 -0.818 2.099 1.00 0.46 O ATOM 64 CB ILE A 4 1.539 -0.150 3.718 1.00 0.41 C ATOM 65 CG1 ILE A 4 1.990 -0.198 5.183 1.00 0.50 C ATOM 66 CG2 ILE A 4 2.221 1.069 3.067 1.00 0.39 C ATOM 67 CD1 ILE A 4 2.284 -1.615 5.696 1.00 1.34 C ATOM 68 H ILE A 4 -0.173 -1.628 4.889 1.00 0.53 H ATOM 69 HA ILE A 4 -0.260 1.026 3.658 1.00 0.43 H ATOM 70 HB ILE A 4 1.899 -1.072 3.256 1.00 0.40 H ATOM 71 HG12 ILE A 4 2.913 0.350 5.250 1.00 0.92 H ATOM 72 HG13 ILE A 4 1.267 0.307 5.819 1.00 1.07 H ATOM 73 HG21 ILE A 4 2.031 1.959 3.670 1.00 1.46 H ATOM 74 HG22 ILE A 4 3.298 0.904 3.013 1.00 1.29 H ATOM 75 HG23 ILE A 4 1.848 1.265 2.063 1.00 1.39 H ATOM 76 HD11 ILE A 4 2.583 -1.562 6.743 1.00 2.12 H ATOM 77 HD12 ILE A 4 1.415 -2.263 5.612 1.00 2.35 H ATOM 78 HD13 ILE A 4 3.103 -2.048 5.120 1.00 2.27 H ATOM 79 N ASN A 5 0.344 -0.679 1.270 1.00 0.27 N ATOM 80 CA ASN A 5 0.096 -1.199 -0.053 1.00 0.22 C ATOM 81 C ASN A 5 0.853 -2.517 -0.197 1.00 0.22 C ATOM 82 O ASN A 5 1.767 -2.783 0.578 1.00 0.29 O ATOM 83 CB ASN A 5 0.510 -0.111 -1.037 1.00 0.23 C ATOM 84 CG ASN A 5 0.552 -0.626 -2.448 1.00 0.23 C ATOM 85 OD1 ASN A 5 -0.404 -0.515 -3.198 1.00 0.32 O ATOM 86 ND2 ASN A 5 1.673 -1.215 -2.794 1.00 0.23 N ATOM 87 H ASN A 5 1.308 -0.493 1.490 1.00 0.28 H ATOM 88 HA ASN A 5 -0.951 -1.405 -0.226 1.00 0.27 H ATOM 89 HB2 ASN A 5 -0.213 0.695 -0.998 1.00 0.29 H ATOM 90 HB3 ASN A 5 1.492 0.282 -0.773 1.00 0.26 H ATOM 91 HD21 ASN A 5 2.362 -1.454 -2.092 1.00 0.25 H ATOM 92 HD22 ASN A 5 1.871 -1.382 -3.763 1.00 0.31 H ATOM 93 N ILE A 6 0.454 -3.326 -1.182 1.00 0.21 N ATOM 94 CA ILE A 6 1.133 -4.541 -1.613 1.00 0.24 C ATOM 95 C ILE A 6 2.429 -4.103 -2.324 1.00 0.23 C ATOM 96 O ILE A 6 3.256 -3.408 -1.740 1.00 0.38 O ATOM 97 CB ILE A 6 0.161 -5.346 -2.514 1.00 0.28 C ATOM 98 CG1 ILE A 6 -1.205 -5.593 -1.838 1.00 0.42 C ATOM 99 CG2 ILE A 6 0.725 -6.715 -2.945 1.00 0.36 C ATOM 100 CD1 ILE A 6 -2.278 -5.959 -2.869 1.00 1.49 C ATOM 101 H ILE A 6 -0.301 -3.009 -1.772 1.00 0.23 H ATOM 102 HA ILE A 6 1.394 -5.134 -0.736 1.00 0.32 H ATOM 103 HB ILE A 6 -0.022 -4.747 -3.409 1.00 0.23 H ATOM 104 HG12 ILE A 6 -1.117 -6.390 -1.101 1.00 0.88 H ATOM 105 HG13 ILE A 6 -1.554 -4.702 -1.319 1.00 1.10 H ATOM 106 HG21 ILE A 6 1.810 -6.711 -3.021 1.00 1.24 H ATOM 107 HG22 ILE A 6 0.462 -7.482 -2.218 1.00 1.49 H ATOM 108 HG23 ILE A 6 0.307 -6.988 -3.914 1.00 1.40 H ATOM 109 HD11 ILE A 6 -1.984 -6.843 -3.432 1.00 2.31 H ATOM 110 HD12 ILE A 6 -3.218 -6.161 -2.355 1.00 2.11 H ATOM 111 HD13 ILE A 6 -2.425 -5.124 -3.555 1.00 2.57 H ATOM 112 N GLY A 7 2.605 -4.442 -3.604 1.00 0.21 N ATOM 113 CA GLY A 7 3.780 -4.069 -4.374 1.00 0.24 C ATOM 114 C GLY A 7 3.408 -2.947 -5.333 1.00 0.19 C ATOM 115 O GLY A 7 3.519 -1.778 -4.973 1.00 0.20 O ATOM 116 H GLY A 7 1.887 -4.966 -4.077 1.00 0.30 H ATOM 117 HA2 GLY A 7 4.574 -3.720 -3.714 1.00 0.28 H ATOM 118 HA3 GLY A 7 4.150 -4.934 -4.924 1.00 0.29 H ATOM 119 N PRO A 8 2.937 -3.273 -6.543 1.00 0.22 N ATOM 120 CA PRO A 8 2.618 -2.284 -7.558 1.00 0.29 C ATOM 121 C PRO A 8 1.358 -1.502 -7.169 1.00 0.26 C ATOM 122 O PRO A 8 0.247 -1.880 -7.528 1.00 0.31 O ATOM 123 CB PRO A 8 2.448 -3.092 -8.848 1.00 0.38 C ATOM 124 CG PRO A 8 1.954 -4.451 -8.350 1.00 0.33 C ATOM 125 CD PRO A 8 2.702 -4.620 -7.028 1.00 0.26 C ATOM 126 HA PRO A 8 3.449 -1.587 -7.677 1.00 0.33 H ATOM 127 HB2 PRO A 8 1.748 -2.630 -9.545 1.00 0.44 H ATOM 128 HB3 PRO A 8 3.423 -3.219 -9.321 1.00 0.44 H ATOM 129 HG2 PRO A 8 0.881 -4.408 -8.160 1.00 0.33 H ATOM 130 HG3 PRO A 8 2.190 -5.252 -9.052 1.00 0.38 H ATOM 131 HD2 PRO A 8 2.100 -5.197 -6.325 1.00 0.24 H ATOM 132 HD3 PRO A 8 3.657 -5.114 -7.206 1.00 0.30 H ATOM 133 N GLY A 9 1.533 -0.404 -6.433 1.00 0.23 N ATOM 134 CA GLY A 9 0.456 0.456 -5.970 1.00 0.25 C ATOM 135 C GLY A 9 0.997 1.401 -4.902 1.00 0.22 C ATOM 136 O GLY A 9 2.179 1.330 -4.568 1.00 0.33 O ATOM 137 H GLY A 9 2.458 -0.191 -6.073 1.00 0.21 H ATOM 138 HA2 GLY A 9 0.060 1.036 -6.802 1.00 0.34 H ATOM 139 HA3 GLY A 9 -0.343 -0.154 -5.545 1.00 0.25 H ATOM 140 N ARG A 10 0.145 2.258 -4.334 1.00 0.32 N ATOM 141 CA ARG A 10 0.444 3.012 -3.119 1.00 0.24 C ATOM 142 C ARG A 10 -0.828 3.086 -2.283 1.00 0.30 C ATOM 143 O ARG A 10 -1.913 2.803 -2.784 1.00 0.42 O ATOM 144 CB ARG A 10 0.976 4.421 -3.429 1.00 0.38 C ATOM 145 CG ARG A 10 2.376 4.381 -4.058 1.00 1.73 C ATOM 146 CD ARG A 10 3.274 5.549 -3.623 1.00 2.37 C ATOM 147 NE ARG A 10 4.471 5.050 -2.922 1.00 3.82 N ATOM 148 CZ ARG A 10 4.501 4.542 -1.682 1.00 5.10 C ATOM 149 NH1 ARG A 10 3.437 4.645 -0.884 1.00 5.56 N ATOM 150 NH2 ARG A 10 5.597 3.922 -1.244 1.00 6.69 N ATOM 151 H ARG A 10 -0.837 2.211 -4.581 1.00 0.49 H ATOM 152 HA ARG A 10 1.189 2.461 -2.543 1.00 0.24 H ATOM 153 HB2 ARG A 10 0.287 4.944 -4.094 1.00 1.19 H ATOM 154 HB3 ARG A 10 1.022 4.977 -2.493 1.00 1.23 H ATOM 155 HG2 ARG A 10 2.872 3.459 -3.762 1.00 2.55 H ATOM 156 HG3 ARG A 10 2.280 4.376 -5.146 1.00 2.59 H ATOM 157 HD2 ARG A 10 3.596 6.091 -4.515 1.00 3.03 H ATOM 158 HD3 ARG A 10 2.728 6.249 -2.991 1.00 2.30 H ATOM 159 HE ARG A 10 5.303 5.001 -3.494 1.00 4.58 H ATOM 160 HH11 ARG A 10 2.638 5.179 -1.185 1.00 4.76 H ATOM 161 HH12 ARG A 10 3.431 4.281 0.058 1.00 7.10 H ATOM 162 HH21 ARG A 10 6.406 3.813 -1.839 1.00 6.96 H ATOM 163 HH22 ARG A 10 5.645 3.516 -0.321 1.00 7.96 H ATOM 164 N ALA A 11 -0.686 3.468 -1.015 1.00 0.30 N ATOM 165 CA ALA A 11 -1.779 3.611 -0.071 1.00 0.35 C ATOM 166 C ALA A 11 -1.515 4.855 0.772 1.00 0.36 C ATOM 167 O ALA A 11 -0.389 5.359 0.766 1.00 0.69 O ATOM 168 CB ALA A 11 -1.849 2.370 0.820 1.00 0.44 C ATOM 169 H ALA A 11 0.209 3.775 -0.666 1.00 0.30 H ATOM 170 HA ALA A 11 -2.712 3.732 -0.619 1.00 0.39 H ATOM 171 HB1 ALA A 11 -0.888 2.221 1.312 1.00 1.21 H ATOM 172 HB2 ALA A 11 -2.616 2.505 1.582 1.00 1.44 H ATOM 173 HB3 ALA A 11 -2.095 1.495 0.219 1.00 1.54 H ATOM 174 N PHE A 12 -2.532 5.336 1.492 1.00 0.33 N ATOM 175 CA PHE A 12 -2.464 6.606 2.200 1.00 0.32 C ATOM 176 C PHE A 12 -3.261 6.518 3.503 1.00 0.78 C ATOM 177 O PHE A 12 -4.373 7.038 3.577 1.00 1.11 O ATOM 178 CB PHE A 12 -3.044 7.714 1.304 1.00 0.88 C ATOM 179 CG PHE A 12 -2.433 7.833 -0.078 1.00 1.75 C ATOM 180 CD1 PHE A 12 -1.146 8.377 -0.239 1.00 2.35 C ATOM 181 CD2 PHE A 12 -3.160 7.417 -1.210 1.00 3.07 C ATOM 182 CE1 PHE A 12 -0.595 8.516 -1.525 1.00 3.15 C ATOM 183 CE2 PHE A 12 -2.609 7.555 -2.495 1.00 3.89 C ATOM 184 CZ PHE A 12 -1.327 8.107 -2.653 1.00 3.62 C ATOM 185 H PHE A 12 -3.423 4.859 1.502 1.00 0.57 H ATOM 186 HA PHE A 12 -1.424 6.837 2.425 1.00 0.65 H ATOM 187 HB2 PHE A 12 -4.112 7.532 1.187 1.00 1.32 H ATOM 188 HB3 PHE A 12 -2.932 8.670 1.818 1.00 0.68 H ATOM 189 HD1 PHE A 12 -0.584 8.695 0.627 1.00 2.92 H ATOM 190 HD2 PHE A 12 -4.153 7.003 -1.097 1.00 3.83 H ATOM 191 HE1 PHE A 12 0.388 8.948 -1.645 1.00 3.94 H ATOM 192 HE2 PHE A 12 -3.178 7.248 -3.361 1.00 5.06 H ATOM 193 HZ PHE A 12 -0.910 8.229 -3.643 1.00 4.36 H ATOM 194 N TYR A 13 -2.723 5.852 4.528 1.00 1.33 N ATOM 195 CA TYR A 13 -3.455 5.591 5.763 1.00 1.91 C ATOM 196 C TYR A 13 -2.522 5.697 6.957 1.00 2.50 C ATOM 197 O TYR A 13 -1.344 5.321 6.784 1.00 2.89 O ATOM 198 CB TYR A 13 -4.085 4.195 5.688 1.00 2.54 C ATOM 199 CG TYR A 13 -5.091 4.053 4.567 1.00 2.09 C ATOM 200 CD1 TYR A 13 -6.260 4.833 4.596 1.00 2.61 C ATOM 201 CD2 TYR A 13 -4.840 3.194 3.482 1.00 2.64 C ATOM 202 CE1 TYR A 13 -7.176 4.780 3.532 1.00 3.03 C ATOM 203 CE2 TYR A 13 -5.748 3.138 2.409 1.00 2.70 C ATOM 204 CZ TYR A 13 -6.915 3.936 2.429 1.00 2.66 C ATOM 205 OH TYR A 13 -7.782 3.886 1.380 1.00 3.43 O ATOM 206 OXT TYR A 13 -3.016 6.100 8.037 1.00 3.14 O ATOM 207 H TYR A 13 -1.791 5.464 4.481 1.00 1.48 H ATOM 208 HA TYR A 13 -4.238 6.338 5.889 1.00 1.74 H ATOM 209 HB2 TYR A 13 -3.293 3.451 5.575 1.00 3.22 H ATOM 210 HB3 TYR A 13 -4.602 3.991 6.622 1.00 3.24 H ATOM 211 HD1 TYR A 13 -6.435 5.504 5.423 1.00 3.45 H ATOM 212 HD2 TYR A 13 -3.951 2.579 3.481 1.00 3.67 H ATOM 213 HE1 TYR A 13 -8.058 5.402 3.566 1.00 4.17 H ATOM 214 HE2 TYR A 13 -5.565 2.486 1.569 1.00 3.57 H ATOM 215 HH TYR A 13 -8.534 4.473 1.480 1.00 3.93 H TER 216 TYR A 13 ENDMDL MODEL 11 ATOM 1 N ARG A 1 -3.751 -3.514 11.090 1.00 5.60 N ATOM 2 CA ARG A 1 -3.580 -2.202 11.746 1.00 4.32 C ATOM 3 C ARG A 1 -2.766 -1.336 10.803 1.00 2.72 C ATOM 4 O ARG A 1 -1.765 -1.841 10.304 1.00 3.49 O ATOM 5 CB ARG A 1 -2.874 -2.363 13.103 1.00 5.36 C ATOM 6 CG ARG A 1 -3.259 -1.232 14.070 1.00 6.11 C ATOM 7 CD ARG A 1 -3.427 -1.757 15.505 1.00 7.52 C ATOM 8 NE ARG A 1 -4.429 -0.974 16.246 1.00 8.34 N ATOM 9 CZ ARG A 1 -5.262 -1.466 17.175 1.00 9.67 C ATOM 10 NH1 ARG A 1 -5.111 -2.711 17.628 1.00 10.42 N ATOM 11 NH2 ARG A 1 -6.256 -0.711 17.644 1.00 10.58 N ATOM 12 H1 ARG A 1 -2.836 -3.874 10.847 1.00 5.78 H ATOM 13 H2 ARG A 1 -4.224 -4.158 11.707 1.00 6.66 H ATOM 14 H3 ARG A 1 -4.286 -3.402 10.239 1.00 5.85 H ATOM 15 HA ARG A 1 -4.563 -1.758 11.899 1.00 4.74 H ATOM 16 HB2 ARG A 1 -3.179 -3.318 13.528 1.00 6.25 H ATOM 17 HB3 ARG A 1 -1.790 -2.390 12.973 1.00 5.48 H ATOM 18 HG2 ARG A 1 -2.499 -0.447 14.050 1.00 6.21 H ATOM 19 HG3 ARG A 1 -4.207 -0.801 13.745 1.00 6.11 H ATOM 20 HD2 ARG A 1 -3.767 -2.791 15.462 1.00 8.04 H ATOM 21 HD3 ARG A 1 -2.467 -1.727 16.025 1.00 7.90 H ATOM 22 HE ARG A 1 -4.512 -0.005 15.977 1.00 8.19 H ATOM 23 HH11 ARG A 1 -4.328 -3.268 17.325 1.00 10.14 H ATOM 24 HH12 ARG A 1 -5.729 -3.112 18.317 1.00 11.54 H ATOM 25 HH21 ARG A 1 -6.406 0.230 17.311 1.00 10.44 H ATOM 26 HH22 ARG A 1 -6.902 -1.060 18.337 1.00 11.66 H ATOM 27 N LYS A 2 -3.189 -0.098 10.520 1.00 1.77 N ATOM 28 CA LYS A 2 -2.626 0.701 9.433 1.00 0.83 C ATOM 29 C LYS A 2 -2.706 -0.088 8.125 1.00 1.17 C ATOM 30 O LYS A 2 -3.758 -0.080 7.497 1.00 3.04 O ATOM 31 CB LYS A 2 -1.226 1.217 9.818 1.00 1.68 C ATOM 32 CG LYS A 2 -0.647 2.223 8.807 1.00 3.28 C ATOM 33 CD LYS A 2 0.670 1.766 8.153 1.00 4.96 C ATOM 34 CE LYS A 2 1.699 2.904 8.125 1.00 6.49 C ATOM 35 NZ LYS A 2 2.266 3.174 9.466 1.00 7.06 N ATOM 36 H LYS A 2 -4.026 0.272 10.946 1.00 3.02 H ATOM 37 HA LYS A 2 -3.265 1.576 9.296 1.00 1.82 H ATOM 38 HB2 LYS A 2 -1.313 1.726 10.779 1.00 2.19 H ATOM 39 HB3 LYS A 2 -0.544 0.382 9.967 1.00 2.53 H ATOM 40 HG2 LYS A 2 -1.377 2.427 8.024 1.00 3.88 H ATOM 41 HG3 LYS A 2 -0.476 3.163 9.332 1.00 3.71 H ATOM 42 HD2 LYS A 2 1.103 0.911 8.674 1.00 5.08 H ATOM 43 HD3 LYS A 2 0.457 1.462 7.127 1.00 5.72 H ATOM 44 HE2 LYS A 2 2.508 2.627 7.446 1.00 7.32 H ATOM 45 HE3 LYS A 2 1.219 3.804 7.736 1.00 6.98 H ATOM 46 HZ1 LYS A 2 2.916 3.948 9.415 1.00 8.07 H ATOM 47 HZ2 LYS A 2 1.528 3.415 10.114 1.00 6.97 H ATOM 48 HZ3 LYS A 2 2.758 2.361 9.809 1.00 7.09 H ATOM 49 N SER A 3 -1.650 -0.824 7.776 1.00 0.73 N ATOM 50 CA SER A 3 -1.499 -1.574 6.539 1.00 0.63 C ATOM 51 C SER A 3 -1.012 -0.614 5.465 1.00 0.63 C ATOM 52 O SER A 3 -1.463 0.524 5.380 1.00 0.86 O ATOM 53 CB SER A 3 -2.793 -2.283 6.122 1.00 0.67 C ATOM 54 OG SER A 3 -2.464 -3.402 5.327 1.00 1.82 O ATOM 55 H SER A 3 -0.896 -0.893 8.441 1.00 2.18 H ATOM 56 HA SER A 3 -0.732 -2.332 6.700 1.00 0.61 H ATOM 57 HB2 SER A 3 -3.326 -2.634 7.006 1.00 1.48 H ATOM 58 HB3 SER A 3 -3.430 -1.601 5.557 1.00 1.35 H ATOM 59 HG SER A 3 -3.251 -3.685 4.853 1.00 2.15 H ATOM 60 N ILE A 4 -0.027 -1.056 4.689 1.00 0.48 N ATOM 61 CA ILE A 4 0.532 -0.288 3.607 1.00 0.44 C ATOM 62 C ILE A 4 -0.153 -0.750 2.321 1.00 0.34 C ATOM 63 O ILE A 4 -1.353 -1.008 2.285 1.00 0.39 O ATOM 64 CB ILE A 4 2.063 -0.465 3.607 1.00 0.49 C ATOM 65 CG1 ILE A 4 2.648 -0.553 5.020 1.00 0.62 C ATOM 66 CG2 ILE A 4 2.709 0.760 2.927 1.00 0.53 C ATOM 67 CD1 ILE A 4 2.866 -1.977 5.549 1.00 1.59 C ATOM 68 H ILE A 4 0.382 -1.964 4.828 1.00 0.45 H ATOM 69 HA ILE A 4 0.318 0.767 3.745 1.00 0.51 H ATOM 70 HB ILE A 4 2.340 -1.385 3.092 1.00 0.44 H ATOM 71 HG12 ILE A 4 3.621 -0.103 4.967 1.00 1.04 H ATOM 72 HG13 ILE A 4 2.050 0.036 5.713 1.00 0.82 H ATOM 73 HG21 ILE A 4 2.634 1.627 3.587 1.00 1.37 H ATOM 74 HG22 ILE A 4 3.762 0.560 2.727 1.00 1.72 H ATOM 75 HG23 ILE A 4 2.220 1.022 1.991 1.00 1.25 H ATOM 76 HD11 ILE A 4 3.436 -2.557 4.821 1.00 2.50 H ATOM 77 HD12 ILE A 4 3.438 -1.927 6.476 1.00 2.21 H ATOM 78 HD13 ILE A 4 1.925 -2.480 5.755 1.00 2.03 H ATOM 79 N ASN A 5 0.633 -0.863 1.263 1.00 0.27 N ATOM 80 CA ASN A 5 0.255 -1.356 -0.037 1.00 0.19 C ATOM 81 C ASN A 5 1.015 -2.658 -0.270 1.00 0.16 C ATOM 82 O ASN A 5 1.993 -2.925 0.426 1.00 0.23 O ATOM 83 CB ASN A 5 0.565 -0.245 -1.030 1.00 0.21 C ATOM 84 CG ASN A 5 0.438 -0.731 -2.444 1.00 0.18 C ATOM 85 OD1 ASN A 5 -0.605 -0.623 -3.069 1.00 0.24 O ATOM 86 ND2 ASN A 5 1.516 -1.296 -2.940 1.00 0.20 N ATOM 87 H ASN A 5 1.621 -0.709 1.391 1.00 0.32 H ATOM 88 HA ASN A 5 -0.801 -1.571 -0.111 1.00 0.21 H ATOM 89 HB2 ASN A 5 -0.142 0.565 -0.893 1.00 0.28 H ATOM 90 HB3 ASN A 5 1.575 0.136 -0.870 1.00 0.27 H ATOM 91 HD21 ASN A 5 2.299 -1.506 -2.333 1.00 0.23 H ATOM 92 HD22 ASN A 5 1.581 -1.486 -3.919 1.00 0.24 H ATOM 93 N ILE A 6 0.553 -3.462 -1.232 1.00 0.14 N ATOM 94 CA ILE A 6 1.261 -4.626 -1.743 1.00 0.18 C ATOM 95 C ILE A 6 2.479 -4.120 -2.540 1.00 0.21 C ATOM 96 O ILE A 6 3.305 -3.375 -2.018 1.00 0.39 O ATOM 97 CB ILE A 6 0.269 -5.471 -2.564 1.00 0.21 C ATOM 98 CG1 ILE A 6 -1.004 -5.764 -1.753 1.00 0.28 C ATOM 99 CG2 ILE A 6 0.842 -6.812 -3.062 1.00 0.28 C ATOM 100 CD1 ILE A 6 -0.751 -6.273 -0.327 1.00 2.61 C ATOM 101 H ILE A 6 -0.272 -3.181 -1.741 1.00 0.15 H ATOM 102 HA ILE A 6 1.603 -5.235 -0.909 1.00 0.25 H ATOM 103 HB ILE A 6 -0.030 -4.889 -3.438 1.00 0.20 H ATOM 104 HG12 ILE A 6 -1.626 -4.869 -1.699 1.00 1.85 H ATOM 105 HG13 ILE A 6 -1.563 -6.519 -2.289 1.00 1.80 H ATOM 106 HG21 ILE A 6 0.332 -7.092 -3.984 1.00 1.55 H ATOM 107 HG22 ILE A 6 1.912 -6.764 -3.250 1.00 1.44 H ATOM 108 HG23 ILE A 6 0.683 -7.599 -2.329 1.00 1.51 H ATOM 109 HD11 ILE A 6 -0.350 -5.476 0.295 1.00 3.78 H ATOM 110 HD12 ILE A 6 -1.694 -6.610 0.104 1.00 3.18 H ATOM 111 HD13 ILE A 6 -0.051 -7.107 -0.335 1.00 3.60 H ATOM 112 N GLY A 7 2.586 -4.459 -3.825 1.00 0.21 N ATOM 113 CA GLY A 7 3.697 -4.048 -4.667 1.00 0.24 C ATOM 114 C GLY A 7 3.252 -2.900 -5.559 1.00 0.19 C ATOM 115 O GLY A 7 3.412 -1.741 -5.185 1.00 0.18 O ATOM 116 H GLY A 7 1.863 -5.026 -4.241 1.00 0.31 H ATOM 117 HA2 GLY A 7 4.533 -3.713 -4.052 1.00 0.27 H ATOM 118 HA3 GLY A 7 4.033 -4.890 -5.270 1.00 0.29 H ATOM 119 N PRO A 8 2.667 -3.192 -6.727 1.00 0.22 N ATOM 120 CA PRO A 8 2.280 -2.179 -7.692 1.00 0.25 C ATOM 121 C PRO A 8 1.065 -1.401 -7.182 1.00 0.22 C ATOM 122 O PRO A 8 -0.075 -1.737 -7.490 1.00 0.27 O ATOM 123 CB PRO A 8 1.995 -2.958 -8.982 1.00 0.32 C ATOM 124 CG PRO A 8 1.519 -4.319 -8.474 1.00 0.32 C ATOM 125 CD PRO A 8 2.345 -4.525 -7.204 1.00 0.28 C ATOM 126 HA PRO A 8 3.104 -1.485 -7.863 1.00 0.27 H ATOM 127 HB2 PRO A 8 1.249 -2.470 -9.610 1.00 0.36 H ATOM 128 HB3 PRO A 8 2.927 -3.088 -9.533 1.00 0.35 H ATOM 129 HG2 PRO A 8 0.460 -4.268 -8.217 1.00 0.33 H ATOM 130 HG3 PRO A 8 1.700 -5.109 -9.203 1.00 0.37 H ATOM 131 HD2 PRO A 8 1.764 -5.078 -6.466 1.00 0.29 H ATOM 132 HD3 PRO A 8 3.264 -5.059 -7.444 1.00 0.31 H ATOM 133 N GLY A 9 1.309 -0.356 -6.395 1.00 0.18 N ATOM 134 CA GLY A 9 0.270 0.472 -5.811 1.00 0.19 C ATOM 135 C GLY A 9 0.890 1.392 -4.762 1.00 0.18 C ATOM 136 O GLY A 9 2.105 1.381 -4.572 1.00 0.29 O ATOM 137 H GLY A 9 2.258 -0.167 -6.085 1.00 0.18 H ATOM 138 HA2 GLY A 9 -0.202 1.069 -6.589 1.00 0.25 H ATOM 139 HA3 GLY A 9 -0.480 -0.174 -5.352 1.00 0.19 H ATOM 140 N ARG A 10 0.069 2.183 -4.071 1.00 0.17 N ATOM 141 CA ARG A 10 0.465 2.982 -2.916 1.00 0.19 C ATOM 142 C ARG A 10 -0.732 3.048 -1.979 1.00 0.18 C ATOM 143 O ARG A 10 -1.853 2.774 -2.400 1.00 0.22 O ATOM 144 CB ARG A 10 0.903 4.394 -3.336 1.00 0.35 C ATOM 145 CG ARG A 10 2.365 4.409 -3.798 1.00 1.71 C ATOM 146 CD ARG A 10 2.813 5.821 -4.186 1.00 2.05 C ATOM 147 NE ARG A 10 4.278 5.956 -4.164 1.00 3.24 N ATOM 148 CZ ARG A 10 5.147 5.373 -5.002 1.00 4.03 C ATOM 149 NH1 ARG A 10 4.714 4.607 -6.003 1.00 4.39 N ATOM 150 NH2 ARG A 10 6.457 5.558 -4.831 1.00 5.29 N ATOM 151 H ARG A 10 -0.933 2.087 -4.205 1.00 0.24 H ATOM 152 HA ARG A 10 1.279 2.478 -2.391 1.00 0.21 H ATOM 153 HB2 ARG A 10 0.253 4.764 -4.131 1.00 1.20 H ATOM 154 HB3 ARG A 10 0.816 5.065 -2.480 1.00 1.25 H ATOM 155 HG2 ARG A 10 2.991 4.042 -2.983 1.00 2.64 H ATOM 156 HG3 ARG A 10 2.482 3.759 -4.660 1.00 2.64 H ATOM 157 HD2 ARG A 10 2.424 6.072 -5.174 1.00 2.57 H ATOM 158 HD3 ARG A 10 2.398 6.530 -3.469 1.00 2.17 H ATOM 159 HE ARG A 10 4.634 6.540 -3.421 1.00 4.11 H ATOM 160 HH11 ARG A 10 3.724 4.461 -6.129 1.00 4.11 H ATOM 161 HH12 ARG A 10 5.342 4.141 -6.639 1.00 5.47 H ATOM 162 HH21 ARG A 10 6.809 6.131 -4.077 1.00 5.86 H ATOM 163 HH22 ARG A 10 7.136 5.130 -5.442 1.00 6.03 H ATOM 164 N ALA A 11 -0.502 3.409 -0.718 1.00 0.23 N ATOM 165 CA ALA A 11 -1.552 3.490 0.275 1.00 0.26 C ATOM 166 C ALA A 11 -1.285 4.698 1.151 1.00 0.35 C ATOM 167 O ALA A 11 -0.143 4.927 1.541 1.00 0.74 O ATOM 168 CB ALA A 11 -1.545 2.236 1.145 1.00 0.32 C ATOM 169 H ALA A 11 0.416 3.697 -0.407 1.00 0.30 H ATOM 170 HA ALA A 11 -2.522 3.586 -0.216 1.00 0.26 H ATOM 171 HB1 ALA A 11 -0.557 2.111 1.588 1.00 1.41 H ATOM 172 HB2 ALA A 11 -2.280 2.354 1.942 1.00 1.33 H ATOM 173 HB3 ALA A 11 -1.801 1.365 0.545 1.00 1.36 H ATOM 174 N PHE A 12 -2.346 5.432 1.473 1.00 0.32 N ATOM 175 CA PHE A 12 -2.318 6.544 2.402 1.00 0.31 C ATOM 176 C PHE A 12 -3.682 6.562 3.086 1.00 0.83 C ATOM 177 O PHE A 12 -4.612 7.217 2.624 1.00 1.27 O ATOM 178 CB PHE A 12 -2.018 7.846 1.654 1.00 0.85 C ATOM 179 CG PHE A 12 -0.584 7.961 1.171 1.00 1.63 C ATOM 180 CD1 PHE A 12 0.434 8.295 2.084 1.00 3.19 C ATOM 181 CD2 PHE A 12 -0.255 7.719 -0.176 1.00 2.46 C ATOM 182 CE1 PHE A 12 1.766 8.416 1.650 1.00 3.92 C ATOM 183 CE2 PHE A 12 1.076 7.851 -0.614 1.00 3.06 C ATOM 184 CZ PHE A 12 2.086 8.202 0.299 1.00 3.34 C ATOM 185 H PHE A 12 -3.258 5.163 1.133 1.00 0.59 H ATOM 186 HA PHE A 12 -1.544 6.383 3.153 1.00 0.68 H ATOM 187 HB2 PHE A 12 -2.700 7.927 0.808 1.00 1.27 H ATOM 188 HB3 PHE A 12 -2.219 8.687 2.320 1.00 0.72 H ATOM 189 HD1 PHE A 12 0.190 8.452 3.124 1.00 4.27 H ATOM 190 HD2 PHE A 12 -1.026 7.424 -0.872 1.00 3.49 H ATOM 191 HE1 PHE A 12 2.541 8.675 2.357 1.00 5.35 H ATOM 192 HE2 PHE A 12 1.322 7.685 -1.651 1.00 4.11 H ATOM 193 HZ PHE A 12 3.110 8.306 -0.033 1.00 4.02 H ATOM 194 N TYR A 13 -3.780 5.792 4.166 1.00 1.29 N ATOM 195 CA TYR A 13 -4.895 5.714 5.095 1.00 1.88 C ATOM 196 C TYR A 13 -4.281 5.838 6.485 1.00 2.39 C ATOM 197 O TYR A 13 -3.078 5.500 6.598 1.00 2.50 O ATOM 198 CB TYR A 13 -5.625 4.367 4.975 1.00 2.35 C ATOM 199 CG TYR A 13 -6.664 4.253 3.877 1.00 2.21 C ATOM 200 CD1 TYR A 13 -7.998 4.615 4.142 1.00 3.15 C ATOM 201 CD2 TYR A 13 -6.326 3.706 2.625 1.00 2.83 C ATOM 202 CE1 TYR A 13 -8.995 4.421 3.170 1.00 3.51 C ATOM 203 CE2 TYR A 13 -7.316 3.511 1.643 1.00 3.31 C ATOM 204 CZ TYR A 13 -8.660 3.864 1.917 1.00 3.20 C ATOM 205 OH TYR A 13 -9.640 3.661 0.991 1.00 4.00 O ATOM 206 OXT TYR A 13 -5.020 6.248 7.403 1.00 3.25 O ATOM 207 H TYR A 13 -2.945 5.353 4.531 1.00 1.42 H ATOM 208 HA TYR A 13 -5.590 6.539 4.934 1.00 1.97 H ATOM 209 HB2 TYR A 13 -4.888 3.571 4.865 1.00 2.79 H ATOM 210 HB3 TYR A 13 -6.137 4.184 5.922 1.00 3.10 H ATOM 211 HD1 TYR A 13 -8.260 5.027 5.106 1.00 4.23 H ATOM 212 HD2 TYR A 13 -5.305 3.416 2.428 1.00 3.77 H ATOM 213 HE1 TYR A 13 -10.021 4.685 3.380 1.00 4.67 H ATOM 214 HE2 TYR A 13 -7.044 3.079 0.691 1.00 4.45 H ATOM 215 HH TYR A 13 -9.326 3.264 0.177 1.00 4.13 H TER 216 TYR A 13 ENDMDL MODEL 12 ATOM 1 N ARG A 1 -0.844 0.276 14.415 1.00 5.18 N ATOM 2 CA ARG A 1 -0.622 -0.505 13.183 1.00 4.60 C ATOM 3 C ARG A 1 -1.703 -0.132 12.177 1.00 2.76 C ATOM 4 O ARG A 1 -2.813 0.173 12.606 1.00 2.81 O ATOM 5 CB ARG A 1 -0.591 -2.017 13.477 1.00 5.81 C ATOM 6 CG ARG A 1 -1.929 -2.590 13.971 1.00 6.73 C ATOM 7 CD ARG A 1 -1.766 -4.061 14.376 1.00 8.19 C ATOM 8 NE ARG A 1 -3.065 -4.696 14.643 1.00 9.02 N ATOM 9 CZ ARG A 1 -3.910 -5.167 13.714 1.00 9.78 C ATOM 10 NH1 ARG A 1 -3.593 -5.098 12.420 1.00 9.89 N ATOM 11 NH2 ARG A 1 -5.076 -5.702 14.078 1.00 10.84 N ATOM 12 H1 ARG A 1 -1.791 0.115 14.734 1.00 5.02 H ATOM 13 H2 ARG A 1 -0.184 0.007 15.131 1.00 6.38 H ATOM 14 H3 ARG A 1 -0.744 1.260 14.212 1.00 5.10 H ATOM 15 HA ARG A 1 0.348 -0.223 12.769 1.00 5.32 H ATOM 16 HB2 ARG A 1 -0.302 -2.544 12.566 1.00 6.02 H ATOM 17 HB3 ARG A 1 0.174 -2.208 14.231 1.00 6.63 H ATOM 18 HG2 ARG A 1 -2.283 -2.028 14.836 1.00 7.10 H ATOM 19 HG3 ARG A 1 -2.669 -2.515 13.174 1.00 6.57 H ATOM 20 HD2 ARG A 1 -1.244 -4.607 13.590 1.00 8.56 H ATOM 21 HD3 ARG A 1 -1.157 -4.113 15.280 1.00 8.73 H ATOM 22 HE ARG A 1 -3.307 -4.788 15.620 1.00 9.41 H ATOM 23 HH11 ARG A 1 -2.700 -4.727 12.138 1.00 9.42 H ATOM 24 HH12 ARG A 1 -4.206 -5.444 11.698 1.00 10.78 H ATOM 25 HH21 ARG A 1 -5.341 -5.772 15.050 1.00 11.13 H ATOM 26 HH22 ARG A 1 -5.728 -6.062 13.397 1.00 11.62 H ATOM 27 N LYS A 2 -1.389 -0.107 10.880 1.00 1.95 N ATOM 28 CA LYS A 2 -2.335 0.120 9.787 1.00 0.67 C ATOM 29 C LYS A 2 -1.933 -0.831 8.657 1.00 0.84 C ATOM 30 O LYS A 2 -1.062 -1.672 8.876 1.00 2.20 O ATOM 31 CB LYS A 2 -2.345 1.605 9.348 1.00 1.92 C ATOM 32 CG LYS A 2 -3.348 2.448 10.155 1.00 3.14 C ATOM 33 CD LYS A 2 -2.725 3.107 11.390 1.00 4.14 C ATOM 34 CE LYS A 2 -3.800 3.378 12.453 1.00 5.40 C ATOM 35 NZ LYS A 2 -4.164 4.808 12.541 1.00 6.99 N ATOM 36 H LYS A 2 -0.480 -0.430 10.568 1.00 3.02 H ATOM 37 HA LYS A 2 -3.335 -0.172 10.110 1.00 1.84 H ATOM 38 HB2 LYS A 2 -1.344 2.036 9.410 1.00 2.47 H ATOM 39 HB3 LYS A 2 -2.657 1.673 8.307 1.00 2.98 H ATOM 40 HG2 LYS A 2 -3.745 3.237 9.514 1.00 4.06 H ATOM 41 HG3 LYS A 2 -4.182 1.813 10.452 1.00 3.66 H ATOM 42 HD2 LYS A 2 -1.977 2.448 11.818 1.00 4.02 H ATOM 43 HD3 LYS A 2 -2.218 4.028 11.096 1.00 4.96 H ATOM 44 HE2 LYS A 2 -4.688 2.782 12.226 1.00 5.84 H ATOM 45 HE3 LYS A 2 -3.420 3.043 13.420 1.00 5.34 H ATOM 46 HZ1 LYS A 2 -4.583 5.117 11.674 1.00 7.58 H ATOM 47 HZ2 LYS A 2 -4.827 4.950 13.292 1.00 7.64 H ATOM 48 HZ3 LYS A 2 -3.342 5.367 12.723 1.00 7.28 H ATOM 49 N SER A 3 -2.552 -0.729 7.481 1.00 0.69 N ATOM 50 CA SER A 3 -2.195 -1.539 6.329 1.00 0.57 C ATOM 51 C SER A 3 -1.780 -0.586 5.216 1.00 0.55 C ATOM 52 O SER A 3 -2.397 0.463 5.040 1.00 0.63 O ATOM 53 CB SER A 3 -3.363 -2.452 5.935 1.00 0.57 C ATOM 54 OG SER A 3 -4.561 -1.732 5.736 1.00 2.46 O ATOM 55 H SER A 3 -3.169 0.044 7.278 1.00 1.79 H ATOM 56 HA SER A 3 -1.344 -2.176 6.573 1.00 0.58 H ATOM 57 HB2 SER A 3 -3.109 -2.984 5.018 1.00 1.85 H ATOM 58 HB3 SER A 3 -3.524 -3.183 6.728 1.00 1.73 H ATOM 59 HG SER A 3 -4.802 -1.270 6.539 1.00 3.14 H ATOM 60 N ILE A 4 -0.676 -0.907 4.539 1.00 0.48 N ATOM 61 CA ILE A 4 -0.126 -0.076 3.487 1.00 0.48 C ATOM 62 C ILE A 4 -0.629 -0.636 2.155 1.00 0.38 C ATOM 63 O ILE A 4 -1.791 -1.008 2.018 1.00 0.42 O ATOM 64 CB ILE A 4 1.401 -0.005 3.627 1.00 0.56 C ATOM 65 CG1 ILE A 4 1.844 0.068 5.095 1.00 0.71 C ATOM 66 CG2 ILE A 4 1.973 1.220 2.881 1.00 0.60 C ATOM 67 CD1 ILE A 4 1.140 1.102 5.988 1.00 3.03 C ATOM 68 H ILE A 4 -0.145 -1.729 4.776 1.00 0.48 H ATOM 69 HA ILE A 4 -0.464 0.945 3.588 1.00 0.53 H ATOM 70 HB ILE A 4 1.842 -0.914 3.212 1.00 0.51 H ATOM 71 HG12 ILE A 4 1.763 -0.916 5.556 1.00 1.71 H ATOM 72 HG13 ILE A 4 2.890 0.317 5.063 1.00 1.43 H ATOM 73 HG21 ILE A 4 3.034 1.062 2.682 1.00 1.38 H ATOM 74 HG22 ILE A 4 1.461 1.404 1.939 1.00 2.04 H ATOM 75 HG23 ILE A 4 1.868 2.122 3.482 1.00 1.91 H ATOM 76 HD11 ILE A 4 0.238 0.679 6.426 1.00 3.87 H ATOM 77 HD12 ILE A 4 1.806 1.381 6.805 1.00 3.47 H ATOM 78 HD13 ILE A 4 0.879 1.999 5.428 1.00 4.31 H ATOM 79 N ASN A 5 0.259 -0.717 1.176 1.00 0.31 N ATOM 80 CA ASN A 5 0.045 -1.292 -0.130 1.00 0.22 C ATOM 81 C ASN A 5 0.969 -2.500 -0.262 1.00 0.19 C ATOM 82 O ASN A 5 1.944 -2.601 0.476 1.00 0.32 O ATOM 83 CB ASN A 5 0.290 -0.193 -1.156 1.00 0.31 C ATOM 84 CG ASN A 5 0.344 -0.757 -2.548 1.00 0.24 C ATOM 85 OD1 ASN A 5 -0.648 -0.797 -3.259 1.00 0.32 O ATOM 86 ND2 ASN A 5 1.514 -1.225 -2.923 1.00 0.20 N ATOM 87 H ASN A 5 1.212 -0.462 1.374 1.00 0.35 H ATOM 88 HA ASN A 5 -0.970 -1.640 -0.267 1.00 0.23 H ATOM 89 HB2 ASN A 5 -0.528 0.518 -1.120 1.00 0.41 H ATOM 90 HB3 ASN A 5 1.225 0.326 -0.941 1.00 0.38 H ATOM 91 HD21 ASN A 5 2.267 -1.299 -2.252 1.00 0.25 H ATOM 92 HD22 ASN A 5 1.663 -1.476 -3.879 1.00 0.20 H ATOM 93 N ILE A 6 0.635 -3.402 -1.187 1.00 0.17 N ATOM 94 CA ILE A 6 1.431 -4.555 -1.581 1.00 0.28 C ATOM 95 C ILE A 6 2.688 -4.039 -2.306 1.00 0.30 C ATOM 96 O ILE A 6 3.521 -3.360 -1.715 1.00 0.42 O ATOM 97 CB ILE A 6 0.537 -5.482 -2.442 1.00 0.35 C ATOM 98 CG1 ILE A 6 -0.734 -5.916 -1.685 1.00 0.43 C ATOM 99 CG2 ILE A 6 1.283 -6.739 -2.934 1.00 0.48 C ATOM 100 CD1 ILE A 6 -1.842 -6.295 -2.673 1.00 1.35 C ATOM 101 H ILE A 6 -0.195 -3.229 -1.735 1.00 0.18 H ATOM 102 HA ILE A 6 1.749 -5.091 -0.687 1.00 0.35 H ATOM 103 HB ILE A 6 0.212 -4.910 -3.313 1.00 0.31 H ATOM 104 HG12 ILE A 6 -0.508 -6.758 -1.031 1.00 1.13 H ATOM 105 HG13 ILE A 6 -1.118 -5.110 -1.062 1.00 0.99 H ATOM 106 HG21 ILE A 6 2.243 -6.838 -2.426 1.00 1.71 H ATOM 107 HG22 ILE A 6 0.703 -7.638 -2.736 1.00 1.25 H ATOM 108 HG23 ILE A 6 1.444 -6.685 -4.011 1.00 1.55 H ATOM 109 HD11 ILE A 6 -1.506 -7.087 -3.341 1.00 2.45 H ATOM 110 HD12 ILE A 6 -2.719 -6.637 -2.122 1.00 1.92 H ATOM 111 HD13 ILE A 6 -2.119 -5.421 -3.264 1.00 2.28 H ATOM 112 N GLY A 7 2.825 -4.312 -3.603 1.00 0.30 N ATOM 113 CA GLY A 7 3.955 -3.872 -4.402 1.00 0.31 C ATOM 114 C GLY A 7 3.468 -2.829 -5.395 1.00 0.19 C ATOM 115 O GLY A 7 3.550 -1.637 -5.111 1.00 0.17 O ATOM 116 H GLY A 7 2.096 -4.822 -4.071 1.00 0.36 H ATOM 117 HA2 GLY A 7 4.723 -3.425 -3.770 1.00 0.36 H ATOM 118 HA3 GLY A 7 4.392 -4.721 -4.927 1.00 0.41 H ATOM 119 N PRO A 8 2.918 -3.249 -6.540 1.00 0.20 N ATOM 120 CA PRO A 8 2.483 -2.340 -7.587 1.00 0.24 C ATOM 121 C PRO A 8 1.216 -1.596 -7.153 1.00 0.24 C ATOM 122 O PRO A 8 0.103 -2.017 -7.457 1.00 0.31 O ATOM 123 CB PRO A 8 2.269 -3.235 -8.813 1.00 0.36 C ATOM 124 CG PRO A 8 1.875 -4.584 -8.208 1.00 0.40 C ATOM 125 CD PRO A 8 2.685 -4.634 -6.912 1.00 0.32 C ATOM 126 HA PRO A 8 3.267 -1.615 -7.804 1.00 0.24 H ATOM 127 HB2 PRO A 8 1.504 -2.851 -9.488 1.00 0.44 H ATOM 128 HB3 PRO A 8 3.216 -3.347 -9.343 1.00 0.38 H ATOM 129 HG2 PRO A 8 0.810 -4.587 -7.975 1.00 0.42 H ATOM 130 HG3 PRO A 8 2.125 -5.413 -8.868 1.00 0.48 H ATOM 131 HD2 PRO A 8 2.120 -5.160 -6.143 1.00 0.34 H ATOM 132 HD3 PRO A 8 3.639 -5.131 -7.091 1.00 0.37 H ATOM 133 N GLY A 9 1.384 -0.481 -6.442 1.00 0.21 N ATOM 134 CA GLY A 9 0.296 0.360 -5.967 1.00 0.25 C ATOM 135 C GLY A 9 0.839 1.369 -4.964 1.00 0.25 C ATOM 136 O GLY A 9 2.050 1.513 -4.814 1.00 0.32 O ATOM 137 H GLY A 9 2.315 -0.215 -6.136 1.00 0.19 H ATOM 138 HA2 GLY A 9 -0.149 0.894 -6.803 1.00 0.32 H ATOM 139 HA3 GLY A 9 -0.472 -0.252 -5.493 1.00 0.23 H ATOM 140 N ARG A 10 -0.055 2.072 -4.270 1.00 0.28 N ATOM 141 CA ARG A 10 0.295 2.961 -3.171 1.00 0.30 C ATOM 142 C ARG A 10 -0.898 3.032 -2.233 1.00 0.28 C ATOM 143 O ARG A 10 -1.998 2.639 -2.615 1.00 0.29 O ATOM 144 CB ARG A 10 0.688 4.353 -3.686 1.00 0.44 C ATOM 145 CG ARG A 10 -0.381 4.989 -4.584 1.00 2.35 C ATOM 146 CD ARG A 10 0.058 6.403 -4.977 1.00 2.84 C ATOM 147 NE ARG A 10 -0.619 6.855 -6.201 1.00 4.54 N ATOM 148 CZ ARG A 10 -0.187 7.848 -6.990 1.00 5.41 C ATOM 149 NH1 ARG A 10 0.839 8.607 -6.606 1.00 5.09 N ATOM 150 NH2 ARG A 10 -0.779 8.075 -8.163 1.00 7.06 N ATOM 151 H ARG A 10 -1.041 1.857 -4.366 1.00 0.32 H ATOM 152 HA ARG A 10 1.139 2.532 -2.628 1.00 0.29 H ATOM 153 HB2 ARG A 10 0.876 5.009 -2.835 1.00 1.45 H ATOM 154 HB3 ARG A 10 1.615 4.264 -4.254 1.00 1.79 H ATOM 155 HG2 ARG A 10 -0.493 4.384 -5.484 1.00 3.27 H ATOM 156 HG3 ARG A 10 -1.339 5.042 -4.065 1.00 3.34 H ATOM 157 HD2 ARG A 10 -0.161 7.088 -4.155 1.00 3.04 H ATOM 158 HD3 ARG A 10 1.135 6.391 -5.153 1.00 2.75 H ATOM 159 HE ARG A 10 -1.424 6.310 -6.477 1.00 5.38 H ATOM 160 HH11 ARG A 10 1.267 8.449 -5.706 1.00 4.31 H ATOM 161 HH12 ARG A 10 1.203 9.355 -7.176 1.00 6.00 H ATOM 162 HH21 ARG A 10 -1.546 7.499 -8.479 1.00 7.82 H ATOM 163 HH22 ARG A 10 -0.465 8.808 -8.781 1.00 7.78 H ATOM 164 N ALA A 11 -0.686 3.536 -1.022 1.00 0.31 N ATOM 165 CA ALA A 11 -1.732 3.697 -0.036 1.00 0.33 C ATOM 166 C ALA A 11 -1.485 5.005 0.710 1.00 0.44 C ATOM 167 O ALA A 11 -0.519 5.704 0.405 1.00 1.09 O ATOM 168 CB ALA A 11 -1.709 2.498 0.911 1.00 0.36 C ATOM 169 H ALA A 11 0.208 3.931 -0.767 1.00 0.39 H ATOM 170 HA ALA A 11 -2.691 3.745 -0.552 1.00 0.33 H ATOM 171 HB1 ALA A 11 -1.941 1.589 0.356 1.00 1.65 H ATOM 172 HB2 ALA A 11 -0.717 2.414 1.356 1.00 1.53 H ATOM 173 HB3 ALA A 11 -2.451 2.623 1.695 1.00 1.59 H ATOM 174 N PHE A 12 -2.343 5.339 1.676 1.00 0.36 N ATOM 175 CA PHE A 12 -2.308 6.638 2.331 1.00 0.29 C ATOM 176 C PHE A 12 -2.583 6.466 3.828 1.00 1.24 C ATOM 177 O PHE A 12 -3.607 6.930 4.324 1.00 1.70 O ATOM 178 CB PHE A 12 -3.350 7.559 1.676 1.00 1.11 C ATOM 179 CG PHE A 12 -3.233 7.702 0.169 1.00 2.24 C ATOM 180 CD1 PHE A 12 -2.435 8.718 -0.390 1.00 2.86 C ATOM 181 CD2 PHE A 12 -3.939 6.827 -0.679 1.00 3.67 C ATOM 182 CE1 PHE A 12 -2.360 8.870 -1.786 1.00 4.03 C ATOM 183 CE2 PHE A 12 -3.859 6.973 -2.075 1.00 4.79 C ATOM 184 CZ PHE A 12 -3.074 8.000 -2.629 1.00 4.75 C ATOM 185 H PHE A 12 -3.103 4.723 1.927 1.00 0.86 H ATOM 186 HA PHE A 12 -1.319 7.074 2.202 1.00 0.90 H ATOM 187 HB2 PHE A 12 -4.344 7.173 1.903 1.00 1.79 H ATOM 188 HB3 PHE A 12 -3.274 8.548 2.130 1.00 0.87 H ATOM 189 HD1 PHE A 12 -1.885 9.387 0.255 1.00 3.16 H ATOM 190 HD2 PHE A 12 -4.547 6.041 -0.255 1.00 4.28 H ATOM 191 HE1 PHE A 12 -1.760 9.662 -2.209 1.00 4.82 H ATOM 192 HE2 PHE A 12 -4.410 6.304 -2.719 1.00 6.01 H ATOM 193 HZ PHE A 12 -3.026 8.124 -3.701 1.00 5.75 H ATOM 194 N TYR A 13 -1.687 5.779 4.539 1.00 2.01 N ATOM 195 CA TYR A 13 -1.831 5.450 5.952 1.00 2.99 C ATOM 196 C TYR A 13 -0.452 5.393 6.591 1.00 3.79 C ATOM 197 O TYR A 13 -0.414 5.316 7.839 1.00 3.72 O ATOM 198 CB TYR A 13 -2.515 4.087 6.117 1.00 3.57 C ATOM 199 CG TYR A 13 -3.882 4.002 5.476 1.00 3.03 C ATOM 200 CD1 TYR A 13 -4.968 4.683 6.056 1.00 3.45 C ATOM 201 CD2 TYR A 13 -4.055 3.291 4.276 1.00 3.17 C ATOM 202 CE1 TYR A 13 -6.227 4.670 5.431 1.00 3.74 C ATOM 203 CE2 TYR A 13 -5.307 3.284 3.635 1.00 2.99 C ATOM 204 CZ TYR A 13 -6.396 3.977 4.209 1.00 3.18 C ATOM 205 OH TYR A 13 -7.604 3.967 3.579 1.00 3.79 O ATOM 206 OXT TYR A 13 0.525 5.383 5.809 1.00 5.21 O ATOM 207 H TYR A 13 -0.792 5.514 4.147 1.00 2.15 H ATOM 208 HA TYR A 13 -2.418 6.222 6.451 1.00 3.00 H ATOM 209 HB2 TYR A 13 -1.867 3.317 5.693 1.00 4.12 H ATOM 210 HB3 TYR A 13 -2.615 3.881 7.182 1.00 4.36 H ATOM 211 HD1 TYR A 13 -4.819 5.245 6.965 1.00 4.18 H ATOM 212 HD2 TYR A 13 -3.221 2.749 3.855 1.00 4.04 H ATOM 213 HE1 TYR A 13 -7.046 5.208 5.883 1.00 4.82 H ATOM 214 HE2 TYR A 13 -5.444 2.747 2.708 1.00 3.50 H ATOM 215 HH TYR A 13 -8.273 4.487 4.028 1.00 4.61 H TER 216 TYR A 13 ENDMDL MODEL 13 ATOM 1 N ARG A 1 -3.285 -1.002 14.387 1.00 4.75 N ATOM 2 CA ARG A 1 -4.051 -0.963 13.126 1.00 4.21 C ATOM 3 C ARG A 1 -3.288 -0.091 12.147 1.00 2.60 C ATOM 4 O ARG A 1 -3.105 1.086 12.435 1.00 2.85 O ATOM 5 CB ARG A 1 -5.463 -0.386 13.335 1.00 5.56 C ATOM 6 CG ARG A 1 -6.510 -1.479 13.571 1.00 6.84 C ATOM 7 CD ARG A 1 -7.902 -0.836 13.618 1.00 8.01 C ATOM 8 NE ARG A 1 -8.965 -1.832 13.820 1.00 9.26 N ATOM 9 CZ ARG A 1 -10.264 -1.540 13.972 1.00 10.61 C ATOM 10 NH1 ARG A 1 -10.675 -0.271 13.923 1.00 11.08 N ATOM 11 NH2 ARG A 1 -11.151 -2.515 14.172 1.00 11.79 N ATOM 12 H1 ARG A 1 -3.151 -0.053 14.711 1.00 4.81 H ATOM 13 H2 ARG A 1 -3.776 -1.539 15.086 1.00 5.81 H ATOM 14 H3 ARG A 1 -2.376 -1.412 14.218 1.00 4.75 H ATOM 15 HA ARG A 1 -4.136 -1.968 12.710 1.00 4.88 H ATOM 16 HB2 ARG A 1 -5.460 0.310 14.177 1.00 6.32 H ATOM 17 HB3 ARG A 1 -5.757 0.168 12.442 1.00 5.68 H ATOM 18 HG2 ARG A 1 -6.474 -2.195 12.748 1.00 7.16 H ATOM 19 HG3 ARG A 1 -6.307 -1.994 14.511 1.00 7.32 H ATOM 20 HD2 ARG A 1 -7.928 -0.113 14.434 1.00 8.39 H ATOM 21 HD3 ARG A 1 -8.083 -0.314 12.678 1.00 8.09 H ATOM 22 HE ARG A 1 -8.670 -2.798 13.837 1.00 9.33 H ATOM 23 HH11 ARG A 1 -10.010 0.468 13.757 1.00 10.45 H ATOM 24 HH12 ARG A 1 -11.644 -0.014 14.035 1.00 12.27 H ATOM 25 HH21 ARG A 1 -10.867 -3.483 14.212 1.00 11.85 H ATOM 26 HH22 ARG A 1 -12.133 -2.319 14.291 1.00 12.86 H ATOM 27 N LYS A 2 -2.806 -0.663 11.043 1.00 2.04 N ATOM 28 CA LYS A 2 -2.164 0.060 9.954 1.00 0.75 C ATOM 29 C LYS A 2 -1.940 -0.957 8.841 1.00 0.98 C ATOM 30 O LYS A 2 -1.719 -2.129 9.142 1.00 2.50 O ATOM 31 CB LYS A 2 -0.836 0.683 10.432 1.00 1.85 C ATOM 32 CG LYS A 2 -0.901 2.218 10.372 1.00 2.75 C ATOM 33 CD LYS A 2 -0.004 2.896 11.421 1.00 4.24 C ATOM 34 CE LYS A 2 0.840 4.013 10.796 1.00 5.71 C ATOM 35 NZ LYS A 2 2.141 3.510 10.302 1.00 6.92 N ATOM 36 H LYS A 2 -2.917 -1.655 10.864 1.00 3.24 H ATOM 37 HA LYS A 2 -2.841 0.835 9.590 1.00 1.33 H ATOM 38 HB2 LYS A 2 -0.630 0.362 11.453 1.00 2.58 H ATOM 39 HB3 LYS A 2 -0.010 0.343 9.806 1.00 2.81 H ATOM 40 HG2 LYS A 2 -0.618 2.538 9.369 1.00 3.49 H ATOM 41 HG3 LYS A 2 -1.924 2.552 10.551 1.00 2.94 H ATOM 42 HD2 LYS A 2 -0.651 3.335 12.182 1.00 4.60 H ATOM 43 HD3 LYS A 2 0.645 2.171 11.913 1.00 4.84 H ATOM 44 HE2 LYS A 2 0.277 4.465 9.976 1.00 6.03 H ATOM 45 HE3 LYS A 2 1.017 4.783 11.550 1.00 6.27 H ATOM 46 HZ1 LYS A 2 2.634 4.249 9.818 1.00 7.93 H ATOM 47 HZ2 LYS A 2 2.707 3.201 11.081 1.00 7.45 H ATOM 48 HZ3 LYS A 2 1.999 2.739 9.666 1.00 6.74 H ATOM 49 N SER A 3 -2.013 -0.538 7.585 1.00 0.66 N ATOM 50 CA SER A 3 -1.851 -1.429 6.451 1.00 0.53 C ATOM 51 C SER A 3 -1.413 -0.576 5.278 1.00 0.44 C ATOM 52 O SER A 3 -2.066 0.423 4.991 1.00 0.55 O ATOM 53 CB SER A 3 -3.189 -2.108 6.148 1.00 0.67 C ATOM 54 OG SER A 3 -4.227 -1.146 6.143 1.00 2.71 O ATOM 55 H SER A 3 -2.244 0.421 7.356 1.00 1.84 H ATOM 56 HA SER A 3 -1.085 -2.178 6.662 1.00 0.53 H ATOM 57 HB2 SER A 3 -3.137 -2.603 5.177 1.00 1.66 H ATOM 58 HB3 SER A 3 -3.398 -2.853 6.916 1.00 1.77 H ATOM 59 HG SER A 3 -3.981 -0.440 5.530 1.00 3.52 H ATOM 60 N ILE A 4 -0.295 -0.936 4.651 1.00 0.35 N ATOM 61 CA ILE A 4 0.275 -0.150 3.576 1.00 0.30 C ATOM 62 C ILE A 4 -0.322 -0.659 2.261 1.00 0.27 C ATOM 63 O ILE A 4 -1.505 -0.981 2.177 1.00 0.33 O ATOM 64 CB ILE A 4 1.807 -0.215 3.652 1.00 0.34 C ATOM 65 CG1 ILE A 4 2.311 -0.154 5.101 1.00 0.45 C ATOM 66 CG2 ILE A 4 2.467 0.937 2.863 1.00 0.38 C ATOM 67 CD1 ILE A 4 1.717 0.951 5.990 1.00 2.71 C ATOM 68 H ILE A 4 0.206 -1.764 4.931 1.00 0.38 H ATOM 69 HA ILE A 4 0.024 0.894 3.698 1.00 0.33 H ATOM 70 HB ILE A 4 2.140 -1.168 3.238 1.00 0.32 H ATOM 71 HG12 ILE A 4 2.165 -1.120 5.584 1.00 1.59 H ATOM 72 HG13 ILE A 4 3.373 0.012 5.031 1.00 1.81 H ATOM 73 HG21 ILE A 4 1.847 1.275 2.036 1.00 1.38 H ATOM 74 HG22 ILE A 4 2.637 1.799 3.506 1.00 1.29 H ATOM 75 HG23 ILE A 4 3.433 0.607 2.477 1.00 1.45 H ATOM 76 HD11 ILE A 4 2.407 1.160 6.808 1.00 3.53 H ATOM 77 HD12 ILE A 4 1.554 1.867 5.424 1.00 3.94 H ATOM 78 HD13 ILE A 4 0.773 0.628 6.424 1.00 3.28 H ATOM 79 N ASN A 5 0.511 -0.754 1.237 1.00 0.22 N ATOM 80 CA ASN A 5 0.197 -1.275 -0.073 1.00 0.18 C ATOM 81 C ASN A 5 1.037 -2.531 -0.279 1.00 0.19 C ATOM 82 O ASN A 5 2.051 -2.694 0.392 1.00 0.29 O ATOM 83 CB ASN A 5 0.464 -0.168 -1.087 1.00 0.21 C ATOM 84 CG ASN A 5 0.437 -0.698 -2.493 1.00 0.19 C ATOM 85 OD1 ASN A 5 -0.574 -0.650 -3.176 1.00 0.23 O ATOM 86 ND2 ASN A 5 1.561 -1.234 -2.915 1.00 0.19 N ATOM 87 H ASN A 5 1.486 -0.572 1.401 1.00 0.24 H ATOM 88 HA ASN A 5 -0.844 -1.556 -0.167 1.00 0.19 H ATOM 89 HB2 ASN A 5 -0.311 0.586 -1.002 1.00 0.26 H ATOM 90 HB3 ASN A 5 1.432 0.295 -0.895 1.00 0.27 H ATOM 91 HD21 ASN A 5 2.325 -1.373 -2.269 1.00 0.21 H ATOM 92 HD22 ASN A 5 1.653 -1.492 -3.877 1.00 0.21 H ATOM 93 N ILE A 6 0.597 -3.398 -1.194 1.00 0.16 N ATOM 94 CA ILE A 6 1.287 -4.603 -1.628 1.00 0.19 C ATOM 95 C ILE A 6 2.566 -4.191 -2.374 1.00 0.20 C ATOM 96 O ILE A 6 3.509 -3.685 -1.776 1.00 0.43 O ATOM 97 CB ILE A 6 0.298 -5.448 -2.469 1.00 0.23 C ATOM 98 CG1 ILE A 6 -0.968 -5.805 -1.662 1.00 0.32 C ATOM 99 CG2 ILE A 6 0.935 -6.751 -2.991 1.00 0.28 C ATOM 100 CD1 ILE A 6 -2.161 -6.020 -2.601 1.00 1.36 C ATOM 101 H ILE A 6 -0.257 -3.175 -1.684 1.00 0.17 H ATOM 102 HA ILE A 6 1.584 -5.177 -0.751 1.00 0.25 H ATOM 103 HB ILE A 6 -0.023 -4.848 -3.323 1.00 0.22 H ATOM 104 HG12 ILE A 6 -0.788 -6.701 -1.071 1.00 0.98 H ATOM 105 HG13 ILE A 6 -1.238 -5.005 -0.975 1.00 1.02 H ATOM 106 HG21 ILE A 6 1.772 -7.043 -2.355 1.00 1.51 H ATOM 107 HG22 ILE A 6 0.207 -7.561 -2.994 1.00 1.48 H ATOM 108 HG23 ILE A 6 1.284 -6.627 -4.016 1.00 1.51 H ATOM 109 HD11 ILE A 6 -3.033 -6.315 -2.019 1.00 2.08 H ATOM 110 HD12 ILE A 6 -2.387 -5.090 -3.124 1.00 2.33 H ATOM 111 HD13 ILE A 6 -1.939 -6.796 -3.333 1.00 2.31 H ATOM 112 N GLY A 7 2.605 -4.363 -3.693 1.00 0.18 N ATOM 113 CA GLY A 7 3.748 -4.009 -4.516 1.00 0.17 C ATOM 114 C GLY A 7 3.323 -2.908 -5.474 1.00 0.13 C ATOM 115 O GLY A 7 3.464 -1.732 -5.147 1.00 0.15 O ATOM 116 H GLY A 7 1.793 -4.739 -4.150 1.00 0.34 H ATOM 117 HA2 GLY A 7 4.569 -3.640 -3.900 1.00 0.20 H ATOM 118 HA3 GLY A 7 4.096 -4.883 -5.065 1.00 0.22 H ATOM 119 N PRO A 8 2.759 -3.261 -6.633 1.00 0.16 N ATOM 120 CA PRO A 8 2.363 -2.294 -7.642 1.00 0.21 C ATOM 121 C PRO A 8 1.134 -1.510 -7.171 1.00 0.20 C ATOM 122 O PRO A 8 0.002 -1.882 -7.464 1.00 0.24 O ATOM 123 CB PRO A 8 2.103 -3.131 -8.899 1.00 0.28 C ATOM 124 CG PRO A 8 1.653 -4.484 -8.345 1.00 0.26 C ATOM 125 CD PRO A 8 2.458 -4.619 -7.053 1.00 0.21 C ATOM 126 HA PRO A 8 3.180 -1.598 -7.835 1.00 0.25 H ATOM 127 HB2 PRO A 8 1.351 -2.686 -9.552 1.00 0.33 H ATOM 128 HB3 PRO A 8 3.040 -3.263 -9.440 1.00 0.32 H ATOM 129 HG2 PRO A 8 0.588 -4.453 -8.113 1.00 0.27 H ATOM 130 HG3 PRO A 8 1.870 -5.297 -9.039 1.00 0.30 H ATOM 131 HD2 PRO A 8 1.868 -5.144 -6.300 1.00 0.22 H ATOM 132 HD3 PRO A 8 3.386 -5.156 -7.250 1.00 0.25 H ATOM 133 N GLY A 9 1.355 -0.418 -6.438 1.00 0.19 N ATOM 134 CA GLY A 9 0.301 0.451 -5.948 1.00 0.21 C ATOM 135 C GLY A 9 0.879 1.469 -4.971 1.00 0.24 C ATOM 136 O GLY A 9 2.092 1.682 -4.924 1.00 0.43 O ATOM 137 H GLY A 9 2.300 -0.192 -6.142 1.00 0.19 H ATOM 138 HA2 GLY A 9 -0.157 0.980 -6.782 1.00 0.28 H ATOM 139 HA3 GLY A 9 -0.466 -0.144 -5.449 1.00 0.19 H ATOM 140 N ARG A 10 0.011 2.112 -4.190 1.00 0.20 N ATOM 141 CA ARG A 10 0.407 2.960 -3.075 1.00 0.21 C ATOM 142 C ARG A 10 -0.779 3.065 -2.129 1.00 0.19 C ATOM 143 O ARG A 10 -1.893 2.714 -2.509 1.00 0.21 O ATOM 144 CB ARG A 10 0.861 4.340 -3.581 1.00 0.38 C ATOM 145 CG ARG A 10 2.270 4.631 -3.060 1.00 1.85 C ATOM 146 CD ARG A 10 2.865 5.851 -3.770 1.00 2.10 C ATOM 147 NE ARG A 10 4.317 5.939 -3.561 1.00 3.38 N ATOM 148 CZ ARG A 10 5.228 5.183 -4.190 1.00 4.17 C ATOM 149 NH1 ARG A 10 4.846 4.234 -5.049 1.00 4.45 N ATOM 150 NH2 ARG A 10 6.527 5.376 -3.956 1.00 5.50 N ATOM 151 H ARG A 10 -0.972 1.869 -4.228 1.00 0.26 H ATOM 152 HA ARG A 10 1.224 2.465 -2.549 1.00 0.23 H ATOM 153 HB2 ARG A 10 0.882 4.342 -4.673 1.00 1.62 H ATOM 154 HB3 ARG A 10 0.174 5.121 -3.251 1.00 1.33 H ATOM 155 HG2 ARG A 10 2.237 4.811 -1.984 1.00 2.94 H ATOM 156 HG3 ARG A 10 2.899 3.763 -3.249 1.00 2.97 H ATOM 157 HD2 ARG A 10 2.661 5.792 -4.840 1.00 2.58 H ATOM 158 HD3 ARG A 10 2.387 6.753 -3.386 1.00 2.24 H ATOM 159 HE ARG A 10 4.618 6.640 -2.900 1.00 4.29 H ATOM 160 HH11 ARG A 10 3.864 4.034 -5.186 1.00 4.10 H ATOM 161 HH12 ARG A 10 5.505 3.651 -5.541 1.00 5.57 H ATOM 162 HH21 ARG A 10 6.840 6.081 -3.304 1.00 6.08 H ATOM 163 HH22 ARG A 10 7.234 4.821 -4.413 1.00 6.27 H ATOM 164 N ALA A 11 -0.548 3.534 -0.906 1.00 0.22 N ATOM 165 CA ALA A 11 -1.594 3.658 0.087 1.00 0.24 C ATOM 166 C ALA A 11 -1.333 4.913 0.899 1.00 0.30 C ATOM 167 O ALA A 11 -0.174 5.239 1.151 1.00 0.55 O ATOM 168 CB ALA A 11 -1.573 2.447 1.016 1.00 0.29 C ATOM 169 H ALA A 11 0.360 3.882 -0.627 1.00 0.28 H ATOM 170 HA ALA A 11 -2.561 3.725 -0.412 1.00 0.24 H ATOM 171 HB1 ALA A 11 -2.261 2.617 1.845 1.00 1.58 H ATOM 172 HB2 ALA A 11 -1.881 1.556 0.470 1.00 1.60 H ATOM 173 HB3 ALA A 11 -0.567 2.316 1.413 1.00 1.63 H ATOM 174 N PHE A 12 -2.403 5.584 1.320 1.00 0.40 N ATOM 175 CA PHE A 12 -2.329 6.786 2.129 1.00 0.39 C ATOM 176 C PHE A 12 -3.567 6.833 3.022 1.00 0.84 C ATOM 177 O PHE A 12 -4.437 7.681 2.850 1.00 1.22 O ATOM 178 CB PHE A 12 -2.248 8.013 1.216 1.00 0.84 C ATOM 179 CG PHE A 12 -0.956 8.119 0.429 1.00 1.42 C ATOM 180 CD1 PHE A 12 0.240 8.432 1.099 1.00 2.59 C ATOM 181 CD2 PHE A 12 -0.941 7.906 -0.961 1.00 2.05 C ATOM 182 CE1 PHE A 12 1.436 8.584 0.379 1.00 3.24 C ATOM 183 CE2 PHE A 12 0.254 8.072 -1.687 1.00 2.55 C ATOM 184 CZ PHE A 12 1.440 8.421 -1.017 1.00 2.85 C ATOM 185 H PHE A 12 -3.329 5.248 1.100 1.00 0.63 H ATOM 186 HA PHE A 12 -1.441 6.746 2.760 1.00 0.50 H ATOM 187 HB2 PHE A 12 -3.094 7.991 0.529 1.00 1.24 H ATOM 188 HB3 PHE A 12 -2.342 8.912 1.825 1.00 0.73 H ATOM 189 HD1 PHE A 12 0.235 8.548 2.173 1.00 3.36 H ATOM 190 HD2 PHE A 12 -1.849 7.618 -1.469 1.00 2.81 H ATOM 191 HE1 PHE A 12 2.349 8.835 0.901 1.00 4.36 H ATOM 192 HE2 PHE A 12 0.253 7.942 -2.759 1.00 3.31 H ATOM 193 HZ PHE A 12 2.357 8.564 -1.570 1.00 3.42 H ATOM 194 N TYR A 13 -3.641 5.888 3.957 1.00 1.24 N ATOM 195 CA TYR A 13 -4.711 5.743 4.932 1.00 1.82 C ATOM 196 C TYR A 13 -4.089 5.184 6.211 1.00 2.28 C ATOM 197 O TYR A 13 -4.778 5.233 7.251 1.00 3.28 O ATOM 198 CB TYR A 13 -5.788 4.786 4.405 1.00 2.43 C ATOM 199 CG TYR A 13 -6.521 5.252 3.160 1.00 2.54 C ATOM 200 CD1 TYR A 13 -7.457 6.298 3.250 1.00 3.66 C ATOM 201 CD2 TYR A 13 -6.293 4.621 1.921 1.00 2.82 C ATOM 202 CE1 TYR A 13 -8.181 6.706 2.114 1.00 4.52 C ATOM 203 CE2 TYR A 13 -7.009 5.025 0.779 1.00 3.51 C ATOM 204 CZ TYR A 13 -7.962 6.064 0.874 1.00 4.22 C ATOM 205 OH TYR A 13 -8.672 6.425 -0.232 1.00 5.31 O ATOM 206 OXT TYR A 13 -2.935 4.705 6.115 1.00 3.02 O ATOM 207 H TYR A 13 -2.862 5.264 4.128 1.00 1.35 H ATOM 208 HA TYR A 13 -5.152 6.715 5.149 1.00 1.75 H ATOM 209 HB2 TYR A 13 -5.328 3.815 4.213 1.00 2.89 H ATOM 210 HB3 TYR A 13 -6.527 4.640 5.194 1.00 3.15 H ATOM 211 HD1 TYR A 13 -7.618 6.788 4.199 1.00 4.35 H ATOM 212 HD2 TYR A 13 -5.582 3.811 1.851 1.00 3.33 H ATOM 213 HE1 TYR A 13 -8.898 7.508 2.205 1.00 5.74 H ATOM 214 HE2 TYR A 13 -6.850 4.537 -0.170 1.00 4.13 H ATOM 215 HH TYR A 13 -9.347 7.082 -0.056 1.00 5.98 H TER 216 TYR A 13 ENDMDL MODEL 14 ATOM 1 N ARG A 1 -6.806 1.740 10.818 1.00 5.76 N ATOM 2 CA ARG A 1 -6.555 0.940 9.603 1.00 5.39 C ATOM 3 C ARG A 1 -5.261 0.141 9.738 1.00 3.54 C ATOM 4 O ARG A 1 -5.334 -1.066 9.920 1.00 3.86 O ATOM 5 CB ARG A 1 -6.554 1.780 8.316 1.00 6.71 C ATOM 6 CG ARG A 1 -7.941 2.291 7.901 1.00 8.16 C ATOM 7 CD ARG A 1 -8.107 2.167 6.379 1.00 9.81 C ATOM 8 NE ARG A 1 -9.287 2.901 5.897 1.00 11.45 N ATOM 9 CZ ARG A 1 -9.298 4.167 5.456 1.00 12.73 C ATOM 10 NH1 ARG A 1 -8.172 4.883 5.419 1.00 12.79 N ATOM 11 NH2 ARG A 1 -10.443 4.722 5.055 1.00 14.20 N ATOM 12 H1 ARG A 1 -6.077 2.429 10.942 1.00 5.69 H ATOM 13 H2 ARG A 1 -7.699 2.209 10.749 1.00 7.09 H ATOM 14 H3 ARG A 1 -6.816 1.127 11.624 1.00 5.29 H ATOM 15 HA ARG A 1 -7.354 0.202 9.511 1.00 6.18 H ATOM 16 HB2 ARG A 1 -5.890 2.637 8.430 1.00 7.15 H ATOM 17 HB3 ARG A 1 -6.172 1.147 7.517 1.00 6.73 H ATOM 18 HG2 ARG A 1 -8.720 1.705 8.390 1.00 8.42 H ATOM 19 HG3 ARG A 1 -8.042 3.336 8.200 1.00 8.31 H ATOM 20 HD2 ARG A 1 -7.209 2.525 5.876 1.00 9.96 H ATOM 21 HD3 ARG A 1 -8.225 1.112 6.128 1.00 10.04 H ATOM 22 HE ARG A 1 -10.145 2.368 5.884 1.00 11.82 H ATOM 23 HH11 ARG A 1 -7.293 4.464 5.681 1.00 11.83 H ATOM 24 HH12 ARG A 1 -8.150 5.837 5.091 1.00 13.98 H ATOM 25 HH21 ARG A 1 -11.310 4.204 5.066 1.00 14.45 H ATOM 26 HH22 ARG A 1 -10.480 5.672 4.717 1.00 15.24 H ATOM 27 N LYS A 2 -4.096 0.802 9.684 1.00 2.36 N ATOM 28 CA LYS A 2 -2.795 0.162 9.480 1.00 0.87 C ATOM 29 C LYS A 2 -2.757 -0.587 8.135 1.00 1.12 C ATOM 30 O LYS A 2 -3.742 -0.592 7.397 1.00 2.96 O ATOM 31 CB LYS A 2 -2.456 -0.733 10.688 1.00 2.29 C ATOM 32 CG LYS A 2 -0.948 -0.893 10.956 1.00 3.27 C ATOM 33 CD LYS A 2 -0.540 -2.373 10.997 1.00 5.08 C ATOM 34 CE LYS A 2 0.914 -2.551 11.453 1.00 6.41 C ATOM 35 NZ LYS A 2 1.899 -2.109 10.440 1.00 7.37 N ATOM 36 H LYS A 2 -4.095 1.805 9.586 1.00 3.26 H ATOM 37 HA LYS A 2 -2.054 0.961 9.428 1.00 1.34 H ATOM 38 HB2 LYS A 2 -2.900 -0.296 11.585 1.00 2.92 H ATOM 39 HB3 LYS A 2 -2.914 -1.713 10.545 1.00 3.46 H ATOM 40 HG2 LYS A 2 -0.363 -0.363 10.205 1.00 3.49 H ATOM 41 HG3 LYS A 2 -0.720 -0.445 11.925 1.00 3.72 H ATOM 42 HD2 LYS A 2 -1.182 -2.888 11.714 1.00 5.49 H ATOM 43 HD3 LYS A 2 -0.686 -2.834 10.019 1.00 5.79 H ATOM 44 HE2 LYS A 2 1.062 -1.989 12.378 1.00 6.46 H ATOM 45 HE3 LYS A 2 1.079 -3.609 11.672 1.00 7.38 H ATOM 46 HZ1 LYS A 2 2.835 -2.223 10.805 1.00 8.23 H ATOM 47 HZ2 LYS A 2 1.816 -2.671 9.603 1.00 8.16 H ATOM 48 HZ3 LYS A 2 1.764 -1.134 10.213 1.00 6.97 H ATOM 49 N SER A 3 -1.606 -1.200 7.839 1.00 0.83 N ATOM 50 CA SER A 3 -1.289 -1.924 6.613 1.00 0.85 C ATOM 51 C SER A 3 -1.109 -0.964 5.443 1.00 0.61 C ATOM 52 O SER A 3 -1.951 -0.107 5.213 1.00 0.68 O ATOM 53 CB SER A 3 -2.344 -2.989 6.308 1.00 1.18 C ATOM 54 OG SER A 3 -1.681 -4.153 5.863 1.00 2.42 O ATOM 55 H SER A 3 -0.847 -1.097 8.486 1.00 2.28 H ATOM 56 HA SER A 3 -0.334 -2.427 6.768 1.00 0.94 H ATOM 57 HB2 SER A 3 -2.910 -3.230 7.208 1.00 1.93 H ATOM 58 HB3 SER A 3 -3.028 -2.628 5.537 1.00 1.08 H ATOM 59 HG SER A 3 -2.336 -4.774 5.532 1.00 2.69 H ATOM 60 N ILE A 4 0.015 -1.078 4.735 1.00 0.52 N ATOM 61 CA ILE A 4 0.327 -0.200 3.623 1.00 0.31 C ATOM 62 C ILE A 4 -0.245 -0.835 2.349 1.00 0.29 C ATOM 63 O ILE A 4 -1.324 -1.422 2.357 1.00 0.53 O ATOM 64 CB ILE A 4 1.836 0.070 3.577 1.00 0.54 C ATOM 65 CG1 ILE A 4 2.457 0.184 4.975 1.00 0.74 C ATOM 66 CG2 ILE A 4 2.147 1.375 2.806 1.00 0.65 C ATOM 67 CD1 ILE A 4 1.732 1.082 5.989 1.00 2.84 C ATOM 68 H ILE A 4 0.685 -1.801 4.944 1.00 0.70 H ATOM 69 HA ILE A 4 -0.128 0.769 3.773 1.00 0.29 H ATOM 70 HB ILE A 4 2.328 -0.771 3.086 1.00 0.64 H ATOM 71 HG12 ILE A 4 2.585 -0.811 5.403 1.00 1.11 H ATOM 72 HG13 ILE A 4 3.439 0.592 4.817 1.00 2.02 H ATOM 73 HG21 ILE A 4 1.535 1.493 1.914 1.00 1.58 H ATOM 74 HG22 ILE A 4 1.959 2.247 3.431 1.00 1.72 H ATOM 75 HG23 ILE A 4 3.197 1.385 2.511 1.00 1.28 H ATOM 76 HD11 ILE A 4 2.455 1.457 6.714 1.00 3.77 H ATOM 77 HD12 ILE A 4 1.259 1.928 5.495 1.00 4.07 H ATOM 78 HD13 ILE A 4 0.977 0.516 6.531 1.00 3.15 H ATOM 79 N ASN A 5 0.491 -0.731 1.251 1.00 0.22 N ATOM 80 CA ASN A 5 0.204 -1.350 -0.025 1.00 0.17 C ATOM 81 C ASN A 5 1.162 -2.524 -0.207 1.00 0.28 C ATOM 82 O ASN A 5 2.197 -2.572 0.450 1.00 0.46 O ATOM 83 CB ASN A 5 0.318 -0.271 -1.099 1.00 0.27 C ATOM 84 CG ASN A 5 0.300 -0.871 -2.477 1.00 0.29 C ATOM 85 OD1 ASN A 5 -0.736 -0.983 -3.113 1.00 0.45 O ATOM 86 ND2 ASN A 5 1.461 -1.294 -2.926 1.00 0.22 N ATOM 87 H ASN A 5 1.414 -0.342 1.336 1.00 0.39 H ATOM 88 HA ASN A 5 -0.802 -1.741 -0.074 1.00 0.28 H ATOM 89 HB2 ASN A 5 -0.534 0.399 -1.031 1.00 0.42 H ATOM 90 HB3 ASN A 5 1.235 0.303 -0.969 1.00 0.38 H ATOM 91 HD21 ASN A 5 2.263 -1.308 -2.312 1.00 0.26 H ATOM 92 HD22 ASN A 5 1.549 -1.554 -3.888 1.00 0.26 H ATOM 93 N ILE A 6 0.791 -3.454 -1.092 1.00 0.33 N ATOM 94 CA ILE A 6 1.602 -4.569 -1.563 1.00 0.43 C ATOM 95 C ILE A 6 2.777 -3.999 -2.379 1.00 0.37 C ATOM 96 O ILE A 6 3.633 -3.302 -1.845 1.00 0.48 O ATOM 97 CB ILE A 6 0.677 -5.516 -2.367 1.00 0.51 C ATOM 98 CG1 ILE A 6 -0.513 -6.013 -1.521 1.00 0.70 C ATOM 99 CG2 ILE A 6 1.424 -6.736 -2.948 1.00 0.62 C ATOM 100 CD1 ILE A 6 -1.700 -6.349 -2.429 1.00 1.32 C ATOM 101 H ILE A 6 -0.092 -3.328 -1.562 1.00 0.36 H ATOM 102 HA ILE A 6 2.008 -5.103 -0.704 1.00 0.55 H ATOM 103 HB ILE A 6 0.262 -4.941 -3.196 1.00 0.42 H ATOM 104 HG12 ILE A 6 -0.220 -6.889 -0.945 1.00 1.38 H ATOM 105 HG13 ILE A 6 -0.846 -5.256 -0.813 1.00 1.19 H ATOM 106 HG21 ILE A 6 2.446 -6.781 -2.568 1.00 1.81 H ATOM 107 HG22 ILE A 6 0.925 -7.666 -2.676 1.00 1.20 H ATOM 108 HG23 ILE A 6 1.442 -6.687 -4.036 1.00 1.56 H ATOM 109 HD11 ILE A 6 -2.117 -5.426 -2.836 1.00 2.01 H ATOM 110 HD12 ILE A 6 -1.383 -6.989 -3.252 1.00 2.23 H ATOM 111 HD13 ILE A 6 -2.471 -6.859 -1.851 1.00 2.22 H ATOM 112 N GLY A 7 2.818 -4.251 -3.688 1.00 0.31 N ATOM 113 CA GLY A 7 3.885 -3.794 -4.564 1.00 0.31 C ATOM 114 C GLY A 7 3.319 -2.781 -5.547 1.00 0.19 C ATOM 115 O GLY A 7 3.426 -1.583 -5.308 1.00 0.31 O ATOM 116 H GLY A 7 2.071 -4.781 -4.103 1.00 0.36 H ATOM 117 HA2 GLY A 7 4.677 -3.316 -3.987 1.00 0.44 H ATOM 118 HA3 GLY A 7 4.312 -4.641 -5.100 1.00 0.36 H ATOM 119 N PRO A 8 2.680 -3.233 -6.633 1.00 0.19 N ATOM 120 CA PRO A 8 2.141 -2.353 -7.655 1.00 0.38 C ATOM 121 C PRO A 8 0.884 -1.647 -7.136 1.00 0.42 C ATOM 122 O PRO A 8 -0.236 -2.083 -7.386 1.00 0.48 O ATOM 123 CB PRO A 8 1.871 -3.266 -8.855 1.00 0.49 C ATOM 124 CG PRO A 8 1.561 -4.618 -8.212 1.00 0.42 C ATOM 125 CD PRO A 8 2.438 -4.628 -6.958 1.00 0.26 C ATOM 126 HA PRO A 8 2.882 -1.602 -7.935 1.00 0.47 H ATOM 127 HB2 PRO A 8 1.048 -2.911 -9.478 1.00 0.63 H ATOM 128 HB3 PRO A 8 2.781 -3.354 -9.449 1.00 0.50 H ATOM 129 HG2 PRO A 8 0.510 -4.658 -7.924 1.00 0.50 H ATOM 130 HG3 PRO A 8 1.806 -5.447 -8.877 1.00 0.48 H ATOM 131 HD2 PRO A 8 1.916 -5.136 -6.147 1.00 0.30 H ATOM 132 HD3 PRO A 8 3.384 -5.124 -7.172 1.00 0.28 H ATOM 133 N GLY A 9 1.075 -0.547 -6.410 1.00 0.42 N ATOM 134 CA GLY A 9 0.013 0.272 -5.852 1.00 0.44 C ATOM 135 C GLY A 9 0.621 1.256 -4.861 1.00 0.40 C ATOM 136 O GLY A 9 1.840 1.307 -4.702 1.00 0.45 O ATOM 137 H GLY A 9 2.020 -0.274 -6.157 1.00 0.41 H ATOM 138 HA2 GLY A 9 -0.479 0.825 -6.650 1.00 0.51 H ATOM 139 HA3 GLY A 9 -0.726 -0.353 -5.353 1.00 0.42 H ATOM 140 N ARG A 10 -0.215 2.059 -4.205 1.00 0.37 N ATOM 141 CA ARG A 10 0.199 3.068 -3.235 1.00 0.41 C ATOM 142 C ARG A 10 -0.861 3.096 -2.142 1.00 0.22 C ATOM 143 O ARG A 10 -1.939 2.534 -2.326 1.00 0.30 O ATOM 144 CB ARG A 10 0.328 4.438 -3.922 1.00 0.80 C ATOM 145 CG ARG A 10 1.640 4.552 -4.711 1.00 1.59 C ATOM 146 CD ARG A 10 1.616 5.710 -5.718 1.00 2.53 C ATOM 147 NE ARG A 10 2.541 6.797 -5.365 1.00 2.93 N ATOM 148 CZ ARG A 10 3.875 6.748 -5.490 1.00 3.49 C ATOM 149 NH1 ARG A 10 4.476 5.616 -5.860 1.00 3.92 N ATOM 150 NH2 ARG A 10 4.605 7.837 -5.244 1.00 4.61 N ATOM 151 H ARG A 10 -1.214 1.902 -4.277 1.00 0.39 H ATOM 152 HA ARG A 10 1.154 2.781 -2.793 1.00 0.50 H ATOM 153 HB2 ARG A 10 -0.523 4.575 -4.591 1.00 1.81 H ATOM 154 HB3 ARG A 10 0.306 5.233 -3.175 1.00 1.30 H ATOM 155 HG2 ARG A 10 2.469 4.664 -4.010 1.00 2.10 H ATOM 156 HG3 ARG A 10 1.801 3.644 -5.284 1.00 2.63 H ATOM 157 HD2 ARG A 10 1.882 5.323 -6.703 1.00 3.53 H ATOM 158 HD3 ARG A 10 0.604 6.111 -5.788 1.00 3.37 H ATOM 159 HE ARG A 10 2.098 7.654 -5.068 1.00 3.70 H ATOM 160 HH11 ARG A 10 3.925 4.788 -6.027 1.00 3.98 H ATOM 161 HH12 ARG A 10 5.477 5.544 -5.963 1.00 4.81 H ATOM 162 HH21 ARG A 10 4.169 8.705 -4.972 1.00 5.25 H ATOM 163 HH22 ARG A 10 5.610 7.832 -5.332 1.00 5.26 H ATOM 164 N ALA A 11 -0.565 3.733 -1.012 1.00 0.38 N ATOM 165 CA ALA A 11 -1.483 3.802 0.106 1.00 0.33 C ATOM 166 C ALA A 11 -1.413 5.189 0.729 1.00 0.52 C ATOM 167 O ALA A 11 -0.630 6.023 0.279 1.00 1.38 O ATOM 168 CB ALA A 11 -1.086 2.743 1.133 1.00 0.72 C ATOM 169 H ALA A 11 0.299 4.241 -0.894 1.00 0.64 H ATOM 170 HA ALA A 11 -2.497 3.616 -0.248 1.00 0.24 H ATOM 171 HB1 ALA A 11 -0.198 3.080 1.671 1.00 1.95 H ATOM 172 HB2 ALA A 11 -1.906 2.594 1.824 1.00 1.24 H ATOM 173 HB3 ALA A 11 -0.884 1.797 0.641 1.00 1.43 H ATOM 174 N PHE A 12 -2.191 5.417 1.790 1.00 0.46 N ATOM 175 CA PHE A 12 -2.242 6.703 2.464 1.00 0.34 C ATOM 176 C PHE A 12 -2.137 6.462 3.967 1.00 1.62 C ATOM 177 O PHE A 12 -3.149 6.282 4.643 1.00 2.33 O ATOM 178 CB PHE A 12 -3.531 7.439 2.078 1.00 1.40 C ATOM 179 CG PHE A 12 -3.840 7.390 0.595 1.00 2.77 C ATOM 180 CD1 PHE A 12 -3.090 8.159 -0.310 1.00 2.78 C ATOM 181 CD2 PHE A 12 -4.846 6.528 0.117 1.00 4.83 C ATOM 182 CE1 PHE A 12 -3.375 8.101 -1.686 1.00 4.19 C ATOM 183 CE2 PHE A 12 -5.129 6.467 -1.256 1.00 6.29 C ATOM 184 CZ PHE A 12 -4.399 7.262 -2.159 1.00 5.81 C ATOM 185 H PHE A 12 -2.803 4.696 2.142 1.00 1.12 H ATOM 186 HA PHE A 12 -1.394 7.306 2.141 1.00 1.06 H ATOM 187 HB2 PHE A 12 -4.374 7.001 2.615 1.00 2.32 H ATOM 188 HB3 PHE A 12 -3.449 8.480 2.393 1.00 1.08 H ATOM 189 HD1 PHE A 12 -2.285 8.781 0.051 1.00 2.67 H ATOM 190 HD2 PHE A 12 -5.394 5.903 0.808 1.00 5.51 H ATOM 191 HE1 PHE A 12 -2.803 8.699 -2.381 1.00 4.48 H ATOM 192 HE2 PHE A 12 -5.907 5.811 -1.620 1.00 7.97 H ATOM 193 HZ PHE A 12 -4.621 7.219 -3.216 1.00 7.01 H ATOM 194 N TYR A 13 -0.903 6.394 4.465 1.00 2.74 N ATOM 195 CA TYR A 13 -0.570 6.109 5.851 1.00 4.08 C ATOM 196 C TYR A 13 0.657 6.927 6.216 1.00 5.00 C ATOM 197 O TYR A 13 0.886 7.087 7.432 1.00 4.97 O ATOM 198 CB TYR A 13 -0.262 4.620 6.021 1.00 5.35 C ATOM 199 CG TYR A 13 -1.472 3.733 5.838 1.00 5.06 C ATOM 200 CD1 TYR A 13 -1.870 3.337 4.550 1.00 4.95 C ATOM 201 CD2 TYR A 13 -2.214 3.334 6.959 1.00 5.58 C ATOM 202 CE1 TYR A 13 -3.018 2.544 4.370 1.00 4.93 C ATOM 203 CE2 TYR A 13 -3.338 2.516 6.786 1.00 5.90 C ATOM 204 CZ TYR A 13 -3.739 2.109 5.499 1.00 5.41 C ATOM 205 OH TYR A 13 -4.766 1.228 5.367 1.00 6.05 O ATOM 206 OXT TYR A 13 1.346 7.349 5.259 1.00 6.38 O ATOM 207 H TYR A 13 -0.089 6.585 3.892 1.00 3.03 H ATOM 208 HA TYR A 13 -1.393 6.396 6.506 1.00 3.86 H ATOM 209 HB2 TYR A 13 0.512 4.334 5.307 1.00 5.95 H ATOM 210 HB3 TYR A 13 0.144 4.461 7.020 1.00 6.37 H ATOM 211 HD1 TYR A 13 -1.278 3.661 3.712 1.00 5.37 H ATOM 212 HD2 TYR A 13 -1.909 3.657 7.944 1.00 6.15 H ATOM 213 HE1 TYR A 13 -3.336 2.205 3.398 1.00 5.09 H ATOM 214 HE2 TYR A 13 -3.892 2.175 7.630 1.00 6.84 H ATOM 215 HH TYR A 13 -4.455 0.374 5.701 1.00 7.08 H TER 216 TYR A 13 ENDMDL MODEL 15 ATOM 1 N ARG A 1 -1.982 -2.961 12.900 1.00 5.30 N ATOM 2 CA ARG A 1 -2.018 -1.542 13.318 1.00 4.45 C ATOM 3 C ARG A 1 -2.459 -0.667 12.150 1.00 2.70 C ATOM 4 O ARG A 1 -3.543 -0.103 12.187 1.00 2.71 O ATOM 5 CB ARG A 1 -0.678 -1.074 13.913 1.00 5.69 C ATOM 6 CG ARG A 1 -0.918 -0.081 15.056 1.00 6.84 C ATOM 7 CD ARG A 1 0.394 0.609 15.452 1.00 8.18 C ATOM 8 NE ARG A 1 0.373 1.074 16.847 1.00 9.58 N ATOM 9 CZ ARG A 1 1.333 1.806 17.429 1.00 11.09 C ATOM 10 NH1 ARG A 1 2.342 2.289 16.705 1.00 11.45 N ATOM 11 NH2 ARG A 1 1.286 2.048 18.740 1.00 12.51 N ATOM 12 H1 ARG A 1 -1.284 -3.099 12.183 1.00 5.42 H ATOM 13 H2 ARG A 1 -1.765 -3.548 13.695 1.00 6.46 H ATOM 14 H3 ARG A 1 -2.886 -3.226 12.533 1.00 5.29 H ATOM 15 HA ARG A 1 -2.782 -1.447 14.091 1.00 5.09 H ATOM 16 HB2 ARG A 1 -0.134 -1.930 14.314 1.00 6.47 H ATOM 17 HB3 ARG A 1 -0.059 -0.606 13.146 1.00 5.63 H ATOM 18 HG2 ARG A 1 -1.643 0.678 14.754 1.00 6.59 H ATOM 19 HG3 ARG A 1 -1.319 -0.631 15.909 1.00 7.57 H ATOM 20 HD2 ARG A 1 1.218 -0.098 15.339 1.00 8.75 H ATOM 21 HD3 ARG A 1 0.560 1.454 14.781 1.00 8.04 H ATOM 22 HE ARG A 1 -0.402 0.749 17.408 1.00 9.65 H ATOM 23 HH11 ARG A 1 2.375 2.121 15.711 1.00 10.63 H ATOM 24 HH12 ARG A 1 3.079 2.845 17.111 1.00 12.72 H ATOM 25 HH21 ARG A 1 0.543 1.679 19.317 1.00 12.55 H ATOM 26 HH22 ARG A 1 2.001 2.589 19.204 1.00 13.76 H ATOM 27 N LYS A 2 -1.647 -0.596 11.094 1.00 2.10 N ATOM 28 CA LYS A 2 -1.956 0.093 9.853 1.00 0.71 C ATOM 29 C LYS A 2 -1.615 -0.900 8.751 1.00 0.95 C ATOM 30 O LYS A 2 -0.732 -1.731 8.956 1.00 2.35 O ATOM 31 CB LYS A 2 -1.105 1.374 9.761 1.00 1.79 C ATOM 32 CG LYS A 2 -1.926 2.659 9.926 1.00 2.87 C ATOM 33 CD LYS A 2 -2.655 3.064 8.637 1.00 4.58 C ATOM 34 CE LYS A 2 -4.162 2.811 8.724 1.00 5.70 C ATOM 35 NZ LYS A 2 -4.826 3.254 7.485 1.00 7.53 N ATOM 36 H LYS A 2 -0.769 -1.099 11.056 1.00 3.24 H ATOM 37 HA LYS A 2 -3.019 0.334 9.814 1.00 1.44 H ATOM 38 HB2 LYS A 2 -0.344 1.356 10.544 1.00 2.44 H ATOM 39 HB3 LYS A 2 -0.572 1.409 8.809 1.00 2.78 H ATOM 40 HG2 LYS A 2 -2.636 2.550 10.747 1.00 3.23 H ATOM 41 HG3 LYS A 2 -1.237 3.463 10.187 1.00 3.49 H ATOM 42 HD2 LYS A 2 -2.495 4.131 8.469 1.00 5.45 H ATOM 43 HD3 LYS A 2 -2.241 2.528 7.783 1.00 5.12 H ATOM 44 HE2 LYS A 2 -4.353 1.752 8.893 1.00 5.67 H ATOM 45 HE3 LYS A 2 -4.568 3.382 9.561 1.00 5.85 H ATOM 46 HZ1 LYS A 2 -4.716 4.260 7.385 1.00 8.15 H ATOM 47 HZ2 LYS A 2 -4.387 2.889 6.650 1.00 8.11 H ATOM 48 HZ3 LYS A 2 -5.820 3.085 7.477 1.00 8.19 H ATOM 49 N SER A 3 -2.312 -0.838 7.620 1.00 0.54 N ATOM 50 CA SER A 3 -1.995 -1.649 6.461 1.00 0.47 C ATOM 51 C SER A 3 -1.551 -0.680 5.380 1.00 0.42 C ATOM 52 O SER A 3 -2.114 0.410 5.272 1.00 0.53 O ATOM 53 CB SER A 3 -3.221 -2.460 6.024 1.00 0.54 C ATOM 54 OG SER A 3 -2.807 -3.695 5.480 1.00 1.70 O ATOM 55 H SER A 3 -2.985 -0.105 7.461 1.00 1.61 H ATOM 56 HA SER A 3 -1.177 -2.332 6.692 1.00 0.50 H ATOM 57 HB2 SER A 3 -3.867 -2.654 6.881 1.00 1.39 H ATOM 58 HB3 SER A 3 -3.784 -1.901 5.275 1.00 1.25 H ATOM 59 HG SER A 3 -2.718 -4.340 6.188 1.00 2.27 H ATOM 60 N ILE A 4 -0.506 -1.052 4.645 1.00 0.35 N ATOM 61 CA ILE A 4 0.074 -0.247 3.597 1.00 0.30 C ATOM 62 C ILE A 4 -0.541 -0.700 2.271 1.00 0.29 C ATOM 63 O ILE A 4 -1.741 -0.938 2.167 1.00 0.39 O ATOM 64 CB ILE A 4 1.606 -0.368 3.661 1.00 0.34 C ATOM 65 CG1 ILE A 4 2.140 -0.402 5.097 1.00 0.42 C ATOM 66 CG2 ILE A 4 2.241 0.868 2.990 1.00 0.34 C ATOM 67 CD1 ILE A 4 2.157 -1.782 5.771 1.00 1.40 C ATOM 68 H ILE A 4 -0.041 -1.928 4.816 1.00 0.39 H ATOM 69 HA ILE A 4 -0.163 0.798 3.749 1.00 0.30 H ATOM 70 HB ILE A 4 1.942 -1.283 3.172 1.00 0.35 H ATOM 71 HG12 ILE A 4 3.164 -0.085 5.023 1.00 0.81 H ATOM 72 HG13 ILE A 4 1.608 0.321 5.714 1.00 0.88 H ATOM 73 HG21 ILE A 4 2.146 1.733 3.649 1.00 1.36 H ATOM 74 HG22 ILE A 4 3.301 0.684 2.804 1.00 1.39 H ATOM 75 HG23 ILE A 4 1.761 1.123 2.048 1.00 1.44 H ATOM 76 HD11 ILE A 4 2.985 -1.821 6.480 1.00 2.07 H ATOM 77 HD12 ILE A 4 1.237 -1.957 6.325 1.00 2.27 H ATOM 78 HD13 ILE A 4 2.299 -2.569 5.029 1.00 2.22 H ATOM 79 N ASN A 5 0.303 -0.830 1.259 1.00 0.24 N ATOM 80 CA ASN A 5 0.009 -1.323 -0.062 1.00 0.22 C ATOM 81 C ASN A 5 0.804 -2.611 -0.262 1.00 0.22 C ATOM 82 O ASN A 5 1.738 -2.873 0.494 1.00 0.29 O ATOM 83 CB ASN A 5 0.367 -0.200 -1.027 1.00 0.23 C ATOM 84 CG ASN A 5 0.295 -0.665 -2.451 1.00 0.25 C ATOM 85 OD1 ASN A 5 -0.731 -0.558 -3.106 1.00 0.30 O ATOM 86 ND2 ASN A 5 1.393 -1.209 -2.920 1.00 0.26 N ATOM 87 H ASN A 5 1.279 -0.659 1.432 1.00 0.26 H ATOM 88 HA ASN A 5 -1.039 -1.551 -0.202 1.00 0.24 H ATOM 89 HB2 ASN A 5 -0.342 0.610 -0.907 1.00 0.27 H ATOM 90 HB3 ASN A 5 1.370 0.173 -0.818 1.00 0.25 H ATOM 91 HD21 ASN A 5 2.159 -1.422 -2.290 1.00 0.26 H ATOM 92 HD22 ASN A 5 1.472 -1.440 -3.888 1.00 0.29 H ATOM 93 N ILE A 6 0.424 -3.410 -1.262 1.00 0.20 N ATOM 94 CA ILE A 6 1.167 -4.564 -1.731 1.00 0.21 C ATOM 95 C ILE A 6 2.425 -4.047 -2.461 1.00 0.22 C ATOM 96 O ILE A 6 3.162 -3.224 -1.925 1.00 0.47 O ATOM 97 CB ILE A 6 0.227 -5.411 -2.613 1.00 0.24 C ATOM 98 CG1 ILE A 6 -1.138 -5.672 -1.942 1.00 0.39 C ATOM 99 CG2 ILE A 6 0.831 -6.796 -2.898 1.00 0.33 C ATOM 100 CD1 ILE A 6 -2.224 -4.614 -2.181 1.00 2.02 C ATOM 101 H ILE A 6 -0.361 -3.148 -1.836 1.00 0.21 H ATOM 102 HA ILE A 6 1.467 -5.161 -0.871 1.00 0.27 H ATOM 103 HB ILE A 6 0.055 -4.899 -3.561 1.00 0.26 H ATOM 104 HG12 ILE A 6 -1.526 -6.592 -2.360 1.00 1.53 H ATOM 105 HG13 ILE A 6 -1.006 -5.833 -0.871 1.00 1.21 H ATOM 106 HG21 ILE A 6 0.309 -7.243 -3.744 1.00 1.50 H ATOM 107 HG22 ILE A 6 1.892 -6.748 -3.131 1.00 1.40 H ATOM 108 HG23 ILE A 6 0.714 -7.435 -2.023 1.00 1.69 H ATOM 109 HD11 ILE A 6 -2.196 -4.270 -3.215 1.00 2.77 H ATOM 110 HD12 ILE A 6 -3.199 -5.062 -1.991 1.00 2.51 H ATOM 111 HD13 ILE A 6 -2.115 -3.771 -1.502 1.00 3.21 H ATOM 112 N GLY A 7 2.672 -4.471 -3.702 1.00 0.18 N ATOM 113 CA GLY A 7 3.822 -4.031 -4.473 1.00 0.18 C ATOM 114 C GLY A 7 3.396 -2.899 -5.397 1.00 0.14 C ATOM 115 O GLY A 7 3.516 -1.734 -5.029 1.00 0.16 O ATOM 116 H GLY A 7 2.028 -5.095 -4.157 1.00 0.36 H ATOM 117 HA2 GLY A 7 4.608 -3.669 -3.809 1.00 0.22 H ATOM 118 HA3 GLY A 7 4.218 -4.864 -5.053 1.00 0.23 H ATOM 119 N PRO A 8 2.870 -3.216 -6.587 1.00 0.16 N ATOM 120 CA PRO A 8 2.512 -2.220 -7.581 1.00 0.21 C ATOM 121 C PRO A 8 1.277 -1.443 -7.120 1.00 0.21 C ATOM 122 O PRO A 8 0.148 -1.815 -7.430 1.00 0.24 O ATOM 123 CB PRO A 8 2.272 -3.018 -8.867 1.00 0.26 C ATOM 124 CG PRO A 8 1.786 -4.375 -8.353 1.00 0.23 C ATOM 125 CD PRO A 8 2.581 -4.559 -7.061 1.00 0.18 C ATOM 126 HA PRO A 8 3.338 -1.525 -7.734 1.00 0.24 H ATOM 127 HB2 PRO A 8 1.544 -2.545 -9.526 1.00 0.32 H ATOM 128 HB3 PRO A 8 3.221 -3.152 -9.387 1.00 0.29 H ATOM 129 HG2 PRO A 8 0.721 -4.325 -8.126 1.00 0.25 H ATOM 130 HG3 PRO A 8 1.989 -5.175 -9.067 1.00 0.27 H ATOM 131 HD2 PRO A 8 1.987 -5.115 -6.335 1.00 0.18 H ATOM 132 HD3 PRO A 8 3.514 -5.081 -7.270 1.00 0.21 H ATOM 133 N GLY A 9 1.485 -0.364 -6.368 1.00 0.19 N ATOM 134 CA GLY A 9 0.409 0.446 -5.829 1.00 0.20 C ATOM 135 C GLY A 9 0.973 1.454 -4.832 1.00 0.19 C ATOM 136 O GLY A 9 2.188 1.605 -4.714 1.00 0.30 O ATOM 137 H GLY A 9 2.423 -0.136 -6.052 1.00 0.19 H ATOM 138 HA2 GLY A 9 -0.092 0.975 -6.636 1.00 0.25 H ATOM 139 HA3 GLY A 9 -0.309 -0.210 -5.337 1.00 0.23 H ATOM 140 N ARG A 10 0.096 2.146 -4.105 1.00 0.18 N ATOM 141 CA ARG A 10 0.459 2.968 -2.957 1.00 0.19 C ATOM 142 C ARG A 10 -0.753 3.057 -2.047 1.00 0.17 C ATOM 143 O ARG A 10 -1.860 2.728 -2.468 1.00 0.21 O ATOM 144 CB ARG A 10 0.914 4.371 -3.383 1.00 0.36 C ATOM 145 CG ARG A 10 -0.058 5.056 -4.355 1.00 2.04 C ATOM 146 CD ARG A 10 0.037 6.581 -4.218 1.00 2.72 C ATOM 147 NE ARG A 10 -0.144 7.264 -5.507 1.00 4.06 N ATOM 148 CZ ARG A 10 0.838 7.514 -6.386 1.00 4.45 C ATOM 149 NH1 ARG A 10 2.078 7.089 -6.144 1.00 3.91 N ATOM 150 NH2 ARG A 10 0.577 8.188 -7.506 1.00 6.00 N ATOM 151 H ARG A 10 -0.890 1.922 -4.187 1.00 0.25 H ATOM 152 HA ARG A 10 1.261 2.476 -2.405 1.00 0.21 H ATOM 153 HB2 ARG A 10 1.022 4.983 -2.486 1.00 1.73 H ATOM 154 HB3 ARG A 10 1.894 4.303 -3.858 1.00 1.70 H ATOM 155 HG2 ARG A 10 0.192 4.750 -5.371 1.00 2.79 H ATOM 156 HG3 ARG A 10 -1.086 4.757 -4.149 1.00 3.10 H ATOM 157 HD2 ARG A 10 -0.737 6.917 -3.525 1.00 3.43 H ATOM 158 HD3 ARG A 10 1.000 6.861 -3.790 1.00 2.47 H ATOM 159 HE ARG A 10 -1.085 7.576 -5.703 1.00 5.14 H ATOM 160 HH11 ARG A 10 2.273 6.553 -5.312 1.00 3.27 H ATOM 161 HH12 ARG A 10 2.845 7.269 -6.774 1.00 4.64 H ATOM 162 HH21 ARG A 10 -0.354 8.519 -7.711 1.00 6.96 H ATOM 163 HH22 ARG A 10 1.300 8.390 -8.181 1.00 6.45 H ATOM 164 N ALA A 11 -0.555 3.524 -0.818 1.00 0.19 N ATOM 165 CA ALA A 11 -1.639 3.689 0.124 1.00 0.23 C ATOM 166 C ALA A 11 -1.389 4.960 0.916 1.00 0.30 C ATOM 167 O ALA A 11 -0.260 5.198 1.337 1.00 0.56 O ATOM 168 CB ALA A 11 -1.675 2.501 1.078 1.00 0.30 C ATOM 169 H ALA A 11 0.353 3.840 -0.505 1.00 0.24 H ATOM 170 HA ALA A 11 -2.584 3.751 -0.417 1.00 0.25 H ATOM 171 HB1 ALA A 11 -0.706 2.408 1.570 1.00 1.35 H ATOM 172 HB2 ALA A 11 -2.448 2.677 1.826 1.00 1.44 H ATOM 173 HB3 ALA A 11 -1.899 1.591 0.524 1.00 1.29 H ATOM 174 N PHE A 12 -2.443 5.743 1.126 1.00 0.60 N ATOM 175 CA PHE A 12 -2.432 6.927 1.970 1.00 0.56 C ATOM 176 C PHE A 12 -3.842 7.085 2.527 1.00 1.27 C ATOM 177 O PHE A 12 -4.617 7.929 2.086 1.00 1.77 O ATOM 178 CB PHE A 12 -1.976 8.155 1.176 1.00 1.04 C ATOM 179 CG PHE A 12 -0.476 8.218 0.948 1.00 1.70 C ATOM 180 CD1 PHE A 12 0.368 8.611 2.002 1.00 2.99 C ATOM 181 CD2 PHE A 12 0.081 7.872 -0.298 1.00 2.18 C ATOM 182 CE1 PHE A 12 1.758 8.686 1.809 1.00 3.93 C ATOM 183 CE2 PHE A 12 1.472 7.953 -0.495 1.00 2.88 C ATOM 184 CZ PHE A 12 2.310 8.365 0.557 1.00 3.59 C ATOM 185 H PHE A 12 -3.342 5.449 0.775 1.00 0.91 H ATOM 186 HA PHE A 12 -1.744 6.776 2.804 1.00 0.54 H ATOM 187 HB2 PHE A 12 -2.501 8.169 0.222 1.00 1.68 H ATOM 188 HB3 PHE A 12 -2.262 9.053 1.723 1.00 0.87 H ATOM 189 HD1 PHE A 12 -0.052 8.851 2.968 1.00 3.62 H ATOM 190 HD2 PHE A 12 -0.563 7.529 -1.092 1.00 2.76 H ATOM 191 HE1 PHE A 12 2.401 8.988 2.622 1.00 5.15 H ATOM 192 HE2 PHE A 12 1.904 7.698 -1.450 1.00 3.46 H ATOM 193 HZ PHE A 12 3.379 8.426 0.409 1.00 4.37 H ATOM 194 N TYR A 13 -4.157 6.219 3.485 1.00 1.69 N ATOM 195 CA TYR A 13 -5.373 6.183 4.280 1.00 2.38 C ATOM 196 C TYR A 13 -4.971 5.625 5.636 1.00 2.75 C ATOM 197 O TYR A 13 -3.884 5.006 5.721 1.00 2.83 O ATOM 198 CB TYR A 13 -6.409 5.227 3.675 1.00 3.02 C ATOM 199 CG TYR A 13 -7.064 5.657 2.380 1.00 3.31 C ATOM 200 CD1 TYR A 13 -8.034 6.675 2.393 1.00 4.25 C ATOM 201 CD2 TYR A 13 -6.782 4.969 1.185 1.00 3.90 C ATOM 202 CE1 TYR A 13 -8.737 7.001 1.218 1.00 4.98 C ATOM 203 CE2 TYR A 13 -7.477 5.290 0.006 1.00 4.66 C ATOM 204 CZ TYR A 13 -8.463 6.302 0.020 1.00 4.92 C ATOM 205 OH TYR A 13 -9.153 6.580 -1.122 1.00 5.94 O ATOM 206 OXT TYR A 13 -5.791 5.662 6.576 1.00 3.52 O ATOM 207 H TYR A 13 -3.440 5.591 3.826 1.00 1.69 H ATOM 208 HA TYR A 13 -5.790 7.183 4.399 1.00 2.39 H ATOM 209 HB2 TYR A 13 -5.940 4.253 3.537 1.00 3.30 H ATOM 210 HB3 TYR A 13 -7.207 5.090 4.407 1.00 3.68 H ATOM 211 HD1 TYR A 13 -8.252 7.194 3.315 1.00 4.99 H ATOM 212 HD2 TYR A 13 -6.053 4.174 1.178 1.00 4.48 H ATOM 213 HE1 TYR A 13 -9.489 7.775 1.250 1.00 6.08 H ATOM 214 HE2 TYR A 13 -7.279 4.754 -0.910 1.00 5.60 H ATOM 215 HH TYR A 13 -9.835 7.244 -1.005 1.00 6.56 H TER 216 TYR A 13 ENDMDL MODEL 16 ATOM 1 N ARG A 1 0.142 -0.819 13.656 1.00 5.53 N ATOM 2 CA ARG A 1 0.616 -0.857 12.259 1.00 5.17 C ATOM 3 C ARG A 1 -0.618 -0.915 11.372 1.00 3.30 C ATOM 4 O ARG A 1 -1.369 -1.876 11.480 1.00 3.58 O ATOM 5 CB ARG A 1 1.533 -2.079 12.035 1.00 6.64 C ATOM 6 CG ARG A 1 3.011 -1.688 11.885 1.00 8.55 C ATOM 7 CD ARG A 1 3.915 -2.873 12.263 1.00 10.20 C ATOM 8 NE ARG A 1 5.262 -2.756 11.681 1.00 11.98 N ATOM 9 CZ ARG A 1 6.389 -3.301 12.169 1.00 13.68 C ATOM 10 NH1 ARG A 1 6.396 -3.904 13.358 1.00 13.91 N ATOM 11 NH2 ARG A 1 7.516 -3.244 11.457 1.00 15.41 N ATOM 12 H1 ARG A 1 -0.439 -1.633 13.817 1.00 5.42 H ATOM 13 H2 ARG A 1 0.921 -0.822 14.298 1.00 6.79 H ATOM 14 H3 ARG A 1 -0.423 0.006 13.805 1.00 5.06 H ATOM 15 HA ARG A 1 1.173 0.053 12.032 1.00 5.73 H ATOM 16 HB2 ARG A 1 1.425 -2.768 12.873 1.00 7.05 H ATOM 17 HB3 ARG A 1 1.233 -2.612 11.130 1.00 6.41 H ATOM 18 HG2 ARG A 1 3.191 -1.396 10.850 1.00 8.69 H ATOM 19 HG3 ARG A 1 3.246 -0.846 12.537 1.00 9.03 H ATOM 20 HD2 ARG A 1 3.973 -2.922 13.351 1.00 10.51 H ATOM 21 HD3 ARG A 1 3.465 -3.797 11.897 1.00 10.17 H ATOM 22 HE ARG A 1 5.301 -2.295 10.784 1.00 12.10 H ATOM 23 HH11 ARG A 1 5.555 -3.957 13.908 1.00 12.98 H ATOM 24 HH12 ARG A 1 7.233 -4.316 13.745 1.00 15.21 H ATOM 25 HH21 ARG A 1 7.541 -2.814 10.545 1.00 15.62 H ATOM 26 HH22 ARG A 1 8.375 -3.653 11.794 1.00 16.71 H ATOM 27 N LYS A 2 -0.884 0.117 10.567 1.00 2.14 N ATOM 28 CA LYS A 2 -1.962 0.038 9.587 1.00 0.67 C ATOM 29 C LYS A 2 -1.461 -0.801 8.419 1.00 0.90 C ATOM 30 O LYS A 2 -0.261 -0.836 8.150 1.00 2.20 O ATOM 31 CB LYS A 2 -2.372 1.444 9.120 1.00 1.95 C ATOM 32 CG LYS A 2 -3.387 2.074 10.085 1.00 3.03 C ATOM 33 CD LYS A 2 -4.840 1.904 9.614 1.00 4.89 C ATOM 34 CE LYS A 2 -5.120 2.874 8.455 1.00 6.32 C ATOM 35 NZ LYS A 2 -6.516 3.364 8.423 1.00 8.07 N ATOM 36 H LYS A 2 -0.224 0.872 10.452 1.00 3.09 H ATOM 37 HA LYS A 2 -2.822 -0.468 10.029 1.00 1.78 H ATOM 38 HB2 LYS A 2 -1.484 2.078 9.060 1.00 2.63 H ATOM 39 HB3 LYS A 2 -2.812 1.391 8.124 1.00 3.02 H ATOM 40 HG2 LYS A 2 -3.274 1.625 11.073 1.00 3.21 H ATOM 41 HG3 LYS A 2 -3.179 3.140 10.180 1.00 3.56 H ATOM 42 HD2 LYS A 2 -5.020 0.874 9.297 1.00 5.27 H ATOM 43 HD3 LYS A 2 -5.499 2.134 10.451 1.00 5.69 H ATOM 44 HE2 LYS A 2 -4.464 3.737 8.570 1.00 6.37 H ATOM 45 HE3 LYS A 2 -4.872 2.391 7.506 1.00 6.73 H ATOM 46 HZ1 LYS A 2 -7.161 2.601 8.268 1.00 8.66 H ATOM 47 HZ2 LYS A 2 -6.743 3.825 9.293 1.00 8.32 H ATOM 48 HZ3 LYS A 2 -6.620 4.044 7.678 1.00 8.82 H ATOM 49 N SER A 3 -2.378 -1.463 7.722 1.00 0.76 N ATOM 50 CA SER A 3 -2.084 -2.129 6.468 1.00 0.66 C ATOM 51 C SER A 3 -1.636 -1.082 5.465 1.00 0.58 C ATOM 52 O SER A 3 -2.250 -0.023 5.387 1.00 0.68 O ATOM 53 CB SER A 3 -3.375 -2.796 5.989 1.00 0.66 C ATOM 54 OG SER A 3 -4.439 -1.867 6.112 1.00 2.29 O ATOM 55 H SER A 3 -3.359 -1.386 7.948 1.00 1.76 H ATOM 56 HA SER A 3 -1.283 -2.860 6.597 1.00 0.70 H ATOM 57 HB2 SER A 3 -3.270 -3.112 4.950 1.00 1.89 H ATOM 58 HB3 SER A 3 -3.587 -3.665 6.613 1.00 1.91 H ATOM 59 HG SER A 3 -4.232 -1.102 5.559 1.00 3.01 H ATOM 60 N ILE A 4 -0.578 -1.360 4.713 1.00 0.48 N ATOM 61 CA ILE A 4 -0.054 -0.468 3.705 1.00 0.43 C ATOM 62 C ILE A 4 -0.606 -0.914 2.351 1.00 0.35 C ATOM 63 O ILE A 4 -1.778 -1.257 2.225 1.00 0.39 O ATOM 64 CB ILE A 4 1.482 -0.465 3.805 1.00 0.44 C ATOM 65 CG1 ILE A 4 1.967 -0.524 5.261 1.00 0.53 C ATOM 66 CG2 ILE A 4 2.032 0.842 3.195 1.00 0.50 C ATOM 67 CD1 ILE A 4 2.290 -1.926 5.800 1.00 1.45 C ATOM 68 H ILE A 4 -0.050 -2.204 4.850 1.00 0.49 H ATOM 69 HA ILE A 4 -0.395 0.546 3.881 1.00 0.51 H ATOM 70 HB ILE A 4 1.897 -1.336 3.296 1.00 0.38 H ATOM 71 HG12 ILE A 4 2.893 0.017 5.290 1.00 0.79 H ATOM 72 HG13 ILE A 4 1.267 -0.007 5.914 1.00 1.08 H ATOM 73 HG21 ILE A 4 1.827 1.676 3.868 1.00 1.54 H ATOM 74 HG22 ILE A 4 3.111 0.759 3.058 1.00 1.25 H ATOM 75 HG23 ILE A 4 1.578 1.085 2.235 1.00 1.49 H ATOM 76 HD11 ILE A 4 2.948 -2.447 5.105 1.00 2.22 H ATOM 77 HD12 ILE A 4 2.804 -1.824 6.757 1.00 2.02 H ATOM 78 HD13 ILE A 4 1.393 -2.517 5.965 1.00 2.16 H ATOM 79 N ASN A 5 0.255 -0.909 1.345 1.00 0.29 N ATOM 80 CA ASN A 5 0.012 -1.358 -0.008 1.00 0.22 C ATOM 81 C ASN A 5 0.841 -2.619 -0.235 1.00 0.19 C ATOM 82 O ASN A 5 1.845 -2.806 0.443 1.00 0.22 O ATOM 83 CB ASN A 5 0.371 -0.208 -0.943 1.00 0.24 C ATOM 84 CG ASN A 5 0.456 -0.682 -2.368 1.00 0.20 C ATOM 85 OD1 ASN A 5 -0.498 -0.599 -3.125 1.00 0.23 O ATOM 86 ND2 ASN A 5 1.609 -1.210 -2.717 1.00 0.25 N ATOM 87 H ASN A 5 1.212 -0.685 1.568 1.00 0.33 H ATOM 88 HA ASN A 5 -1.025 -1.605 -0.183 1.00 0.23 H ATOM 89 HB2 ASN A 5 -0.395 0.560 -0.889 1.00 0.28 H ATOM 90 HB3 ASN A 5 1.328 0.228 -0.655 1.00 0.32 H ATOM 91 HD21 ASN A 5 2.308 -1.367 -2.007 1.00 0.31 H ATOM 92 HD22 ASN A 5 1.814 -1.373 -3.686 1.00 0.31 H ATOM 93 N ILE A 6 0.415 -3.460 -1.184 1.00 0.19 N ATOM 94 CA ILE A 6 1.102 -4.678 -1.594 1.00 0.26 C ATOM 95 C ILE A 6 2.441 -4.313 -2.249 1.00 0.32 C ATOM 96 O ILE A 6 3.436 -4.091 -1.568 1.00 0.78 O ATOM 97 CB ILE A 6 0.153 -5.510 -2.492 1.00 0.26 C ATOM 98 CG1 ILE A 6 -1.121 -5.902 -1.721 1.00 0.33 C ATOM 99 CG2 ILE A 6 0.841 -6.788 -3.002 1.00 0.29 C ATOM 100 CD1 ILE A 6 -2.288 -6.209 -2.669 1.00 1.39 C ATOM 101 H ILE A 6 -0.424 -3.227 -1.693 1.00 0.24 H ATOM 102 HA ILE A 6 1.335 -5.264 -0.712 1.00 0.35 H ATOM 103 HB ILE A 6 -0.157 -4.905 -3.346 1.00 0.27 H ATOM 104 HG12 ILE A 6 -0.912 -6.766 -1.094 1.00 1.00 H ATOM 105 HG13 ILE A 6 -1.443 -5.090 -1.073 1.00 0.96 H ATOM 106 HG21 ILE A 6 1.540 -6.564 -3.806 1.00 1.26 H ATOM 107 HG22 ILE A 6 1.377 -7.271 -2.184 1.00 1.34 H ATOM 108 HG23 ILE A 6 0.106 -7.487 -3.397 1.00 1.36 H ATOM 109 HD11 ILE A 6 -2.529 -5.321 -3.252 1.00 2.23 H ATOM 110 HD12 ILE A 6 -2.038 -7.025 -3.345 1.00 2.13 H ATOM 111 HD13 ILE A 6 -3.163 -6.495 -2.084 1.00 2.35 H ATOM 112 N GLY A 7 2.477 -4.242 -3.576 1.00 0.33 N ATOM 113 CA GLY A 7 3.676 -3.959 -4.343 1.00 0.28 C ATOM 114 C GLY A 7 3.357 -2.845 -5.324 1.00 0.18 C ATOM 115 O GLY A 7 3.491 -1.678 -4.966 1.00 0.19 O ATOM 116 H GLY A 7 1.623 -4.435 -4.071 1.00 0.63 H ATOM 117 HA2 GLY A 7 4.480 -3.627 -3.685 1.00 0.31 H ATOM 118 HA3 GLY A 7 4.006 -4.854 -4.870 1.00 0.35 H ATOM 119 N PRO A 8 2.880 -3.170 -6.532 1.00 0.19 N ATOM 120 CA PRO A 8 2.538 -2.180 -7.538 1.00 0.23 C ATOM 121 C PRO A 8 1.301 -1.391 -7.100 1.00 0.22 C ATOM 122 O PRO A 8 0.172 -1.754 -7.420 1.00 0.25 O ATOM 123 CB PRO A 8 2.309 -2.984 -8.821 1.00 0.29 C ATOM 124 CG PRO A 8 1.822 -4.339 -8.303 1.00 0.27 C ATOM 125 CD PRO A 8 2.617 -4.515 -7.010 1.00 0.22 C ATOM 126 HA PRO A 8 3.370 -1.490 -7.686 1.00 0.26 H ATOM 127 HB2 PRO A 8 1.583 -2.516 -9.487 1.00 0.33 H ATOM 128 HB3 PRO A 8 3.261 -3.119 -9.335 1.00 0.32 H ATOM 129 HG2 PRO A 8 0.756 -4.285 -8.073 1.00 0.28 H ATOM 130 HG3 PRO A 8 2.021 -5.142 -9.014 1.00 0.30 H ATOM 131 HD2 PRO A 8 2.038 -5.091 -6.287 1.00 0.23 H ATOM 132 HD3 PRO A 8 3.562 -5.015 -7.225 1.00 0.25 H ATOM 133 N GLY A 9 1.515 -0.308 -6.356 1.00 0.21 N ATOM 134 CA GLY A 9 0.459 0.526 -5.813 1.00 0.22 C ATOM 135 C GLY A 9 1.046 1.435 -4.737 1.00 0.23 C ATOM 136 O GLY A 9 2.255 1.424 -4.513 1.00 0.33 O ATOM 137 H GLY A 9 2.453 -0.109 -6.022 1.00 0.20 H ATOM 138 HA2 GLY A 9 0.026 1.132 -6.607 1.00 0.29 H ATOM 139 HA3 GLY A 9 -0.317 -0.111 -5.388 1.00 0.21 H ATOM 140 N ARG A 10 0.207 2.229 -4.073 1.00 0.24 N ATOM 141 CA ARG A 10 0.568 3.070 -2.934 1.00 0.25 C ATOM 142 C ARG A 10 -0.694 3.256 -2.104 1.00 0.29 C ATOM 143 O ARG A 10 -1.790 3.015 -2.605 1.00 0.43 O ATOM 144 CB ARG A 10 1.119 4.425 -3.420 1.00 0.46 C ATOM 145 CG ARG A 10 2.652 4.470 -3.371 1.00 1.97 C ATOM 146 CD ARG A 10 3.199 5.744 -4.024 1.00 2.27 C ATOM 147 NE ARG A 10 3.449 5.558 -5.462 1.00 3.06 N ATOM 148 CZ ARG A 10 3.934 6.500 -6.283 1.00 3.75 C ATOM 149 NH1 ARG A 10 4.108 7.745 -5.840 1.00 3.96 N ATOM 150 NH2 ARG A 10 4.254 6.195 -7.543 1.00 5.01 N ATOM 151 H ARG A 10 -0.788 2.146 -4.250 1.00 0.31 H ATOM 152 HA ARG A 10 1.304 2.555 -2.316 1.00 0.24 H ATOM 153 HB2 ARG A 10 0.772 4.624 -4.435 1.00 1.37 H ATOM 154 HB3 ARG A 10 0.745 5.223 -2.776 1.00 1.17 H ATOM 155 HG2 ARG A 10 2.963 4.449 -2.325 1.00 2.93 H ATOM 156 HG3 ARG A 10 3.082 3.604 -3.868 1.00 3.00 H ATOM 157 HD2 ARG A 10 2.492 6.561 -3.869 1.00 2.45 H ATOM 158 HD3 ARG A 10 4.144 5.998 -3.542 1.00 2.99 H ATOM 159 HE ARG A 10 3.304 4.619 -5.808 1.00 3.81 H ATOM 160 HH11 ARG A 10 3.862 7.976 -4.891 1.00 3.74 H ATOM 161 HH12 ARG A 10 4.470 8.483 -6.426 1.00 4.87 H ATOM 162 HH21 ARG A 10 4.149 5.254 -7.892 1.00 5.66 H ATOM 163 HH22 ARG A 10 4.629 6.885 -8.175 1.00 5.67 H ATOM 164 N ALA A 11 -0.557 3.683 -0.849 1.00 0.28 N ATOM 165 CA ALA A 11 -1.697 3.898 0.020 1.00 0.41 C ATOM 166 C ALA A 11 -1.469 5.164 0.830 1.00 0.46 C ATOM 167 O ALA A 11 -0.358 5.396 1.295 1.00 0.57 O ATOM 168 CB ALA A 11 -1.856 2.711 0.966 1.00 0.52 C ATOM 169 H ALA A 11 0.345 3.917 -0.453 1.00 0.26 H ATOM 170 HA ALA A 11 -2.602 4.003 -0.581 1.00 0.48 H ATOM 171 HB1 ALA A 11 -0.944 2.585 1.550 1.00 1.29 H ATOM 172 HB2 ALA A 11 -2.689 2.908 1.643 1.00 1.64 H ATOM 173 HB3 ALA A 11 -2.049 1.805 0.390 1.00 1.36 H ATOM 174 N PHE A 12 -2.532 5.944 1.013 1.00 0.81 N ATOM 175 CA PHE A 12 -2.552 7.120 1.864 1.00 0.78 C ATOM 176 C PHE A 12 -3.945 7.169 2.481 1.00 1.39 C ATOM 177 O PHE A 12 -4.882 7.672 1.864 1.00 1.93 O ATOM 178 CB PHE A 12 -2.249 8.376 1.040 1.00 1.08 C ATOM 179 CG PHE A 12 -0.806 8.487 0.583 1.00 1.55 C ATOM 180 CD1 PHE A 12 0.156 9.057 1.437 1.00 2.87 C ATOM 181 CD2 PHE A 12 -0.419 8.020 -0.688 1.00 2.62 C ATOM 182 CE1 PHE A 12 1.495 9.166 1.022 1.00 3.57 C ATOM 183 CE2 PHE A 12 0.920 8.128 -1.102 1.00 3.11 C ATOM 184 CZ PHE A 12 1.878 8.703 -0.249 1.00 3.12 C ATOM 185 H PHE A 12 -3.420 5.690 0.606 1.00 1.17 H ATOM 186 HA PHE A 12 -1.806 7.025 2.656 1.00 0.69 H ATOM 187 HB2 PHE A 12 -2.907 8.390 0.171 1.00 1.62 H ATOM 188 HB3 PHE A 12 -2.485 9.252 1.644 1.00 0.94 H ATOM 189 HD1 PHE A 12 -0.133 9.411 2.416 1.00 3.96 H ATOM 190 HD2 PHE A 12 -1.152 7.572 -1.343 1.00 3.78 H ATOM 191 HE1 PHE A 12 2.228 9.606 1.683 1.00 4.97 H ATOM 192 HE2 PHE A 12 1.211 7.773 -2.078 1.00 4.26 H ATOM 193 HZ PHE A 12 2.907 8.790 -0.563 1.00 3.78 H ATOM 194 N TYR A 13 -4.079 6.574 3.663 1.00 1.71 N ATOM 195 CA TYR A 13 -5.303 6.535 4.456 1.00 2.40 C ATOM 196 C TYR A 13 -5.109 7.346 5.734 1.00 3.45 C ATOM 197 O TYR A 13 -4.079 8.049 5.815 1.00 4.09 O ATOM 198 CB TYR A 13 -5.675 5.082 4.763 1.00 2.39 C ATOM 199 CG TYR A 13 -4.471 4.296 5.213 1.00 2.55 C ATOM 200 CD1 TYR A 13 -3.783 4.660 6.383 1.00 4.17 C ATOM 201 CD2 TYR A 13 -3.935 3.328 4.354 1.00 3.26 C ATOM 202 CE1 TYR A 13 -2.566 4.048 6.706 1.00 6.20 C ATOM 203 CE2 TYR A 13 -2.719 2.714 4.670 1.00 5.23 C ATOM 204 CZ TYR A 13 -2.037 3.049 5.862 1.00 6.66 C ATOM 205 OH TYR A 13 -0.897 2.394 6.214 1.00 8.93 O ATOM 206 OXT TYR A 13 -5.931 7.148 6.656 1.00 4.04 O ATOM 207 H TYR A 13 -3.260 6.175 4.095 1.00 1.74 H ATOM 208 HA TYR A 13 -6.112 6.973 3.894 1.00 2.79 H ATOM 209 HB2 TYR A 13 -6.452 5.042 5.527 1.00 3.48 H ATOM 210 HB3 TYR A 13 -6.087 4.633 3.859 1.00 3.34 H ATOM 211 HD1 TYR A 13 -4.151 5.447 7.026 1.00 4.46 H ATOM 212 HD2 TYR A 13 -4.438 3.076 3.432 1.00 3.26 H ATOM 213 HE1 TYR A 13 -2.040 4.377 7.583 1.00 7.71 H ATOM 214 HE2 TYR A 13 -2.327 1.988 3.982 1.00 6.08 H ATOM 215 HH TYR A 13 -0.893 1.513 5.830 1.00 9.24 H TER 216 TYR A 13 ENDMDL MODEL 17 ATOM 1 N ARG A 1 -1.036 -0.408 14.240 1.00 5.06 N ATOM 2 CA ARG A 1 -0.363 -0.274 12.928 1.00 4.61 C ATOM 3 C ARG A 1 -1.465 -0.088 11.885 1.00 2.72 C ATOM 4 O ARG A 1 -2.629 -0.148 12.265 1.00 2.68 O ATOM 5 CB ARG A 1 0.533 -1.501 12.652 1.00 5.94 C ATOM 6 CG ARG A 1 1.743 -1.207 11.748 1.00 7.50 C ATOM 7 CD ARG A 1 2.799 -0.328 12.439 1.00 8.88 C ATOM 8 NE ARG A 1 3.996 -1.091 12.827 1.00 10.70 N ATOM 9 CZ ARG A 1 5.076 -0.581 13.438 1.00 12.26 C ATOM 10 NH1 ARG A 1 5.094 0.699 13.810 1.00 12.33 N ATOM 11 NH2 ARG A 1 6.139 -1.352 13.673 1.00 14.02 N ATOM 12 H1 ARG A 1 -1.648 -1.212 14.211 1.00 4.95 H ATOM 13 H2 ARG A 1 -0.364 -0.504 14.987 1.00 6.27 H ATOM 14 H3 ARG A 1 -1.619 0.403 14.393 1.00 4.71 H ATOM 15 HA ARG A 1 0.253 0.625 12.949 1.00 5.28 H ATOM 16 HB2 ARG A 1 0.915 -1.888 13.597 1.00 6.67 H ATOM 17 HB3 ARG A 1 -0.072 -2.286 12.195 1.00 5.72 H ATOM 18 HG2 ARG A 1 2.197 -2.156 11.453 1.00 8.20 H ATOM 19 HG3 ARG A 1 1.418 -0.715 10.835 1.00 7.59 H ATOM 20 HD2 ARG A 1 3.103 0.458 11.744 1.00 9.25 H ATOM 21 HD3 ARG A 1 2.366 0.139 13.324 1.00 8.62 H ATOM 22 HE ARG A 1 4.011 -2.062 12.548 1.00 10.99 H ATOM 23 HH11 ARG A 1 4.306 1.295 13.621 1.00 11.29 H ATOM 24 HH12 ARG A 1 5.892 1.111 14.273 1.00 13.60 H ATOM 25 HH21 ARG A 1 6.160 -2.321 13.389 1.00 14.32 H ATOM 26 HH22 ARG A 1 6.965 -0.990 14.125 1.00 15.25 H ATOM 27 N LYS A 2 -1.142 0.131 10.608 1.00 1.98 N ATOM 28 CA LYS A 2 -2.123 0.249 9.539 1.00 0.57 C ATOM 29 C LYS A 2 -1.653 -0.608 8.374 1.00 0.76 C ATOM 30 O LYS A 2 -0.463 -0.890 8.263 1.00 2.09 O ATOM 31 CB LYS A 2 -2.262 1.715 9.102 1.00 2.05 C ATOM 32 CG LYS A 2 -3.187 2.518 10.030 1.00 3.11 C ATOM 33 CD LYS A 2 -4.332 3.150 9.232 1.00 5.04 C ATOM 34 CE LYS A 2 -5.262 2.071 8.662 1.00 6.15 C ATOM 35 NZ LYS A 2 -6.104 2.625 7.588 1.00 8.00 N ATOM 36 H LYS A 2 -0.186 0.129 10.280 1.00 3.06 H ATOM 37 HA LYS A 2 -3.090 -0.130 9.876 1.00 1.65 H ATOM 38 HB2 LYS A 2 -1.276 2.184 9.076 1.00 2.70 H ATOM 39 HB3 LYS A 2 -2.651 1.749 8.083 1.00 3.12 H ATOM 40 HG2 LYS A 2 -3.607 1.879 10.806 1.00 3.37 H ATOM 41 HG3 LYS A 2 -2.612 3.311 10.509 1.00 3.44 H ATOM 42 HD2 LYS A 2 -4.909 3.810 9.882 1.00 5.77 H ATOM 43 HD3 LYS A 2 -3.911 3.746 8.420 1.00 5.75 H ATOM 44 HE2 LYS A 2 -4.663 1.263 8.243 1.00 6.06 H ATOM 45 HE3 LYS A 2 -5.882 1.670 9.466 1.00 6.31 H ATOM 46 HZ1 LYS A 2 -6.789 1.966 7.252 1.00 8.76 H ATOM 47 HZ2 LYS A 2 -6.547 3.495 7.869 1.00 8.61 H ATOM 48 HZ3 LYS A 2 -5.510 2.938 6.823 1.00 8.30 H ATOM 49 N SER A 3 -2.590 -1.022 7.526 1.00 0.68 N ATOM 50 CA SER A 3 -2.307 -1.743 6.304 1.00 0.63 C ATOM 51 C SER A 3 -1.795 -0.768 5.260 1.00 0.53 C ATOM 52 O SER A 3 -2.449 0.241 4.997 1.00 0.66 O ATOM 53 CB SER A 3 -3.620 -2.367 5.826 1.00 0.74 C ATOM 54 OG SER A 3 -4.632 -1.376 5.863 1.00 2.71 O ATOM 55 H SER A 3 -3.557 -0.757 7.642 1.00 1.75 H ATOM 56 HA SER A 3 -1.545 -2.503 6.484 1.00 0.68 H ATOM 57 HB2 SER A 3 -3.504 -2.748 4.809 1.00 1.86 H ATOM 58 HB3 SER A 3 -3.896 -3.187 6.489 1.00 1.64 H ATOM 59 HG SER A 3 -4.363 -0.667 5.261 1.00 3.43 H ATOM 60 N ILE A 4 -0.642 -1.077 4.673 1.00 0.41 N ATOM 61 CA ILE A 4 -0.030 -0.264 3.642 1.00 0.35 C ATOM 62 C ILE A 4 -0.555 -0.771 2.296 1.00 0.28 C ATOM 63 O ILE A 4 -1.741 -1.043 2.132 1.00 0.35 O ATOM 64 CB ILE A 4 1.496 -0.306 3.804 1.00 0.41 C ATOM 65 CG1 ILE A 4 1.883 -0.179 5.284 1.00 0.59 C ATOM 66 CG2 ILE A 4 2.211 0.799 2.997 1.00 0.36 C ATOM 67 CD1 ILE A 4 1.257 0.998 6.051 1.00 2.91 C ATOM 68 H ILE A 4 -0.149 -1.913 4.945 1.00 0.43 H ATOM 69 HA ILE A 4 -0.307 0.774 3.755 1.00 0.37 H ATOM 70 HB ILE A 4 1.858 -1.278 3.459 1.00 0.47 H ATOM 71 HG12 ILE A 4 1.649 -1.106 5.807 1.00 1.95 H ATOM 72 HG13 ILE A 4 2.952 -0.067 5.308 1.00 1.40 H ATOM 73 HG21 ILE A 4 1.607 1.151 2.162 1.00 1.41 H ATOM 74 HG22 ILE A 4 2.426 1.664 3.621 1.00 1.32 H ATOM 75 HG23 ILE A 4 3.159 0.417 2.615 1.00 1.37 H ATOM 76 HD11 ILE A 4 0.189 0.843 6.192 1.00 3.97 H ATOM 77 HD12 ILE A 4 1.721 1.067 7.034 1.00 3.29 H ATOM 78 HD13 ILE A 4 1.414 1.938 5.526 1.00 4.14 H ATOM 79 N ASN A 5 0.348 -0.913 1.338 1.00 0.24 N ATOM 80 CA ASN A 5 0.114 -1.376 -0.008 1.00 0.17 C ATOM 81 C ASN A 5 0.931 -2.647 -0.214 1.00 0.16 C ATOM 82 O ASN A 5 1.857 -2.908 0.550 1.00 0.23 O ATOM 83 CB ASN A 5 0.468 -0.230 -0.947 1.00 0.21 C ATOM 84 CG ASN A 5 0.525 -0.694 -2.373 1.00 0.21 C ATOM 85 OD1 ASN A 5 -0.459 -0.652 -3.094 1.00 0.24 O ATOM 86 ND2 ASN A 5 1.684 -1.177 -2.761 1.00 0.26 N ATOM 87 H ASN A 5 1.311 -0.742 1.572 1.00 0.30 H ATOM 88 HA ASN A 5 -0.922 -1.623 -0.189 1.00 0.18 H ATOM 89 HB2 ASN A 5 -0.299 0.531 -0.885 1.00 0.25 H ATOM 90 HB3 ASN A 5 1.428 0.209 -0.671 1.00 0.28 H ATOM 91 HD21 ASN A 5 2.394 -1.388 -2.071 1.00 0.27 H ATOM 92 HD22 ASN A 5 1.857 -1.372 -3.728 1.00 0.31 H ATOM 93 N ILE A 6 0.564 -3.430 -1.231 1.00 0.14 N ATOM 94 CA ILE A 6 1.295 -4.601 -1.688 1.00 0.18 C ATOM 95 C ILE A 6 2.555 -4.083 -2.410 1.00 0.19 C ATOM 96 O ILE A 6 3.359 -3.365 -1.820 1.00 0.35 O ATOM 97 CB ILE A 6 0.355 -5.458 -2.573 1.00 0.22 C ATOM 98 CG1 ILE A 6 -0.986 -5.760 -1.868 1.00 0.30 C ATOM 99 CG2 ILE A 6 0.989 -6.805 -2.964 1.00 0.30 C ATOM 100 CD1 ILE A 6 -2.042 -6.302 -2.837 1.00 1.42 C ATOM 101 H ILE A 6 -0.204 -3.123 -1.811 1.00 0.18 H ATOM 102 HA ILE A 6 1.605 -5.185 -0.820 1.00 0.23 H ATOM 103 HB ILE A 6 0.130 -4.892 -3.479 1.00 0.25 H ATOM 104 HG12 ILE A 6 -0.825 -6.479 -1.065 1.00 0.91 H ATOM 105 HG13 ILE A 6 -1.403 -4.856 -1.429 1.00 0.99 H ATOM 106 HG21 ILE A 6 0.438 -7.241 -3.797 1.00 1.42 H ATOM 107 HG22 ILE A 6 2.027 -6.702 -3.267 1.00 1.53 H ATOM 108 HG23 ILE A 6 0.962 -7.489 -2.116 1.00 1.64 H ATOM 109 HD11 ILE A 6 -2.981 -6.450 -2.299 1.00 2.05 H ATOM 110 HD12 ILE A 6 -2.207 -5.584 -3.640 1.00 2.30 H ATOM 111 HD13 ILE A 6 -1.730 -7.257 -3.257 1.00 2.47 H ATOM 112 N GLY A 7 2.722 -4.381 -3.700 1.00 0.19 N ATOM 113 CA GLY A 7 3.862 -3.933 -4.481 1.00 0.21 C ATOM 114 C GLY A 7 3.402 -2.827 -5.419 1.00 0.15 C ATOM 115 O GLY A 7 3.470 -1.657 -5.056 1.00 0.15 O ATOM 116 H GLY A 7 2.016 -4.917 -4.176 1.00 0.30 H ATOM 117 HA2 GLY A 7 4.644 -3.541 -3.829 1.00 0.25 H ATOM 118 HA3 GLY A 7 4.273 -4.766 -5.048 1.00 0.27 H ATOM 119 N PRO A 8 2.891 -3.175 -6.605 1.00 0.16 N ATOM 120 CA PRO A 8 2.465 -2.204 -7.597 1.00 0.18 C ATOM 121 C PRO A 8 1.210 -1.469 -7.114 1.00 0.18 C ATOM 122 O PRO A 8 0.090 -1.903 -7.373 1.00 0.25 O ATOM 123 CB PRO A 8 2.227 -3.025 -8.870 1.00 0.25 C ATOM 124 CG PRO A 8 1.825 -4.400 -8.333 1.00 0.26 C ATOM 125 CD PRO A 8 2.679 -4.533 -7.074 1.00 0.23 C ATOM 126 HA PRO A 8 3.259 -1.478 -7.778 1.00 0.20 H ATOM 127 HB2 PRO A 8 1.457 -2.594 -9.511 1.00 0.30 H ATOM 128 HB3 PRO A 8 3.165 -3.118 -9.417 1.00 0.27 H ATOM 129 HG2 PRO A 8 0.770 -4.398 -8.061 1.00 0.29 H ATOM 130 HG3 PRO A 8 2.034 -5.195 -9.049 1.00 0.29 H ATOM 131 HD2 PRO A 8 2.158 -5.137 -6.330 1.00 0.28 H ATOM 132 HD3 PRO A 8 3.640 -4.985 -7.325 1.00 0.27 H ATOM 133 N GLY A 9 1.392 -0.355 -6.404 1.00 0.16 N ATOM 134 CA GLY A 9 0.306 0.430 -5.843 1.00 0.18 C ATOM 135 C GLY A 9 0.866 1.450 -4.857 1.00 0.18 C ATOM 136 O GLY A 9 2.075 1.669 -4.812 1.00 0.36 O ATOM 137 H GLY A 9 2.330 -0.078 -6.132 1.00 0.18 H ATOM 138 HA2 GLY A 9 -0.220 0.954 -6.637 1.00 0.27 H ATOM 139 HA3 GLY A 9 -0.396 -0.232 -5.335 1.00 0.20 H ATOM 140 N ARG A 10 -0.004 2.082 -4.069 1.00 0.20 N ATOM 141 CA ARG A 10 0.387 2.956 -2.970 1.00 0.18 C ATOM 142 C ARG A 10 -0.749 2.993 -1.958 1.00 0.19 C ATOM 143 O ARG A 10 -1.870 2.593 -2.274 1.00 0.28 O ATOM 144 CB ARG A 10 0.721 4.367 -3.483 1.00 0.33 C ATOM 145 CG ARG A 10 -0.473 5.041 -4.172 1.00 2.35 C ATOM 146 CD ARG A 10 -0.174 6.517 -4.450 1.00 2.90 C ATOM 147 NE ARG A 10 -1.397 7.247 -4.816 1.00 4.89 N ATOM 148 CZ ARG A 10 -1.976 7.265 -6.023 1.00 6.29 C ATOM 149 NH1 ARG A 10 -1.409 6.631 -7.050 1.00 6.27 N ATOM 150 NH2 ARG A 10 -3.128 7.915 -6.197 1.00 8.21 N ATOM 151 H ARG A 10 -0.975 1.791 -4.079 1.00 0.35 H ATOM 152 HA ARG A 10 1.266 2.531 -2.480 1.00 0.20 H ATOM 153 HB2 ARG A 10 1.035 4.977 -2.635 1.00 1.62 H ATOM 154 HB3 ARG A 10 1.557 4.311 -4.184 1.00 1.71 H ATOM 155 HG2 ARG A 10 -0.697 4.528 -5.109 1.00 3.27 H ATOM 156 HG3 ARG A 10 -1.349 4.989 -3.526 1.00 3.40 H ATOM 157 HD2 ARG A 10 0.224 6.966 -3.543 1.00 2.86 H ATOM 158 HD3 ARG A 10 0.583 6.608 -5.231 1.00 3.07 H ATOM 159 HE ARG A 10 -1.829 7.757 -4.057 1.00 5.61 H ATOM 160 HH11 ARG A 10 -0.535 6.147 -6.917 1.00 5.27 H ATOM 161 HH12 ARG A 10 -1.815 6.627 -7.973 1.00 7.60 H ATOM 162 HH21 ARG A 10 -3.577 8.392 -5.430 1.00 8.79 H ATOM 163 HH22 ARG A 10 -3.591 7.942 -7.093 1.00 9.34 H ATOM 164 N ALA A 11 -0.480 3.504 -0.758 1.00 0.21 N ATOM 165 CA ALA A 11 -1.492 3.619 0.271 1.00 0.27 C ATOM 166 C ALA A 11 -1.290 4.928 1.015 1.00 0.29 C ATOM 167 O ALA A 11 -0.150 5.321 1.242 1.00 0.56 O ATOM 168 CB ALA A 11 -1.372 2.443 1.238 1.00 0.41 C ATOM 169 H ALA A 11 0.427 3.884 -0.527 1.00 0.27 H ATOM 170 HA ALA A 11 -2.471 3.609 -0.205 1.00 0.27 H ATOM 171 HB1 ALA A 11 -1.545 1.511 0.704 1.00 1.40 H ATOM 172 HB2 ALA A 11 -0.375 2.440 1.677 1.00 1.81 H ATOM 173 HB3 ALA A 11 -2.113 2.539 2.032 1.00 1.58 H ATOM 174 N PHE A 12 -2.388 5.586 1.391 1.00 0.37 N ATOM 175 CA PHE A 12 -2.375 6.822 2.160 1.00 0.39 C ATOM 176 C PHE A 12 -3.696 6.901 2.930 1.00 0.94 C ATOM 177 O PHE A 12 -4.524 7.767 2.655 1.00 1.35 O ATOM 178 CB PHE A 12 -2.220 8.028 1.218 1.00 0.85 C ATOM 179 CG PHE A 12 -0.804 8.323 0.757 1.00 1.49 C ATOM 180 CD1 PHE A 12 0.044 9.078 1.588 1.00 2.77 C ATOM 181 CD2 PHE A 12 -0.338 7.881 -0.496 1.00 2.01 C ATOM 182 CE1 PHE A 12 1.349 9.392 1.173 1.00 3.58 C ATOM 183 CE2 PHE A 12 0.971 8.193 -0.910 1.00 2.60 C ATOM 184 CZ PHE A 12 1.813 8.949 -0.076 1.00 3.17 C ATOM 185 H PHE A 12 -3.296 5.181 1.209 1.00 0.57 H ATOM 186 HA PHE A 12 -1.548 6.804 2.868 1.00 0.50 H ATOM 187 HB2 PHE A 12 -2.871 7.875 0.359 1.00 1.37 H ATOM 188 HB3 PHE A 12 -2.571 8.927 1.730 1.00 0.71 H ATOM 189 HD1 PHE A 12 -0.308 9.424 2.549 1.00 3.48 H ATOM 190 HD2 PHE A 12 -0.983 7.294 -1.132 1.00 2.69 H ATOM 191 HE1 PHE A 12 1.996 9.973 1.816 1.00 4.77 H ATOM 192 HE2 PHE A 12 1.345 7.854 -1.862 1.00 3.24 H ATOM 193 HZ PHE A 12 2.819 9.188 -0.394 1.00 3.85 H ATOM 194 N TYR A 13 -3.934 5.961 3.846 1.00 1.40 N ATOM 195 CA TYR A 13 -5.187 5.886 4.589 1.00 2.13 C ATOM 196 C TYR A 13 -5.062 4.947 5.781 1.00 2.81 C ATOM 197 O TYR A 13 -4.203 4.040 5.749 1.00 3.21 O ATOM 198 CB TYR A 13 -6.341 5.449 3.680 1.00 3.04 C ATOM 199 CG TYR A 13 -5.917 4.458 2.625 1.00 2.46 C ATOM 200 CD1 TYR A 13 -5.516 3.168 3.001 1.00 2.46 C ATOM 201 CD2 TYR A 13 -5.789 4.878 1.291 1.00 3.71 C ATOM 202 CE1 TYR A 13 -4.988 2.292 2.044 1.00 3.39 C ATOM 203 CE2 TYR A 13 -5.264 4.004 0.327 1.00 4.33 C ATOM 204 CZ TYR A 13 -4.867 2.696 0.696 1.00 4.06 C ATOM 205 OH TYR A 13 -4.318 1.840 -0.212 1.00 5.46 O ATOM 206 OXT TYR A 13 -5.909 5.038 6.694 1.00 3.59 O ATOM 207 H TYR A 13 -3.263 5.232 4.044 1.00 1.54 H ATOM 208 HA TYR A 13 -5.424 6.872 4.953 1.00 1.93 H ATOM 209 HB2 TYR A 13 -7.143 5.022 4.285 1.00 3.87 H ATOM 210 HB3 TYR A 13 -6.745 6.338 3.195 1.00 4.30 H ATOM 211 HD1 TYR A 13 -5.566 2.863 4.035 1.00 3.09 H ATOM 212 HD2 TYR A 13 -6.068 5.886 1.018 1.00 4.84 H ATOM 213 HE1 TYR A 13 -4.645 1.325 2.366 1.00 4.41 H ATOM 214 HE2 TYR A 13 -5.165 4.366 -0.680 1.00 5.65 H ATOM 215 HH TYR A 13 -4.123 2.209 -1.079 1.00 5.99 H TER 216 TYR A 13 ENDMDL MODEL 18 ATOM 1 N ARG A 1 -0.090 3.953 9.314 1.00 6.94 N ATOM 2 CA ARG A 1 -1.301 3.475 8.618 1.00 5.76 C ATOM 3 C ARG A 1 -1.480 2.012 8.996 1.00 3.58 C ATOM 4 O ARG A 1 -0.468 1.339 9.180 1.00 4.08 O ATOM 5 CB ARG A 1 -1.152 3.650 7.099 1.00 7.28 C ATOM 6 CG ARG A 1 -2.516 3.775 6.416 1.00 8.13 C ATOM 7 CD ARG A 1 -3.153 5.130 6.761 1.00 9.50 C ATOM 8 NE ARG A 1 -4.523 4.971 7.258 1.00 10.02 N ATOM 9 CZ ARG A 1 -5.123 5.575 8.287 1.00 10.72 C ATOM 10 NH1 ARG A 1 -4.414 6.237 9.204 1.00 10.89 N ATOM 11 NH2 ARG A 1 -6.446 5.509 8.392 1.00 11.60 N ATOM 12 H1 ARG A 1 0.686 3.362 9.044 1.00 7.26 H ATOM 13 H2 ARG A 1 0.105 4.914 9.076 1.00 8.35 H ATOM 14 H3 ARG A 1 -0.216 3.861 10.312 1.00 6.36 H ATOM 15 HA ARG A 1 -2.162 4.044 8.965 1.00 5.90 H ATOM 16 HB2 ARG A 1 -0.580 4.555 6.885 1.00 8.45 H ATOM 17 HB3 ARG A 1 -0.607 2.801 6.682 1.00 7.11 H ATOM 18 HG2 ARG A 1 -2.382 3.716 5.334 1.00 8.73 H ATOM 19 HG3 ARG A 1 -3.162 2.952 6.724 1.00 7.68 H ATOM 20 HD2 ARG A 1 -2.540 5.665 7.483 1.00 9.68 H ATOM 21 HD3 ARG A 1 -3.196 5.728 5.849 1.00 10.44 H ATOM 22 HE ARG A 1 -5.127 4.485 6.592 1.00 10.32 H ATOM 23 HH11 ARG A 1 -3.435 6.404 9.060 1.00 10.54 H ATOM 24 HH12 ARG A 1 -4.866 6.691 9.984 1.00 11.69 H ATOM 25 HH21 ARG A 1 -6.952 5.226 7.546 1.00 11.99 H ATOM 26 HH22 ARG A 1 -6.978 5.933 9.133 1.00 12.29 H ATOM 27 N LYS A 2 -2.705 1.518 9.201 1.00 2.15 N ATOM 28 CA LYS A 2 -2.845 0.119 9.580 1.00 0.92 C ATOM 29 C LYS A 2 -2.783 -0.709 8.304 1.00 1.15 C ATOM 30 O LYS A 2 -3.779 -0.822 7.598 1.00 2.95 O ATOM 31 CB LYS A 2 -4.134 -0.139 10.371 1.00 2.91 C ATOM 32 CG LYS A 2 -4.028 -1.526 11.021 1.00 4.25 C ATOM 33 CD LYS A 2 -5.340 -1.960 11.674 1.00 6.03 C ATOM 34 CE LYS A 2 -5.113 -3.310 12.365 1.00 7.34 C ATOM 35 NZ LYS A 2 -6.384 -3.969 12.734 1.00 9.17 N ATOM 36 H LYS A 2 -3.542 2.040 8.982 1.00 3.24 H ATOM 37 HA LYS A 2 -2.006 -0.155 10.221 1.00 1.64 H ATOM 38 HB2 LYS A 2 -4.241 0.612 11.154 1.00 3.36 H ATOM 39 HB3 LYS A 2 -5.003 -0.092 9.711 1.00 4.00 H ATOM 40 HG2 LYS A 2 -3.763 -2.267 10.265 1.00 4.77 H ATOM 41 HG3 LYS A 2 -3.241 -1.504 11.776 1.00 4.42 H ATOM 42 HD2 LYS A 2 -5.654 -1.215 12.407 1.00 6.14 H ATOM 43 HD3 LYS A 2 -6.103 -2.056 10.900 1.00 6.88 H ATOM 44 HE2 LYS A 2 -4.555 -3.961 11.689 1.00 7.57 H ATOM 45 HE3 LYS A 2 -4.506 -3.148 13.260 1.00 7.17 H ATOM 46 HZ1 LYS A 2 -6.925 -4.167 11.903 1.00 9.70 H ATOM 47 HZ2 LYS A 2 -6.194 -4.841 13.210 1.00 9.87 H ATOM 48 HZ3 LYS A 2 -6.924 -3.374 13.348 1.00 9.63 H ATOM 49 N SER A 3 -1.609 -1.273 8.032 1.00 0.92 N ATOM 50 CA SER A 3 -1.279 -1.936 6.782 1.00 0.90 C ATOM 51 C SER A 3 -0.918 -0.883 5.736 1.00 0.82 C ATOM 52 O SER A 3 -1.260 0.293 5.871 1.00 1.22 O ATOM 53 CB SER A 3 -2.403 -2.866 6.301 1.00 1.06 C ATOM 54 OG SER A 3 -1.826 -3.937 5.583 1.00 2.26 O ATOM 55 H SER A 3 -0.830 -1.043 8.631 1.00 2.31 H ATOM 56 HA SER A 3 -0.399 -2.551 6.968 1.00 0.95 H ATOM 57 HB2 SER A 3 -2.938 -3.276 7.158 1.00 1.91 H ATOM 58 HB3 SER A 3 -3.101 -2.321 5.664 1.00 1.07 H ATOM 59 HG SER A 3 -2.516 -4.572 5.373 1.00 2.52 H ATOM 60 N ILE A 4 -0.173 -1.311 4.720 1.00 0.46 N ATOM 61 CA ILE A 4 0.361 -0.481 3.665 1.00 0.39 C ATOM 62 C ILE A 4 -0.274 -0.925 2.349 1.00 0.30 C ATOM 63 O ILE A 4 -1.469 -1.196 2.272 1.00 0.32 O ATOM 64 CB ILE A 4 1.901 -0.580 3.689 1.00 0.43 C ATOM 65 CG1 ILE A 4 2.444 -0.718 5.113 1.00 0.57 C ATOM 66 CG2 ILE A 4 2.504 0.697 3.067 1.00 0.42 C ATOM 67 CD1 ILE A 4 2.738 -2.159 5.550 1.00 1.63 C ATOM 68 H ILE A 4 0.205 -2.243 4.742 1.00 0.51 H ATOM 69 HA ILE A 4 0.089 0.556 3.832 1.00 0.42 H ATOM 70 HB ILE A 4 2.246 -1.462 3.147 1.00 0.41 H ATOM 71 HG12 ILE A 4 3.383 -0.207 5.126 1.00 0.88 H ATOM 72 HG13 ILE A 4 1.793 -0.211 5.823 1.00 0.89 H ATOM 73 HG21 ILE A 4 2.032 0.961 2.121 1.00 1.35 H ATOM 74 HG22 ILE A 4 2.366 1.538 3.749 1.00 1.35 H ATOM 75 HG23 ILE A 4 3.572 0.553 2.896 1.00 1.58 H ATOM 76 HD11 ILE A 4 3.546 -2.564 4.939 1.00 2.50 H ATOM 77 HD12 ILE A 4 3.056 -2.160 6.593 1.00 2.15 H ATOM 78 HD13 ILE A 4 1.866 -2.799 5.447 1.00 2.21 H ATOM 79 N ASN A 5 0.544 -0.997 1.311 1.00 0.27 N ATOM 80 CA ASN A 5 0.220 -1.460 -0.015 1.00 0.21 C ATOM 81 C ASN A 5 0.999 -2.751 -0.266 1.00 0.20 C ATOM 82 O ASN A 5 1.964 -3.025 0.444 1.00 0.26 O ATOM 83 CB ASN A 5 0.552 -0.317 -0.967 1.00 0.24 C ATOM 84 CG ASN A 5 0.487 -0.766 -2.397 1.00 0.20 C ATOM 85 OD1 ASN A 5 -0.533 -0.647 -3.057 1.00 0.23 O ATOM 86 ND2 ASN A 5 1.588 -1.311 -2.864 1.00 0.19 N ATOM 87 H ASN A 5 1.519 -0.801 1.467 1.00 0.30 H ATOM 88 HA ASN A 5 -0.831 -1.683 -0.133 1.00 0.22 H ATOM 89 HB2 ASN A 5 -0.169 0.483 -0.834 1.00 0.29 H ATOM 90 HB3 ASN A 5 1.550 0.071 -0.758 1.00 0.28 H ATOM 91 HD21 ASN A 5 2.342 -1.547 -2.233 1.00 0.22 H ATOM 92 HD22 ASN A 5 1.705 -1.446 -3.851 1.00 0.20 H ATOM 93 N ILE A 6 0.566 -3.532 -1.259 1.00 0.17 N ATOM 94 CA ILE A 6 1.269 -4.697 -1.779 1.00 0.21 C ATOM 95 C ILE A 6 2.496 -4.172 -2.554 1.00 0.21 C ATOM 96 O ILE A 6 3.336 -3.474 -1.992 1.00 0.35 O ATOM 97 CB ILE A 6 0.283 -5.520 -2.645 1.00 0.24 C ATOM 98 CG1 ILE A 6 -1.000 -5.890 -1.872 1.00 0.31 C ATOM 99 CG2 ILE A 6 0.893 -6.828 -3.191 1.00 0.31 C ATOM 100 CD1 ILE A 6 -2.115 -6.344 -2.819 1.00 1.42 C ATOM 101 H ILE A 6 -0.236 -3.219 -1.787 1.00 0.17 H ATOM 102 HA ILE A 6 1.616 -5.306 -0.944 1.00 0.28 H ATOM 103 HB ILE A 6 -0.011 -4.895 -3.490 1.00 0.21 H ATOM 104 HG12 ILE A 6 -0.784 -6.683 -1.155 1.00 0.98 H ATOM 105 HG13 ILE A 6 -1.380 -5.036 -1.315 1.00 0.92 H ATOM 106 HG21 ILE A 6 1.971 -6.762 -3.317 1.00 1.30 H ATOM 107 HG22 ILE A 6 0.707 -7.652 -2.503 1.00 1.30 H ATOM 108 HG23 ILE A 6 0.441 -7.061 -4.154 1.00 1.47 H ATOM 109 HD11 ILE A 6 -2.981 -6.657 -2.235 1.00 2.10 H ATOM 110 HD12 ILE A 6 -2.406 -5.513 -3.464 1.00 2.24 H ATOM 111 HD13 ILE A 6 -1.785 -7.180 -3.434 1.00 2.50 H ATOM 112 N GLY A 7 2.598 -4.445 -3.856 1.00 0.22 N ATOM 113 CA GLY A 7 3.719 -4.018 -4.676 1.00 0.23 C ATOM 114 C GLY A 7 3.274 -2.862 -5.557 1.00 0.18 C ATOM 115 O GLY A 7 3.407 -1.709 -5.155 1.00 0.17 O ATOM 116 H GLY A 7 1.866 -4.970 -4.307 1.00 0.31 H ATOM 117 HA2 GLY A 7 4.546 -3.685 -4.048 1.00 0.26 H ATOM 118 HA3 GLY A 7 4.068 -4.849 -5.288 1.00 0.29 H ATOM 119 N PRO A 8 2.712 -3.141 -6.739 1.00 0.21 N ATOM 120 CA PRO A 8 2.302 -2.115 -7.682 1.00 0.25 C ATOM 121 C PRO A 8 1.088 -1.352 -7.142 1.00 0.22 C ATOM 122 O PRO A 8 -0.054 -1.709 -7.419 1.00 0.26 O ATOM 123 CB PRO A 8 2.006 -2.873 -8.980 1.00 0.33 C ATOM 124 CG PRO A 8 1.566 -4.255 -8.492 1.00 0.31 C ATOM 125 CD PRO A 8 2.438 -4.470 -7.255 1.00 0.26 C ATOM 126 HA PRO A 8 3.119 -1.413 -7.853 1.00 0.27 H ATOM 127 HB2 PRO A 8 1.238 -2.390 -9.586 1.00 0.38 H ATOM 128 HB3 PRO A 8 2.928 -2.976 -9.554 1.00 0.38 H ATOM 129 HG2 PRO A 8 0.515 -4.227 -8.199 1.00 0.30 H ATOM 130 HG3 PRO A 8 1.735 -5.026 -9.244 1.00 0.38 H ATOM 131 HD2 PRO A 8 1.908 -5.082 -6.524 1.00 0.24 H ATOM 132 HD3 PRO A 8 3.374 -4.947 -7.543 1.00 0.33 H ATOM 133 N GLY A 9 1.336 -0.298 -6.365 1.00 0.18 N ATOM 134 CA GLY A 9 0.300 0.517 -5.754 1.00 0.20 C ATOM 135 C GLY A 9 0.917 1.406 -4.675 1.00 0.21 C ATOM 136 O GLY A 9 2.127 1.374 -4.459 1.00 0.33 O ATOM 137 H GLY A 9 2.288 -0.099 -6.075 1.00 0.17 H ATOM 138 HA2 GLY A 9 -0.169 1.139 -6.513 1.00 0.28 H ATOM 139 HA3 GLY A 9 -0.455 -0.137 -5.317 1.00 0.19 H ATOM 140 N ARG A 10 0.091 2.199 -3.990 1.00 0.20 N ATOM 141 CA ARG A 10 0.463 3.057 -2.866 1.00 0.21 C ATOM 142 C ARG A 10 -0.744 3.107 -1.937 1.00 0.20 C ATOM 143 O ARG A 10 -1.856 2.814 -2.369 1.00 0.24 O ATOM 144 CB ARG A 10 0.788 4.478 -3.362 1.00 0.32 C ATOM 145 CG ARG A 10 2.198 4.663 -3.945 1.00 1.57 C ATOM 146 CD ARG A 10 3.211 5.059 -2.864 1.00 2.66 C ATOM 147 NE ARG A 10 4.522 5.365 -3.460 1.00 3.57 N ATOM 148 CZ ARG A 10 5.393 6.287 -3.022 1.00 4.42 C ATOM 149 NH1 ARG A 10 5.167 6.948 -1.885 1.00 4.97 N ATOM 150 NH2 ARG A 10 6.495 6.549 -3.727 1.00 5.41 N ATOM 151 H ARG A 10 -0.907 2.108 -4.149 1.00 0.25 H ATOM 152 HA ARG A 10 1.302 2.621 -2.322 1.00 0.25 H ATOM 153 HB2 ARG A 10 0.059 4.745 -4.128 1.00 1.26 H ATOM 154 HB3 ARG A 10 0.664 5.186 -2.542 1.00 1.27 H ATOM 155 HG2 ARG A 10 2.531 3.761 -4.451 1.00 2.29 H ATOM 156 HG3 ARG A 10 2.158 5.466 -4.682 1.00 2.56 H ATOM 157 HD2 ARG A 10 2.825 5.942 -2.356 1.00 3.14 H ATOM 158 HD3 ARG A 10 3.315 4.247 -2.143 1.00 3.41 H ATOM 159 HE ARG A 10 4.738 4.841 -4.295 1.00 4.12 H ATOM 160 HH11 ARG A 10 4.371 6.707 -1.318 1.00 4.79 H ATOM 161 HH12 ARG A 10 5.793 7.663 -1.547 1.00 5.98 H ATOM 162 HH21 ARG A 10 6.686 6.065 -4.592 1.00 5.73 H ATOM 163 HH22 ARG A 10 7.167 7.239 -3.426 1.00 6.22 H ATOM 164 N ALA A 11 -0.544 3.499 -0.678 1.00 0.22 N ATOM 165 CA ALA A 11 -1.630 3.611 0.275 1.00 0.22 C ATOM 166 C ALA A 11 -1.363 4.791 1.196 1.00 0.33 C ATOM 167 O ALA A 11 -0.236 4.954 1.653 1.00 0.78 O ATOM 168 CB ALA A 11 -1.702 2.339 1.107 1.00 0.29 C ATOM 169 H ALA A 11 0.369 3.763 -0.335 1.00 0.29 H ATOM 170 HA ALA A 11 -2.573 3.753 -0.255 1.00 0.23 H ATOM 171 HB1 ALA A 11 -1.930 1.492 0.461 1.00 1.63 H ATOM 172 HB2 ALA A 11 -0.741 2.182 1.599 1.00 1.50 H ATOM 173 HB3 ALA A 11 -2.484 2.457 1.857 1.00 1.61 H ATOM 174 N PHE A 12 -2.397 5.590 1.466 1.00 0.34 N ATOM 175 CA PHE A 12 -2.306 6.783 2.302 1.00 0.33 C ATOM 176 C PHE A 12 -3.682 7.161 2.869 1.00 1.08 C ATOM 177 O PHE A 12 -3.974 8.338 3.062 1.00 1.57 O ATOM 178 CB PHE A 12 -1.726 7.941 1.470 1.00 1.05 C ATOM 179 CG PHE A 12 -0.224 7.911 1.283 1.00 1.88 C ATOM 180 CD1 PHE A 12 0.614 8.137 2.389 1.00 3.24 C ATOM 181 CD2 PHE A 12 0.339 7.717 0.008 1.00 2.29 C ATOM 182 CE1 PHE A 12 2.007 8.206 2.220 1.00 4.22 C ATOM 183 CE2 PHE A 12 1.731 7.810 -0.167 1.00 3.06 C ATOM 184 CZ PHE A 12 2.566 8.057 0.939 1.00 3.87 C ATOM 185 H PHE A 12 -3.297 5.350 1.081 1.00 0.67 H ATOM 186 HA PHE A 12 -1.640 6.579 3.139 1.00 0.62 H ATOM 187 HB2 PHE A 12 -2.225 7.971 0.500 1.00 1.65 H ATOM 188 HB3 PHE A 12 -1.941 8.887 1.967 1.00 0.90 H ATOM 189 HD1 PHE A 12 0.182 8.268 3.369 1.00 3.84 H ATOM 190 HD2 PHE A 12 -0.305 7.512 -0.834 1.00 2.75 H ATOM 191 HE1 PHE A 12 2.644 8.393 3.073 1.00 5.46 H ATOM 192 HE2 PHE A 12 2.149 7.718 -1.155 1.00 3.56 H ATOM 193 HZ PHE A 12 3.635 8.143 0.814 1.00 4.66 H ATOM 194 N TYR A 13 -4.537 6.181 3.155 1.00 2.09 N ATOM 195 CA TYR A 13 -5.828 6.412 3.788 1.00 2.94 C ATOM 196 C TYR A 13 -6.099 5.247 4.731 1.00 3.82 C ATOM 197 O TYR A 13 -6.930 5.393 5.654 1.00 4.99 O ATOM 198 CB TYR A 13 -6.921 6.641 2.746 1.00 4.25 C ATOM 199 CG TYR A 13 -7.395 5.358 2.129 1.00 3.48 C ATOM 200 CD1 TYR A 13 -6.701 4.794 1.048 1.00 3.49 C ATOM 201 CD2 TYR A 13 -8.460 4.673 2.731 1.00 3.75 C ATOM 202 CE1 TYR A 13 -7.073 3.529 0.570 1.00 3.33 C ATOM 203 CE2 TYR A 13 -8.838 3.413 2.257 1.00 3.72 C ATOM 204 CZ TYR A 13 -8.146 2.831 1.168 1.00 3.29 C ATOM 205 OH TYR A 13 -8.495 1.600 0.700 1.00 3.97 O ATOM 206 OXT TYR A 13 -5.332 4.262 4.648 1.00 4.12 O ATOM 207 H TYR A 13 -4.272 5.204 3.125 1.00 2.54 H ATOM 208 HA TYR A 13 -5.786 7.304 4.391 1.00 2.44 H ATOM 209 HB2 TYR A 13 -7.765 7.129 3.235 1.00 5.42 H ATOM 210 HB3 TYR A 13 -6.556 7.317 1.971 1.00 5.42 H ATOM 211 HD1 TYR A 13 -5.869 5.321 0.607 1.00 4.34 H ATOM 212 HD2 TYR A 13 -8.955 5.098 3.593 1.00 4.61 H ATOM 213 HE1 TYR A 13 -6.518 3.090 -0.239 1.00 4.04 H ATOM 214 HE2 TYR A 13 -9.633 2.909 2.774 1.00 4.64 H ATOM 215 HH TYR A 13 -9.237 1.213 1.168 1.00 4.25 H TER 216 TYR A 13 ENDMDL MODEL 19 ATOM 1 N ARG A 1 -6.076 1.359 10.988 1.00 5.20 N ATOM 2 CA ARG A 1 -5.130 1.973 10.038 1.00 4.66 C ATOM 3 C ARG A 1 -3.749 1.410 10.351 1.00 2.69 C ATOM 4 O ARG A 1 -3.480 1.234 11.534 1.00 2.66 O ATOM 5 CB ARG A 1 -5.172 3.512 10.104 1.00 6.19 C ATOM 6 CG ARG A 1 -4.974 4.140 11.500 1.00 6.71 C ATOM 7 CD ARG A 1 -6.299 4.564 12.153 1.00 8.19 C ATOM 8 NE ARG A 1 -6.105 5.051 13.529 1.00 9.16 N ATOM 9 CZ ARG A 1 -5.641 6.258 13.886 1.00 10.50 C ATOM 10 NH1 ARG A 1 -5.312 7.156 12.957 1.00 11.10 N ATOM 11 NH2 ARG A 1 -5.507 6.565 15.177 1.00 11.58 N ATOM 12 H1 ARG A 1 -5.752 1.552 11.928 1.00 5.08 H ATOM 13 H2 ARG A 1 -7.008 1.720 10.848 1.00 6.53 H ATOM 14 H3 ARG A 1 -6.072 0.356 10.865 1.00 4.93 H ATOM 15 HA ARG A 1 -5.404 1.676 9.024 1.00 5.31 H ATOM 16 HB2 ARG A 1 -4.394 3.894 9.441 1.00 6.87 H ATOM 17 HB3 ARG A 1 -6.128 3.851 9.699 1.00 7.08 H ATOM 18 HG2 ARG A 1 -4.450 3.452 12.161 1.00 6.27 H ATOM 19 HG3 ARG A 1 -4.350 5.027 11.388 1.00 7.18 H ATOM 20 HD2 ARG A 1 -6.774 5.341 11.551 1.00 9.05 H ATOM 21 HD3 ARG A 1 -6.975 3.709 12.187 1.00 8.20 H ATOM 22 HE ARG A 1 -6.378 4.408 14.259 1.00 9.12 H ATOM 23 HH11 ARG A 1 -5.429 6.939 11.980 1.00 10.58 H ATOM 24 HH12 ARG A 1 -4.954 8.068 13.193 1.00 12.32 H ATOM 25 HH21 ARG A 1 -5.751 5.909 15.905 1.00 11.48 H ATOM 26 HH22 ARG A 1 -5.157 7.465 15.472 1.00 12.74 H ATOM 27 N LYS A 2 -2.943 1.064 9.336 1.00 1.93 N ATOM 28 CA LYS A 2 -1.585 0.501 9.430 1.00 0.84 C ATOM 29 C LYS A 2 -1.224 -0.303 8.189 1.00 1.04 C ATOM 30 O LYS A 2 -0.092 -0.230 7.727 1.00 2.41 O ATOM 31 CB LYS A 2 -1.292 -0.343 10.688 1.00 2.05 C ATOM 32 CG LYS A 2 -2.255 -1.519 10.943 1.00 3.62 C ATOM 33 CD LYS A 2 -1.483 -2.841 11.060 1.00 5.31 C ATOM 34 CE LYS A 2 -2.393 -3.984 11.525 1.00 6.92 C ATOM 35 NZ LYS A 2 -3.274 -4.483 10.447 1.00 8.22 N ATOM 36 H LYS A 2 -3.243 1.286 8.392 1.00 3.07 H ATOM 37 HA LYS A 2 -0.892 1.344 9.451 1.00 2.08 H ATOM 38 HB2 LYS A 2 -0.279 -0.736 10.580 1.00 3.01 H ATOM 39 HB3 LYS A 2 -1.261 0.300 11.569 1.00 3.00 H ATOM 40 HG2 LYS A 2 -2.784 -1.341 11.879 1.00 4.12 H ATOM 41 HG3 LYS A 2 -2.992 -1.598 10.146 1.00 4.24 H ATOM 42 HD2 LYS A 2 -1.023 -3.093 10.104 1.00 5.66 H ATOM 43 HD3 LYS A 2 -0.692 -2.718 11.802 1.00 5.80 H ATOM 44 HE2 LYS A 2 -1.764 -4.805 11.879 1.00 7.71 H ATOM 45 HE3 LYS A 2 -2.992 -3.635 12.369 1.00 6.92 H ATOM 46 HZ1 LYS A 2 -3.888 -5.200 10.810 1.00 9.11 H ATOM 47 HZ2 LYS A 2 -3.829 -3.733 10.061 1.00 8.18 H ATOM 48 HZ3 LYS A 2 -2.720 -4.878 9.697 1.00 8.75 H ATOM 49 N SER A 3 -2.154 -1.110 7.680 1.00 0.51 N ATOM 50 CA SER A 3 -1.908 -1.906 6.494 1.00 0.49 C ATOM 51 C SER A 3 -1.556 -0.976 5.338 1.00 0.48 C ATOM 52 O SER A 3 -2.277 -0.018 5.074 1.00 0.65 O ATOM 53 CB SER A 3 -3.156 -2.731 6.185 1.00 0.60 C ATOM 54 OG SER A 3 -3.565 -3.457 7.338 1.00 2.00 O ATOM 55 H SER A 3 -3.071 -1.181 8.086 1.00 1.55 H ATOM 56 HA SER A 3 -1.062 -2.570 6.675 1.00 0.49 H ATOM 57 HB2 SER A 3 -3.964 -2.064 5.877 1.00 1.28 H ATOM 58 HB3 SER A 3 -2.939 -3.419 5.368 1.00 1.45 H ATOM 59 HG SER A 3 -4.254 -4.062 7.038 1.00 2.41 H ATOM 60 N ILE A 4 -0.422 -1.247 4.696 1.00 0.36 N ATOM 61 CA ILE A 4 0.115 -0.442 3.622 1.00 0.33 C ATOM 62 C ILE A 4 -0.490 -0.945 2.311 1.00 0.30 C ATOM 63 O ILE A 4 -1.653 -1.335 2.239 1.00 0.37 O ATOM 64 CB ILE A 4 1.660 -0.497 3.655 1.00 0.35 C ATOM 65 CG1 ILE A 4 2.242 -0.533 5.073 1.00 0.43 C ATOM 66 CG2 ILE A 4 2.234 0.773 2.988 1.00 0.36 C ATOM 67 CD1 ILE A 4 2.597 -1.935 5.592 1.00 1.49 C ATOM 68 H ILE A 4 0.138 -2.029 4.982 1.00 0.36 H ATOM 69 HA ILE A 4 -0.182 0.593 3.763 1.00 0.35 H ATOM 70 HB ILE A 4 2.014 -1.391 3.142 1.00 0.34 H ATOM 71 HG12 ILE A 4 3.167 0.022 5.046 1.00 0.82 H ATOM 72 HG13 ILE A 4 1.577 -0.018 5.760 1.00 0.89 H ATOM 73 HG21 ILE A 4 2.093 1.627 3.654 1.00 1.34 H ATOM 74 HG22 ILE A 4 3.302 0.643 2.806 1.00 1.41 H ATOM 75 HG23 ILE A 4 1.744 1.014 2.049 1.00 1.44 H ATOM 76 HD11 ILE A 4 3.241 -2.442 4.874 1.00 2.37 H ATOM 77 HD12 ILE A 4 3.135 -1.837 6.536 1.00 2.06 H ATOM 78 HD13 ILE A 4 1.711 -2.539 5.768 1.00 2.08 H ATOM 79 N ASN A 5 0.326 -0.952 1.267 1.00 0.25 N ATOM 80 CA ASN A 5 0.024 -1.442 -0.053 1.00 0.23 C ATOM 81 C ASN A 5 0.876 -2.687 -0.285 1.00 0.18 C ATOM 82 O ASN A 5 1.858 -2.891 0.425 1.00 0.21 O ATOM 83 CB ASN A 5 0.307 -0.299 -1.020 1.00 0.28 C ATOM 84 CG ASN A 5 0.211 -0.768 -2.442 1.00 0.31 C ATOM 85 OD1 ASN A 5 -0.832 -0.695 -3.070 1.00 0.36 O ATOM 86 ND2 ASN A 5 1.310 -1.280 -2.944 1.00 0.32 N ATOM 87 H ASN A 5 1.295 -0.730 1.422 1.00 0.27 H ATOM 88 HA ASN A 5 -1.015 -1.719 -0.168 1.00 0.26 H ATOM 89 HB2 ASN A 5 -0.433 0.481 -0.880 1.00 0.32 H ATOM 90 HB3 ASN A 5 1.300 0.115 -0.840 1.00 0.30 H ATOM 91 HD21 ASN A 5 2.109 -1.468 -2.348 1.00 0.31 H ATOM 92 HD22 ASN A 5 1.339 -1.525 -3.909 1.00 0.41 H ATOM 93 N ILE A 6 0.493 -3.505 -1.268 1.00 0.16 N ATOM 94 CA ILE A 6 1.282 -4.621 -1.766 1.00 0.19 C ATOM 95 C ILE A 6 2.493 -4.051 -2.535 1.00 0.22 C ATOM 96 O ILE A 6 3.204 -3.184 -2.029 1.00 0.50 O ATOM 97 CB ILE A 6 0.360 -5.541 -2.589 1.00 0.24 C ATOM 98 CG1 ILE A 6 -0.885 -5.927 -1.770 1.00 0.33 C ATOM 99 CG2 ILE A 6 1.070 -6.823 -3.065 1.00 0.32 C ATOM 100 CD1 ILE A 6 -0.581 -6.521 -0.389 1.00 2.67 C ATOM 101 H ILE A 6 -0.333 -3.267 -1.796 1.00 0.20 H ATOM 102 HA ILE A 6 1.642 -5.201 -0.919 1.00 0.25 H ATOM 103 HB ILE A 6 0.013 -4.996 -3.469 1.00 0.24 H ATOM 104 HG12 ILE A 6 -1.538 -5.062 -1.646 1.00 1.66 H ATOM 105 HG13 ILE A 6 -1.438 -6.662 -2.339 1.00 1.92 H ATOM 106 HG21 ILE A 6 0.487 -7.707 -2.809 1.00 1.56 H ATOM 107 HG22 ILE A 6 1.173 -6.809 -4.150 1.00 1.69 H ATOM 108 HG23 ILE A 6 2.050 -6.914 -2.598 1.00 1.80 H ATOM 109 HD11 ILE A 6 -0.193 -5.750 0.278 1.00 3.81 H ATOM 110 HD12 ILE A 6 -1.502 -6.916 0.040 1.00 3.20 H ATOM 111 HD13 ILE A 6 0.144 -7.329 -0.474 1.00 3.71 H ATOM 112 N GLY A 7 2.731 -4.480 -3.775 1.00 0.21 N ATOM 113 CA GLY A 7 3.849 -4.005 -4.573 1.00 0.19 C ATOM 114 C GLY A 7 3.393 -2.857 -5.464 1.00 0.13 C ATOM 115 O GLY A 7 3.570 -1.696 -5.101 1.00 0.16 O ATOM 116 H GLY A 7 2.107 -5.142 -4.200 1.00 0.42 H ATOM 117 HA2 GLY A 7 4.651 -3.652 -3.924 1.00 0.21 H ATOM 118 HA3 GLY A 7 4.239 -4.820 -5.182 1.00 0.25 H ATOM 119 N PRO A 8 2.794 -3.156 -6.624 1.00 0.14 N ATOM 120 CA PRO A 8 2.392 -2.150 -7.590 1.00 0.18 C ATOM 121 C PRO A 8 1.173 -1.382 -7.073 1.00 0.19 C ATOM 122 O PRO A 8 0.035 -1.725 -7.380 1.00 0.24 O ATOM 123 CB PRO A 8 2.105 -2.936 -8.876 1.00 0.25 C ATOM 124 CG PRO A 8 1.646 -4.300 -8.362 1.00 0.25 C ATOM 125 CD PRO A 8 2.484 -4.493 -7.099 1.00 0.19 C ATOM 126 HA PRO A 8 3.208 -1.449 -7.770 1.00 0.21 H ATOM 127 HB2 PRO A 8 1.350 -2.458 -9.503 1.00 0.30 H ATOM 128 HB3 PRO A 8 3.034 -3.059 -9.435 1.00 0.28 H ATOM 129 HG2 PRO A 8 0.588 -4.260 -8.099 1.00 0.26 H ATOM 130 HG3 PRO A 8 1.828 -5.091 -9.091 1.00 0.29 H ATOM 131 HD2 PRO A 8 1.916 -5.056 -6.358 1.00 0.20 H ATOM 132 HD3 PRO A 8 3.408 -5.015 -7.347 1.00 0.21 H ATOM 133 N GLY A 9 1.409 -0.341 -6.276 1.00 0.19 N ATOM 134 CA GLY A 9 0.362 0.488 -5.707 1.00 0.22 C ATOM 135 C GLY A 9 0.947 1.401 -4.634 1.00 0.25 C ATOM 136 O GLY A 9 2.156 1.396 -4.399 1.00 0.37 O ATOM 137 H GLY A 9 2.356 -0.145 -5.968 1.00 0.18 H ATOM 138 HA2 GLY A 9 -0.092 1.094 -6.489 1.00 0.28 H ATOM 139 HA3 GLY A 9 -0.405 -0.154 -5.274 1.00 0.21 H ATOM 140 N ARG A 10 0.093 2.176 -3.966 1.00 0.22 N ATOM 141 CA ARG A 10 0.435 3.012 -2.821 1.00 0.23 C ATOM 142 C ARG A 10 -0.784 3.039 -1.908 1.00 0.20 C ATOM 143 O ARG A 10 -1.877 2.677 -2.335 1.00 0.22 O ATOM 144 CB ARG A 10 0.785 4.441 -3.272 1.00 0.35 C ATOM 145 CG ARG A 10 2.207 4.631 -3.823 1.00 1.59 C ATOM 146 CD ARG A 10 3.275 4.797 -2.729 1.00 2.86 C ATOM 147 NE ARG A 10 3.546 3.570 -1.961 1.00 4.53 N ATOM 148 CZ ARG A 10 4.325 2.553 -2.359 1.00 5.75 C ATOM 149 NH1 ARG A 10 4.870 2.557 -3.574 1.00 5.66 N ATOM 150 NH2 ARG A 10 4.576 1.540 -1.528 1.00 7.59 N ATOM 151 H ARG A 10 -0.902 2.066 -4.139 1.00 0.25 H ATOM 152 HA ARG A 10 1.262 2.558 -2.277 1.00 0.26 H ATOM 153 HB2 ARG A 10 0.071 4.738 -4.042 1.00 1.21 H ATOM 154 HB3 ARG A 10 0.658 5.128 -2.434 1.00 1.31 H ATOM 155 HG2 ARG A 10 2.471 3.822 -4.500 1.00 2.27 H ATOM 156 HG3 ARG A 10 2.207 5.550 -4.410 1.00 2.58 H ATOM 157 HD2 ARG A 10 4.202 5.140 -3.190 1.00 3.74 H ATOM 158 HD3 ARG A 10 2.949 5.577 -2.040 1.00 2.85 H ATOM 159 HE ARG A 10 3.177 3.566 -1.021 1.00 5.30 H ATOM 160 HH11 ARG A 10 4.619 3.283 -4.225 1.00 4.78 H ATOM 161 HH12 ARG A 10 5.416 1.785 -3.919 1.00 6.86 H ATOM 162 HH21 ARG A 10 4.209 1.524 -0.589 1.00 8.22 H ATOM 163 HH22 ARG A 10 5.145 0.758 -1.817 1.00 8.61 H ATOM 164 N ALA A 11 -0.604 3.468 -0.660 1.00 0.23 N ATOM 165 CA ALA A 11 -1.677 3.560 0.309 1.00 0.25 C ATOM 166 C ALA A 11 -1.404 4.768 1.189 1.00 0.33 C ATOM 167 O ALA A 11 -0.247 5.008 1.529 1.00 0.69 O ATOM 168 CB ALA A 11 -1.696 2.299 1.166 1.00 0.30 C ATOM 169 H ALA A 11 0.285 3.821 -0.338 1.00 0.29 H ATOM 170 HA ALA A 11 -2.630 3.674 -0.211 1.00 0.24 H ATOM 171 HB1 ALA A 11 -2.434 2.410 1.961 1.00 1.68 H ATOM 172 HB2 ALA A 11 -1.956 1.438 0.552 1.00 1.61 H ATOM 173 HB3 ALA A 11 -0.710 2.153 1.609 1.00 1.55 H ATOM 174 N PHE A 12 -2.451 5.509 1.554 1.00 0.31 N ATOM 175 CA PHE A 12 -2.342 6.697 2.386 1.00 0.30 C ATOM 176 C PHE A 12 -3.641 6.876 3.176 1.00 0.83 C ATOM 177 O PHE A 12 -4.329 7.884 3.030 1.00 1.25 O ATOM 178 CB PHE A 12 -2.057 7.919 1.498 1.00 0.83 C ATOM 179 CG PHE A 12 -0.644 7.993 0.954 1.00 1.55 C ATOM 180 CD1 PHE A 12 0.400 8.406 1.803 1.00 2.87 C ATOM 181 CD2 PHE A 12 -0.365 7.676 -0.390 1.00 1.99 C ATOM 182 CE1 PHE A 12 1.710 8.524 1.309 1.00 3.63 C ATOM 183 CE2 PHE A 12 0.945 7.804 -0.887 1.00 2.59 C ATOM 184 CZ PHE A 12 1.982 8.231 -0.038 1.00 3.19 C ATOM 185 H PHE A 12 -3.378 5.244 1.252 1.00 0.58 H ATOM 186 HA PHE A 12 -1.520 6.569 3.091 1.00 0.58 H ATOM 187 HB2 PHE A 12 -2.772 7.927 0.676 1.00 1.27 H ATOM 188 HB3 PHE A 12 -2.221 8.827 2.080 1.00 0.70 H ATOM 189 HD1 PHE A 12 0.191 8.637 2.836 1.00 3.60 H ATOM 190 HD2 PHE A 12 -1.160 7.338 -1.038 1.00 2.62 H ATOM 191 HE1 PHE A 12 2.504 8.850 1.966 1.00 4.82 H ATOM 192 HE2 PHE A 12 1.154 7.589 -1.923 1.00 3.21 H ATOM 193 HZ PHE A 12 2.987 8.341 -0.418 1.00 3.84 H ATOM 194 N TYR A 13 -3.998 5.880 3.989 1.00 1.41 N ATOM 195 CA TYR A 13 -5.175 5.890 4.851 1.00 2.06 C ATOM 196 C TYR A 13 -5.001 4.847 5.960 1.00 2.77 C ATOM 197 O TYR A 13 -4.047 4.047 5.827 1.00 3.12 O ATOM 198 CB TYR A 13 -6.474 5.744 4.045 1.00 3.08 C ATOM 199 CG TYR A 13 -6.866 4.333 3.692 1.00 2.33 C ATOM 200 CD1 TYR A 13 -5.891 3.408 3.291 1.00 2.30 C ATOM 201 CD2 TYR A 13 -8.206 3.935 3.822 1.00 3.32 C ATOM 202 CE1 TYR A 13 -6.242 2.075 3.063 1.00 2.97 C ATOM 203 CE2 TYR A 13 -8.569 2.602 3.578 1.00 3.63 C ATOM 204 CZ TYR A 13 -7.584 1.659 3.200 1.00 3.34 C ATOM 205 OH TYR A 13 -7.915 0.355 2.986 1.00 4.51 O ATOM 206 OXT TYR A 13 -5.780 4.882 6.939 1.00 3.52 O ATOM 207 H TYR A 13 -3.387 5.089 4.146 1.00 1.63 H ATOM 208 HA TYR A 13 -5.240 6.847 5.332 1.00 1.79 H ATOM 209 HB2 TYR A 13 -7.272 6.179 4.646 1.00 4.34 H ATOM 210 HB3 TYR A 13 -6.411 6.331 3.128 1.00 4.21 H ATOM 211 HD1 TYR A 13 -4.856 3.690 3.211 1.00 2.99 H ATOM 212 HD2 TYR A 13 -8.954 4.649 4.135 1.00 4.49 H ATOM 213 HE1 TYR A 13 -5.451 1.393 2.818 1.00 4.03 H ATOM 214 HE2 TYR A 13 -9.597 2.329 3.714 1.00 4.78 H ATOM 215 HH TYR A 13 -8.855 0.185 3.060 1.00 4.89 H TER 216 TYR A 13 ENDMDL MODEL 20 ATOM 1 N ARG A 1 -5.521 2.342 10.938 1.00 5.24 N ATOM 2 CA ARG A 1 -4.737 2.667 9.735 1.00 4.90 C ATOM 3 C ARG A 1 -3.339 2.123 9.968 1.00 3.04 C ATOM 4 O ARG A 1 -2.709 2.541 10.934 1.00 3.31 O ATOM 5 CB ARG A 1 -4.707 4.181 9.469 1.00 6.59 C ATOM 6 CG ARG A 1 -6.099 4.719 9.117 1.00 7.80 C ATOM 7 CD ARG A 1 -6.970 5.104 10.322 1.00 8.89 C ATOM 8 NE ARG A 1 -8.335 4.570 10.186 1.00 9.87 N ATOM 9 CZ ARG A 1 -9.327 4.733 11.071 1.00 10.96 C ATOM 10 NH1 ARG A 1 -9.127 5.448 12.178 1.00 11.38 N ATOM 11 NH2 ARG A 1 -10.518 4.172 10.852 1.00 11.94 N ATOM 12 H1 ARG A 1 -5.079 2.784 11.734 1.00 5.32 H ATOM 13 H2 ARG A 1 -6.472 2.665 10.837 1.00 6.54 H ATOM 14 H3 ARG A 1 -5.515 1.343 11.086 1.00 4.66 H ATOM 15 HA ARG A 1 -5.172 2.174 8.863 1.00 5.43 H ATOM 16 HB2 ARG A 1 -4.303 4.720 10.328 1.00 7.19 H ATOM 17 HB3 ARG A 1 -4.051 4.358 8.615 1.00 6.90 H ATOM 18 HG2 ARG A 1 -5.981 5.610 8.500 1.00 8.41 H ATOM 19 HG3 ARG A 1 -6.608 3.955 8.530 1.00 7.76 H ATOM 20 HD2 ARG A 1 -6.525 4.730 11.244 1.00 8.62 H ATOM 21 HD3 ARG A 1 -7.016 6.192 10.385 1.00 9.70 H ATOM 22 HE ARG A 1 -8.541 4.143 9.290 1.00 10.06 H ATOM 23 HH11 ARG A 1 -8.248 5.922 12.321 1.00 10.91 H ATOM 24 HH12 ARG A 1 -9.857 5.601 12.857 1.00 12.42 H ATOM 25 HH21 ARG A 1 -10.697 3.630 10.019 1.00 12.01 H ATOM 26 HH22 ARG A 1 -11.285 4.286 11.498 1.00 12.86 H ATOM 27 N LYS A 2 -2.904 1.125 9.194 1.00 2.01 N ATOM 28 CA LYS A 2 -1.574 0.540 9.367 1.00 0.86 C ATOM 29 C LYS A 2 -1.201 -0.315 8.164 1.00 1.05 C ATOM 30 O LYS A 2 -0.054 -0.284 7.734 1.00 2.42 O ATOM 31 CB LYS A 2 -1.465 -0.300 10.656 1.00 1.97 C ATOM 32 CG LYS A 2 -0.004 -0.326 11.150 1.00 3.40 C ATOM 33 CD LYS A 2 0.111 0.137 12.611 1.00 4.42 C ATOM 34 CE LYS A 2 1.506 0.693 12.925 1.00 5.75 C ATOM 35 NZ LYS A 2 2.563 -0.341 12.899 1.00 7.24 N ATOM 36 H LYS A 2 -3.417 0.886 8.356 1.00 3.07 H ATOM 37 HA LYS A 2 -0.870 1.372 9.419 1.00 2.11 H ATOM 38 HB2 LYS A 2 -2.105 0.119 11.429 1.00 2.45 H ATOM 39 HB3 LYS A 2 -1.808 -1.320 10.470 1.00 2.98 H ATOM 40 HG2 LYS A 2 0.400 -1.335 11.051 1.00 4.44 H ATOM 41 HG3 LYS A 2 0.606 0.335 10.534 1.00 3.76 H ATOM 42 HD2 LYS A 2 -0.598 0.948 12.786 1.00 4.24 H ATOM 43 HD3 LYS A 2 -0.134 -0.687 13.282 1.00 5.36 H ATOM 44 HE2 LYS A 2 1.740 1.473 12.196 1.00 5.90 H ATOM 45 HE3 LYS A 2 1.478 1.155 13.914 1.00 6.10 H ATOM 46 HZ1 LYS A 2 2.378 -1.046 13.601 1.00 7.91 H ATOM 47 HZ2 LYS A 2 2.604 -0.778 11.988 1.00 7.55 H ATOM 48 HZ3 LYS A 2 3.459 0.084 13.097 1.00 7.83 H ATOM 49 N SER A 3 -2.158 -1.089 7.644 1.00 0.50 N ATOM 50 CA SER A 3 -1.969 -1.815 6.398 1.00 0.46 C ATOM 51 C SER A 3 -1.513 -0.840 5.321 1.00 0.41 C ATOM 52 O SER A 3 -2.137 0.200 5.120 1.00 0.52 O ATOM 53 CB SER A 3 -3.268 -2.512 5.975 1.00 0.52 C ATOM 54 OG SER A 3 -3.059 -3.906 5.933 1.00 1.63 O ATOM 55 H SER A 3 -3.057 -1.153 8.088 1.00 1.54 H ATOM 56 HA SER A 3 -1.185 -2.560 6.544 1.00 0.50 H ATOM 57 HB2 SER A 3 -4.066 -2.296 6.685 1.00 1.32 H ATOM 58 HB3 SER A 3 -3.575 -2.162 4.987 1.00 1.19 H ATOM 59 HG SER A 3 -3.794 -4.316 5.469 1.00 2.14 H ATOM 60 N ILE A 4 -0.404 -1.179 4.671 1.00 0.33 N ATOM 61 CA ILE A 4 0.197 -0.395 3.617 1.00 0.29 C ATOM 62 C ILE A 4 -0.412 -0.862 2.295 1.00 0.24 C ATOM 63 O ILE A 4 -1.598 -1.170 2.200 1.00 0.28 O ATOM 64 CB ILE A 4 1.735 -0.535 3.678 1.00 0.36 C ATOM 65 CG1 ILE A 4 2.265 -0.634 5.112 1.00 0.48 C ATOM 66 CG2 ILE A 4 2.389 0.709 3.042 1.00 0.39 C ATOM 67 CD1 ILE A 4 2.551 -2.070 5.575 1.00 1.55 C ATOM 68 H ILE A 4 0.079 -2.019 4.933 1.00 0.35 H ATOM 69 HA ILE A 4 -0.053 0.653 3.757 1.00 0.31 H ATOM 70 HB ILE A 4 2.058 -1.440 3.161 1.00 0.36 H ATOM 71 HG12 ILE A 4 3.202 -0.102 5.152 1.00 0.80 H ATOM 72 HG13 ILE A 4 1.583 -0.132 5.791 1.00 0.92 H ATOM 73 HG21 ILE A 4 1.916 0.993 2.105 1.00 1.38 H ATOM 74 HG22 ILE A 4 2.299 1.557 3.722 1.00 1.36 H ATOM 75 HG23 ILE A 4 3.447 0.515 2.857 1.00 1.52 H ATOM 76 HD11 ILE A 4 2.727 -2.073 6.649 1.00 2.13 H ATOM 77 HD12 ILE A 4 1.725 -2.740 5.349 1.00 2.54 H ATOM 78 HD13 ILE A 4 3.444 -2.440 5.069 1.00 2.58 H ATOM 79 N ASN A 5 0.423 -0.925 1.270 1.00 0.20 N ATOM 80 CA ASN A 5 0.115 -1.418 -0.049 1.00 0.18 C ATOM 81 C ASN A 5 0.917 -2.697 -0.266 1.00 0.17 C ATOM 82 O ASN A 5 1.884 -2.938 0.451 1.00 0.21 O ATOM 83 CB ASN A 5 0.418 -0.293 -1.030 1.00 0.22 C ATOM 84 CG ASN A 5 0.382 -0.780 -2.451 1.00 0.20 C ATOM 85 OD1 ASN A 5 -0.627 -0.696 -3.133 1.00 0.23 O ATOM 86 ND2 ASN A 5 1.497 -1.326 -2.883 1.00 0.20 N ATOM 87 H ASN A 5 1.398 -0.740 1.445 1.00 0.24 H ATOM 88 HA ASN A 5 -0.931 -1.666 -0.163 1.00 0.20 H ATOM 89 HB2 ASN A 5 -0.337 0.476 -0.925 1.00 0.27 H ATOM 90 HB3 ASN A 5 1.398 0.139 -0.822 1.00 0.25 H ATOM 91 HD21 ASN A 5 2.260 -1.486 -2.241 1.00 0.21 H ATOM 92 HD22 ASN A 5 1.607 -1.520 -3.858 1.00 0.22 H ATOM 93 N ILE A 6 0.488 -3.503 -1.240 1.00 0.16 N ATOM 94 CA ILE A 6 1.160 -4.697 -1.730 1.00 0.21 C ATOM 95 C ILE A 6 2.456 -4.244 -2.430 1.00 0.21 C ATOM 96 O ILE A 6 3.363 -3.720 -1.792 1.00 0.41 O ATOM 97 CB ILE A 6 0.172 -5.453 -2.652 1.00 0.26 C ATOM 98 CG1 ILE A 6 -1.163 -5.774 -1.943 1.00 0.36 C ATOM 99 CG2 ILE A 6 0.743 -6.766 -3.221 1.00 0.37 C ATOM 100 CD1 ILE A 6 -2.288 -5.971 -2.963 1.00 1.52 C ATOM 101 H ILE A 6 -0.318 -3.202 -1.767 1.00 0.16 H ATOM 102 HA ILE A 6 1.427 -5.333 -0.887 1.00 0.30 H ATOM 103 HB ILE A 6 -0.062 -4.786 -3.485 1.00 0.23 H ATOM 104 HG12 ILE A 6 -1.058 -6.669 -1.331 1.00 0.93 H ATOM 105 HG13 ILE A 6 -1.466 -4.962 -1.285 1.00 0.95 H ATOM 106 HG21 ILE A 6 1.824 -6.731 -3.338 1.00 1.22 H ATOM 107 HG22 ILE A 6 0.521 -7.602 -2.557 1.00 1.34 H ATOM 108 HG23 ILE A 6 0.293 -6.964 -4.195 1.00 1.56 H ATOM 109 HD11 ILE A 6 -2.040 -6.776 -3.654 1.00 2.40 H ATOM 110 HD12 ILE A 6 -3.211 -6.222 -2.440 1.00 2.09 H ATOM 111 HD13 ILE A 6 -2.442 -5.047 -3.521 1.00 2.57 H ATOM 112 N GLY A 7 2.548 -4.392 -3.752 1.00 0.19 N ATOM 113 CA GLY A 7 3.717 -4.007 -4.523 1.00 0.17 C ATOM 114 C GLY A 7 3.341 -2.849 -5.432 1.00 0.12 C ATOM 115 O GLY A 7 3.496 -1.697 -5.040 1.00 0.14 O ATOM 116 H GLY A 7 1.776 -4.804 -4.249 1.00 0.33 H ATOM 117 HA2 GLY A 7 4.525 -3.686 -3.863 1.00 0.21 H ATOM 118 HA3 GLY A 7 4.071 -4.854 -5.109 1.00 0.22 H ATOM 119 N PRO A 8 2.804 -3.125 -6.626 1.00 0.15 N ATOM 120 CA PRO A 8 2.464 -2.095 -7.592 1.00 0.21 C ATOM 121 C PRO A 8 1.229 -1.317 -7.123 1.00 0.21 C ATOM 122 O PRO A 8 0.105 -1.641 -7.496 1.00 0.28 O ATOM 123 CB PRO A 8 2.244 -2.853 -8.905 1.00 0.29 C ATOM 124 CG PRO A 8 1.760 -4.232 -8.455 1.00 0.27 C ATOM 125 CD PRO A 8 2.488 -4.451 -7.129 1.00 0.20 C ATOM 126 HA PRO A 8 3.298 -1.403 -7.711 1.00 0.24 H ATOM 127 HB2 PRO A 8 1.525 -2.360 -9.560 1.00 0.35 H ATOM 128 HB3 PRO A 8 3.201 -2.962 -9.417 1.00 0.32 H ATOM 129 HG2 PRO A 8 0.683 -4.207 -8.283 1.00 0.31 H ATOM 130 HG3 PRO A 8 2.013 -5.005 -9.180 1.00 0.33 H ATOM 131 HD2 PRO A 8 1.842 -4.989 -6.435 1.00 0.26 H ATOM 132 HD3 PRO A 8 3.410 -5.008 -7.299 1.00 0.21 H ATOM 133 N GLY A 9 1.437 -0.286 -6.303 1.00 0.19 N ATOM 134 CA GLY A 9 0.383 0.566 -5.780 1.00 0.21 C ATOM 135 C GLY A 9 0.948 1.472 -4.690 1.00 0.21 C ATOM 136 O GLY A 9 2.161 1.527 -4.492 1.00 0.30 O ATOM 137 H GLY A 9 2.372 -0.103 -5.951 1.00 0.20 H ATOM 138 HA2 GLY A 9 -0.021 1.183 -6.582 1.00 0.29 H ATOM 139 HA3 GLY A 9 -0.420 -0.047 -5.370 1.00 0.20 H ATOM 140 N ARG A 10 0.077 2.178 -3.970 1.00 0.21 N ATOM 141 CA ARG A 10 0.441 2.950 -2.788 1.00 0.26 C ATOM 142 C ARG A 10 -0.755 2.954 -1.845 1.00 0.27 C ATOM 143 O ARG A 10 -1.856 2.600 -2.262 1.00 0.29 O ATOM 144 CB ARG A 10 0.850 4.382 -3.172 1.00 0.40 C ATOM 145 CG ARG A 10 -0.290 5.143 -3.870 1.00 2.20 C ATOM 146 CD ARG A 10 -0.094 6.663 -3.803 1.00 2.87 C ATOM 147 NE ARG A 10 -1.396 7.348 -3.781 1.00 4.94 N ATOM 148 CZ ARG A 10 -1.584 8.667 -3.659 1.00 6.34 C ATOM 149 NH1 ARG A 10 -0.539 9.495 -3.653 1.00 6.11 N ATOM 150 NH2 ARG A 10 -2.820 9.153 -3.536 1.00 8.36 N ATOM 151 H ARG A 10 -0.916 2.023 -4.108 1.00 0.25 H ATOM 152 HA ARG A 10 1.273 2.456 -2.284 1.00 0.27 H ATOM 153 HB2 ARG A 10 1.130 4.907 -2.258 1.00 1.92 H ATOM 154 HB3 ARG A 10 1.722 4.354 -3.826 1.00 1.56 H ATOM 155 HG2 ARG A 10 -0.360 4.830 -4.912 1.00 2.98 H ATOM 156 HG3 ARG A 10 -1.234 4.908 -3.382 1.00 3.33 H ATOM 157 HD2 ARG A 10 0.439 6.914 -2.887 1.00 2.97 H ATOM 158 HD3 ARG A 10 0.496 6.991 -4.659 1.00 2.97 H ATOM 159 HE ARG A 10 -2.202 6.740 -3.812 1.00 5.67 H ATOM 160 HH11 ARG A 10 0.392 9.125 -3.760 1.00 4.99 H ATOM 161 HH12 ARG A 10 -0.644 10.494 -3.562 1.00 7.36 H ATOM 162 HH21 ARG A 10 -3.623 8.539 -3.520 1.00 8.99 H ATOM 163 HH22 ARG A 10 -2.995 10.141 -3.438 1.00 9.50 H ATOM 164 N ALA A 11 -0.563 3.387 -0.602 1.00 0.29 N ATOM 165 CA ALA A 11 -1.641 3.463 0.365 1.00 0.30 C ATOM 166 C ALA A 11 -1.402 4.669 1.259 1.00 0.41 C ATOM 167 O ALA A 11 -0.258 4.928 1.623 1.00 0.77 O ATOM 168 CB ALA A 11 -1.647 2.196 1.212 1.00 0.35 C ATOM 169 H ALA A 11 0.335 3.723 -0.284 1.00 0.34 H ATOM 170 HA ALA A 11 -2.593 3.563 -0.159 1.00 0.28 H ATOM 171 HB1 ALA A 11 -1.899 1.340 0.588 1.00 1.62 H ATOM 172 HB2 ALA A 11 -0.658 2.058 1.650 1.00 1.57 H ATOM 173 HB3 ALA A 11 -2.385 2.294 2.008 1.00 1.59 H ATOM 174 N PHE A 12 -2.469 5.390 1.607 1.00 0.32 N ATOM 175 CA PHE A 12 -2.405 6.570 2.458 1.00 0.32 C ATOM 176 C PHE A 12 -3.773 6.785 3.112 1.00 0.87 C ATOM 177 O PHE A 12 -4.399 7.824 2.921 1.00 1.25 O ATOM 178 CB PHE A 12 -2.013 7.788 1.607 1.00 0.85 C ATOM 179 CG PHE A 12 -0.529 7.926 1.335 1.00 1.72 C ATOM 180 CD1 PHE A 12 0.317 8.342 2.377 1.00 3.12 C ATOM 181 CD2 PHE A 12 0.004 7.672 0.058 1.00 2.11 C ATOM 182 CE1 PHE A 12 1.688 8.533 2.143 1.00 4.05 C ATOM 183 CE2 PHE A 12 1.377 7.873 -0.180 1.00 2.86 C ATOM 184 CZ PHE A 12 2.217 8.309 0.860 1.00 3.66 C ATOM 185 H PHE A 12 -3.383 5.107 1.286 1.00 0.54 H ATOM 186 HA PHE A 12 -1.660 6.414 3.237 1.00 0.73 H ATOM 187 HB2 PHE A 12 -2.569 7.749 0.673 1.00 1.36 H ATOM 188 HB3 PHE A 12 -2.309 8.704 2.123 1.00 0.64 H ATOM 189 HD1 PHE A 12 -0.091 8.516 3.362 1.00 3.76 H ATOM 190 HD2 PHE A 12 -0.642 7.314 -0.728 1.00 2.61 H ATOM 191 HE1 PHE A 12 2.334 8.854 2.949 1.00 5.29 H ATOM 192 HE2 PHE A 12 1.800 7.693 -1.156 1.00 3.39 H ATOM 193 HZ PHE A 12 3.272 8.463 0.681 1.00 4.42 H ATOM 194 N TYR A 13 -4.268 5.790 3.850 1.00 1.60 N ATOM 195 CA TYR A 13 -5.554 5.869 4.535 1.00 2.36 C ATOM 196 C TYR A 13 -5.639 4.809 5.631 1.00 3.24 C ATOM 197 O TYR A 13 -4.605 4.142 5.862 1.00 3.35 O ATOM 198 CB TYR A 13 -6.727 5.826 3.549 1.00 3.42 C ATOM 199 CG TYR A 13 -7.160 4.443 3.141 1.00 2.66 C ATOM 200 CD1 TYR A 13 -6.204 3.497 2.744 1.00 2.80 C ATOM 201 CD2 TYR A 13 -8.514 4.087 3.236 1.00 3.39 C ATOM 202 CE1 TYR A 13 -6.596 2.185 2.465 1.00 3.34 C ATOM 203 CE2 TYR A 13 -8.916 2.778 2.942 1.00 3.44 C ATOM 204 CZ TYR A 13 -7.956 1.813 2.554 1.00 3.28 C ATOM 205 OH TYR A 13 -8.327 0.531 2.283 1.00 4.32 O ATOM 206 OXT TYR A 13 -6.720 4.706 6.252 1.00 4.26 O ATOM 207 H TYR A 13 -3.715 4.976 4.081 1.00 1.87 H ATOM 208 HA TYR A 13 -5.621 6.821 5.025 1.00 1.99 H ATOM 209 HB2 TYR A 13 -7.569 6.321 4.035 1.00 4.67 H ATOM 210 HB3 TYR A 13 -6.494 6.403 2.654 1.00 4.54 H ATOM 211 HD1 TYR A 13 -5.160 3.753 2.696 1.00 3.56 H ATOM 212 HD2 TYR A 13 -9.242 4.814 3.564 1.00 4.62 H ATOM 213 HE1 TYR A 13 -5.830 1.477 2.214 1.00 4.54 H ATOM 214 HE2 TYR A 13 -9.956 2.536 3.052 1.00 4.46 H ATOM 215 HH TYR A 13 -9.274 0.392 2.337 1.00 4.70 H TER 216 TYR A 13 ENDMDL MODEL 21 ATOM 1 N ARG A 1 -1.818 5.184 8.529 1.00 7.50 N ATOM 2 CA ARG A 1 -2.873 4.192 8.816 1.00 5.87 C ATOM 3 C ARG A 1 -2.218 2.825 8.986 1.00 3.87 C ATOM 4 O ARG A 1 -1.011 2.720 8.794 1.00 4.57 O ATOM 5 CB ARG A 1 -3.934 4.198 7.707 1.00 7.12 C ATOM 6 CG ARG A 1 -5.139 5.079 8.075 1.00 8.08 C ATOM 7 CD ARG A 1 -6.340 4.200 8.440 1.00 8.70 C ATOM 8 NE ARG A 1 -7.582 4.981 8.558 1.00 10.19 N ATOM 9 CZ ARG A 1 -8.813 4.488 8.368 1.00 11.25 C ATOM 10 NH1 ARG A 1 -8.991 3.192 8.108 1.00 11.27 N ATOM 11 NH2 ARG A 1 -9.877 5.288 8.469 1.00 12.63 N ATOM 12 H1 ARG A 1 -1.359 4.925 7.665 1.00 8.05 H ATOM 13 H2 ARG A 1 -2.211 6.111 8.449 1.00 8.76 H ATOM 14 H3 ARG A 1 -1.125 5.155 9.264 1.00 7.19 H ATOM 15 HA ARG A 1 -3.351 4.446 9.762 1.00 5.83 H ATOM 16 HB2 ARG A 1 -3.487 4.571 6.784 1.00 8.29 H ATOM 17 HB3 ARG A 1 -4.277 3.182 7.510 1.00 6.70 H ATOM 18 HG2 ARG A 1 -4.895 5.739 8.909 1.00 8.02 H ATOM 19 HG3 ARG A 1 -5.401 5.700 7.218 1.00 8.90 H ATOM 20 HD2 ARG A 1 -6.460 3.453 7.655 1.00 8.98 H ATOM 21 HD3 ARG A 1 -6.146 3.688 9.383 1.00 8.20 H ATOM 22 HE ARG A 1 -7.464 5.976 8.666 1.00 10.72 H ATOM 23 HH11 ARG A 1 -8.183 2.642 7.867 1.00 10.52 H ATOM 24 HH12 ARG A 1 -9.900 2.787 7.958 1.00 12.33 H ATOM 25 HH21 ARG A 1 -9.768 6.276 8.631 1.00 13.01 H ATOM 26 HH22 ARG A 1 -10.810 4.938 8.318 1.00 13.51 H ATOM 27 N LYS A 2 -2.980 1.809 9.400 1.00 2.30 N ATOM 28 CA LYS A 2 -2.493 0.436 9.474 1.00 0.67 C ATOM 29 C LYS A 2 -2.628 -0.184 8.090 1.00 1.09 C ATOM 30 O LYS A 2 -3.556 0.173 7.371 1.00 3.00 O ATOM 31 CB LYS A 2 -3.333 -0.355 10.490 1.00 2.44 C ATOM 32 CG LYS A 2 -2.827 -0.130 11.921 1.00 3.25 C ATOM 33 CD LYS A 2 -1.810 -1.192 12.373 1.00 4.47 C ATOM 34 CE LYS A 2 -2.451 -2.087 13.442 1.00 6.04 C ATOM 35 NZ LYS A 2 -1.472 -2.995 14.082 1.00 7.55 N ATOM 36 H LYS A 2 -3.980 1.928 9.442 1.00 3.28 H ATOM 37 HA LYS A 2 -1.441 0.433 9.764 1.00 1.58 H ATOM 38 HB2 LYS A 2 -4.373 -0.029 10.418 1.00 3.49 H ATOM 39 HB3 LYS A 2 -3.309 -1.420 10.254 1.00 3.38 H ATOM 40 HG2 LYS A 2 -2.370 0.859 11.990 1.00 3.26 H ATOM 41 HG3 LYS A 2 -3.681 -0.145 12.599 1.00 4.22 H ATOM 42 HD2 LYS A 2 -1.483 -1.798 11.526 1.00 4.69 H ATOM 43 HD3 LYS A 2 -0.939 -0.688 12.795 1.00 4.95 H ATOM 44 HE2 LYS A 2 -2.895 -1.448 14.208 1.00 6.39 H ATOM 45 HE3 LYS A 2 -3.250 -2.674 12.982 1.00 6.40 H ATOM 46 HZ1 LYS A 2 -0.750 -2.457 14.546 1.00 7.84 H ATOM 47 HZ2 LYS A 2 -1.937 -3.570 14.773 1.00 8.37 H ATOM 48 HZ3 LYS A 2 -1.044 -3.598 13.393 1.00 7.97 H ATOM 49 N SER A 3 -1.735 -1.125 7.779 1.00 0.69 N ATOM 50 CA SER A 3 -1.582 -1.758 6.477 1.00 0.56 C ATOM 51 C SER A 3 -1.086 -0.769 5.427 1.00 0.56 C ATOM 52 O SER A 3 -1.605 0.332 5.266 1.00 0.70 O ATOM 53 CB SER A 3 -2.859 -2.486 6.051 1.00 0.59 C ATOM 54 OG SER A 3 -3.117 -3.515 6.987 1.00 1.78 O ATOM 55 H SER A 3 -1.047 -1.377 8.467 1.00 2.19 H ATOM 56 HA SER A 3 -0.811 -2.520 6.582 1.00 0.56 H ATOM 57 HB2 SER A 3 -3.704 -1.801 6.005 1.00 1.32 H ATOM 58 HB3 SER A 3 -2.708 -2.925 5.064 1.00 1.39 H ATOM 59 HG SER A 3 -3.841 -4.052 6.655 1.00 2.14 H ATOM 60 N ILE A 4 -0.020 -1.167 4.737 1.00 0.50 N ATOM 61 CA ILE A 4 0.572 -0.402 3.663 1.00 0.50 C ATOM 62 C ILE A 4 -0.078 -0.862 2.358 1.00 0.41 C ATOM 63 O ILE A 4 -1.257 -1.205 2.309 1.00 0.45 O ATOM 64 CB ILE A 4 2.106 -0.576 3.676 1.00 0.55 C ATOM 65 CG1 ILE A 4 2.663 -0.721 5.095 1.00 0.69 C ATOM 66 CG2 ILE A 4 2.765 0.668 3.048 1.00 0.60 C ATOM 67 CD1 ILE A 4 2.878 -2.176 5.534 1.00 1.69 C ATOM 68 H ILE A 4 0.417 -2.048 4.940 1.00 0.48 H ATOM 69 HA ILE A 4 0.354 0.653 3.811 1.00 0.56 H ATOM 70 HB ILE A 4 2.390 -1.474 3.126 1.00 0.49 H ATOM 71 HG12 ILE A 4 3.627 -0.241 5.110 1.00 1.02 H ATOM 72 HG13 ILE A 4 2.025 -0.191 5.797 1.00 0.88 H ATOM 73 HG21 ILE A 4 2.760 1.490 3.767 1.00 1.50 H ATOM 74 HG22 ILE A 4 3.798 0.441 2.779 1.00 1.78 H ATOM 75 HG23 ILE A 4 2.237 1.014 2.161 1.00 1.18 H ATOM 76 HD11 ILE A 4 2.081 -2.827 5.179 1.00 2.38 H ATOM 77 HD12 ILE A 4 3.821 -2.540 5.127 1.00 2.83 H ATOM 78 HD13 ILE A 4 2.922 -2.224 6.622 1.00 2.32 H ATOM 79 N ASN A 5 0.713 -0.874 1.295 1.00 0.34 N ATOM 80 CA ASN A 5 0.343 -1.317 -0.029 1.00 0.25 C ATOM 81 C ASN A 5 1.020 -2.656 -0.294 1.00 0.16 C ATOM 82 O ASN A 5 1.979 -3.000 0.391 1.00 0.26 O ATOM 83 CB ASN A 5 0.730 -0.206 -0.996 1.00 0.32 C ATOM 84 CG ASN A 5 0.641 -0.668 -2.424 1.00 0.27 C ATOM 85 OD1 ASN A 5 -0.371 -0.519 -3.091 1.00 0.32 O ATOM 86 ND2 ASN A 5 1.716 -1.272 -2.874 1.00 0.24 N ATOM 87 H ASN A 5 1.695 -0.695 1.440 1.00 0.37 H ATOM 88 HA ASN A 5 -0.722 -1.467 -0.130 1.00 0.28 H ATOM 89 HB2 ASN A 5 0.044 0.621 -0.868 1.00 0.41 H ATOM 90 HB3 ASN A 5 1.743 0.141 -0.791 1.00 0.37 H ATOM 91 HD21 ASN A 5 2.463 -1.495 -2.234 1.00 0.25 H ATOM 92 HD22 ASN A 5 1.816 -1.447 -3.856 1.00 0.25 H ATOM 93 N ILE A 6 0.498 -3.395 -1.276 1.00 0.15 N ATOM 94 CA ILE A 6 1.047 -4.640 -1.790 1.00 0.28 C ATOM 95 C ILE A 6 2.368 -4.317 -2.508 1.00 0.29 C ATOM 96 O ILE A 6 3.357 -3.965 -1.874 1.00 0.58 O ATOM 97 CB ILE A 6 -0.025 -5.315 -2.680 1.00 0.41 C ATOM 98 CG1 ILE A 6 -1.331 -5.565 -1.899 1.00 0.49 C ATOM 99 CG2 ILE A 6 0.476 -6.648 -3.270 1.00 0.57 C ATOM 100 CD1 ILE A 6 -2.528 -5.690 -2.850 1.00 1.60 C ATOM 101 H ILE A 6 -0.294 -3.018 -1.777 1.00 0.21 H ATOM 102 HA ILE A 6 1.276 -5.297 -0.953 1.00 0.38 H ATOM 103 HB ILE A 6 -0.268 -4.635 -3.499 1.00 0.41 H ATOM 104 HG12 ILE A 6 -1.234 -6.467 -1.297 1.00 0.88 H ATOM 105 HG13 ILE A 6 -1.548 -4.738 -1.226 1.00 1.07 H ATOM 106 HG21 ILE A 6 1.297 -7.042 -2.672 1.00 1.21 H ATOM 107 HG22 ILE A 6 -0.322 -7.390 -3.279 1.00 1.85 H ATOM 108 HG23 ILE A 6 0.809 -6.514 -4.298 1.00 1.65 H ATOM 109 HD11 ILE A 6 -3.439 -5.832 -2.269 1.00 2.25 H ATOM 110 HD12 ILE A 6 -2.626 -4.778 -3.439 1.00 2.65 H ATOM 111 HD13 ILE A 6 -2.399 -6.538 -3.522 1.00 2.36 H ATOM 112 N GLY A 7 2.394 -4.389 -3.837 1.00 0.31 N ATOM 113 CA GLY A 7 3.568 -4.074 -4.634 1.00 0.29 C ATOM 114 C GLY A 7 3.239 -2.895 -5.536 1.00 0.19 C ATOM 115 O GLY A 7 3.443 -1.752 -5.139 1.00 0.15 O ATOM 116 H GLY A 7 1.551 -4.649 -4.317 1.00 0.54 H ATOM 117 HA2 GLY A 7 4.406 -3.799 -3.993 1.00 0.31 H ATOM 118 HA3 GLY A 7 3.860 -4.941 -5.226 1.00 0.38 H ATOM 119 N PRO A 8 2.687 -3.140 -6.729 1.00 0.22 N ATOM 120 CA PRO A 8 2.374 -2.088 -7.679 1.00 0.23 C ATOM 121 C PRO A 8 1.175 -1.268 -7.190 1.00 0.25 C ATOM 122 O PRO A 8 0.033 -1.563 -7.533 1.00 0.34 O ATOM 123 CB PRO A 8 2.107 -2.828 -8.995 1.00 0.32 C ATOM 124 CG PRO A 8 1.568 -4.187 -8.543 1.00 0.37 C ATOM 125 CD PRO A 8 2.329 -4.450 -7.244 1.00 0.32 C ATOM 126 HA PRO A 8 3.233 -1.428 -7.805 1.00 0.22 H ATOM 127 HB2 PRO A 8 1.400 -2.302 -9.638 1.00 0.39 H ATOM 128 HB3 PRO A 8 3.052 -2.978 -9.518 1.00 0.33 H ATOM 129 HG2 PRO A 8 0.500 -4.111 -8.334 1.00 0.42 H ATOM 130 HG3 PRO A 8 1.759 -4.965 -9.283 1.00 0.42 H ATOM 131 HD2 PRO A 8 1.695 -4.991 -6.541 1.00 0.39 H ATOM 132 HD3 PRO A 8 3.234 -5.019 -7.454 1.00 0.34 H ATOM 133 N GLY A 9 1.426 -0.232 -6.386 1.00 0.20 N ATOM 134 CA GLY A 9 0.394 0.651 -5.865 1.00 0.25 C ATOM 135 C GLY A 9 0.972 1.558 -4.783 1.00 0.21 C ATOM 136 O GLY A 9 2.189 1.644 -4.625 1.00 0.30 O ATOM 137 H GLY A 9 2.371 -0.066 -6.054 1.00 0.17 H ATOM 138 HA2 GLY A 9 -0.001 1.265 -6.673 1.00 0.33 H ATOM 139 HA3 GLY A 9 -0.419 0.057 -5.445 1.00 0.28 H ATOM 140 N ARG A 10 0.102 2.228 -4.025 1.00 0.19 N ATOM 141 CA ARG A 10 0.459 2.973 -2.823 1.00 0.23 C ATOM 142 C ARG A 10 -0.738 2.948 -1.882 1.00 0.25 C ATOM 143 O ARG A 10 -1.847 2.652 -2.320 1.00 0.24 O ATOM 144 CB ARG A 10 0.857 4.417 -3.166 1.00 0.40 C ATOM 145 CG ARG A 10 -0.217 5.145 -3.989 1.00 2.17 C ATOM 146 CD ARG A 10 -0.098 6.667 -3.842 1.00 2.89 C ATOM 147 NE ARG A 10 1.215 7.177 -4.267 1.00 3.17 N ATOM 148 CZ ARG A 10 1.584 7.429 -5.529 1.00 3.88 C ATOM 149 NH1 ARG A 10 0.754 7.161 -6.538 1.00 4.69 N ATOM 150 NH2 ARG A 10 2.785 7.951 -5.779 1.00 4.65 N ATOM 151 H ARG A 10 -0.887 2.037 -4.137 1.00 0.24 H ATOM 152 HA ARG A 10 1.295 2.472 -2.332 1.00 0.23 H ATOM 153 HB2 ARG A 10 1.027 4.958 -2.234 1.00 1.90 H ATOM 154 HB3 ARG A 10 1.793 4.409 -3.727 1.00 1.52 H ATOM 155 HG2 ARG A 10 -0.123 4.860 -5.038 1.00 2.88 H ATOM 156 HG3 ARG A 10 -1.211 4.861 -3.646 1.00 3.27 H ATOM 157 HD2 ARG A 10 -0.890 7.148 -4.417 1.00 3.60 H ATOM 158 HD3 ARG A 10 -0.251 6.926 -2.794 1.00 3.41 H ATOM 159 HE ARG A 10 1.856 7.383 -3.514 1.00 3.65 H ATOM 160 HH11 ARG A 10 -0.152 6.762 -6.347 1.00 4.80 H ATOM 161 HH12 ARG A 10 0.998 7.341 -7.499 1.00 5.66 H ATOM 162 HH21 ARG A 10 3.427 8.167 -5.030 1.00 5.00 H ATOM 163 HH22 ARG A 10 3.088 8.154 -6.720 1.00 5.35 H ATOM 164 N ALA A 11 -0.531 3.271 -0.607 1.00 0.35 N ATOM 165 CA ALA A 11 -1.598 3.278 0.376 1.00 0.43 C ATOM 166 C ALA A 11 -1.348 4.410 1.358 1.00 0.63 C ATOM 167 O ALA A 11 -0.218 4.585 1.804 1.00 1.07 O ATOM 168 CB ALA A 11 -1.608 1.957 1.135 1.00 0.51 C ATOM 169 H ALA A 11 0.379 3.556 -0.269 1.00 0.43 H ATOM 170 HA ALA A 11 -2.557 3.416 -0.126 1.00 0.39 H ATOM 171 HB1 ALA A 11 -2.357 2.011 1.926 1.00 1.59 H ATOM 172 HB2 ALA A 11 -1.851 1.140 0.457 1.00 1.82 H ATOM 173 HB3 ALA A 11 -0.625 1.795 1.577 1.00 1.59 H ATOM 174 N PHE A 12 -2.402 5.156 1.687 1.00 0.46 N ATOM 175 CA PHE A 12 -2.359 6.287 2.604 1.00 0.54 C ATOM 176 C PHE A 12 -3.772 6.548 3.144 1.00 0.86 C ATOM 177 O PHE A 12 -4.226 7.688 3.187 1.00 1.15 O ATOM 178 CB PHE A 12 -1.814 7.525 1.866 1.00 1.06 C ATOM 179 CG PHE A 12 -0.305 7.582 1.740 1.00 2.06 C ATOM 180 CD1 PHE A 12 0.469 7.861 2.880 1.00 3.50 C ATOM 181 CD2 PHE A 12 0.326 7.389 0.496 1.00 2.38 C ATOM 182 CE1 PHE A 12 1.866 7.965 2.780 1.00 4.53 C ATOM 183 CE2 PHE A 12 1.725 7.499 0.394 1.00 3.25 C ATOM 184 CZ PHE A 12 2.494 7.790 1.534 1.00 4.18 C ATOM 185 H PHE A 12 -3.299 4.905 1.299 1.00 0.55 H ATOM 186 HA PHE A 12 -1.703 6.049 3.442 1.00 1.07 H ATOM 187 HB2 PHE A 12 -2.274 7.587 0.879 1.00 1.50 H ATOM 188 HB3 PHE A 12 -2.100 8.424 2.410 1.00 0.86 H ATOM 189 HD1 PHE A 12 -0.013 8.002 3.835 1.00 4.08 H ATOM 190 HD2 PHE A 12 -0.267 7.154 -0.374 1.00 2.69 H ATOM 191 HE1 PHE A 12 2.456 8.185 3.658 1.00 5.79 H ATOM 192 HE2 PHE A 12 2.215 7.360 -0.558 1.00 3.71 H ATOM 193 HZ PHE A 12 3.569 7.878 1.459 1.00 5.01 H ATOM 194 N TYR A 13 -4.496 5.496 3.531 1.00 1.89 N ATOM 195 CA TYR A 13 -5.870 5.615 4.006 1.00 2.77 C ATOM 196 C TYR A 13 -6.179 4.469 4.962 1.00 3.91 C ATOM 197 O TYR A 13 -7.250 4.515 5.603 1.00 5.34 O ATOM 198 CB TYR A 13 -6.853 5.729 2.836 1.00 3.81 C ATOM 199 CG TYR A 13 -7.343 4.407 2.305 1.00 3.17 C ATOM 200 CD1 TYR A 13 -6.424 3.405 1.961 1.00 3.28 C ATOM 201 CD2 TYR A 13 -8.722 4.151 2.249 1.00 3.77 C ATOM 202 CE1 TYR A 13 -6.874 2.133 1.592 1.00 3.69 C ATOM 203 CE2 TYR A 13 -9.182 2.883 1.865 1.00 3.72 C ATOM 204 CZ TYR A 13 -8.262 1.862 1.540 1.00 3.55 C ATOM 205 OH TYR A 13 -8.721 0.624 1.204 1.00 4.40 O ATOM 206 OXT TYR A 13 -5.279 3.612 5.106 1.00 4.10 O ATOM 207 H TYR A 13 -4.098 4.571 3.641 1.00 2.36 H ATOM 208 HA TYR A 13 -5.970 6.524 4.571 1.00 2.31 H ATOM 209 HB2 TYR A 13 -7.711 6.298 3.192 1.00 4.98 H ATOM 210 HB3 TYR A 13 -6.401 6.300 2.024 1.00 4.89 H ATOM 211 HD1 TYR A 13 -5.365 3.587 2.034 1.00 3.95 H ATOM 212 HD2 TYR A 13 -9.430 4.915 2.534 1.00 4.91 H ATOM 213 HE1 TYR A 13 -6.130 1.385 1.394 1.00 4.77 H ATOM 214 HE2 TYR A 13 -10.240 2.693 1.858 1.00 4.60 H ATOM 215 HH TYR A 13 -8.020 -0.015 1.066 1.00 4.74 H TER 216 TYR A 13 ENDMDL MASTER 141 0 0 0 0 0 0 6 105 1 0 1 END