Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pys_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N ASN 1.A O no hydrogen 3.050 N/A ILE 6.A N ARG 2.A O no hydrogen 3.212 N/A LEU 7.A N GLU 3.A O no hydrogen 3.045 N/A ASN 8.A N GLU 4.A O no hydrogen 2.779 N/A ARG 9.A N LYS 5.A O no hydrogen 3.142 N/A GLU 10.A N ILE 6.A O no hydrogen 3.107 N/A ILE 11.A N LEU 7.A O no hydrogen 2.936 N/A GLY 12.A N ASN 8.A O no hydrogen 2.849 N/A PHE 13.A N ARG 9.A O no hydrogen 2.938 N/A ALA 14.A N GLU 10.A O no hydrogen 2.953 N/A ILE 15.A N ILE 11.A O no hydrogen 2.951 N/A GLY 16.A N GLY 12.A O no hydrogen 3.045 N/A MET 17.A N GLY 12.A O no hydrogen 3.198 N/A GLU 21.A N PRO 18.A O no hydrogen 3.286 N/A PHE 22.A N VAL 19.A O no hydrogen 2.894 N/A MET 24.A N CYS 20.A O no hydrogen 3.198 N/A VAL 25.A N PHE 22.A O no hydrogen 3.358 N/A GLU 29.A N ASP 27.A OD1 no hydrogen 3.183 N/A GLN 31.A N ASP 27.A O no hydrogen 3.380 N/A GLN 31.A NE2 PHE 22.A O no hydrogen 2.760 N/A GLN 31.A NE2 VAL 25.A O no hydrogen 2.866 N/A ASP 32.A N PRO 28.A O no hydrogen 2.860 N/A PHE 33.A N GLU 29.A O no hydrogen 2.894 N/A ARG 34.A N VAL 30.A O no hydrogen 3.094 N/A ARG 34.A NE GLU 545.A OE1 no hydrogen 2.927 N/A ARG 34.A NH1 ASP 23.A OD1 no hydrogen 2.766 N/A ARG 34.A NH1 GLN 31.A OE1 no hydrogen 3.310 N/A ARG 34.A NH2 ASP 23.A OD1 no hydrogen 3.275 N/A ARG 34.A NH2 GLU 545.A OE2 no hydrogen 2.900 N/A ARG 35.A N GLN 31.A O no hydrogen 3.181 N/A ASN 36.A N ASP 32.A O no hydrogen 2.847 N/A ILE 37.A N PHE 33.A O no hydrogen 2.851 N/A LEU 38.A N ARG 35.A O no hydrogen 3.305 N/A VAL 40.A N ILE 37.A O no hydrogen 2.875 N/A CYS 41.A SG SER 546.A O no hydrogen 3.349 N/A LYS 42.A N LEU 38.A O no hydrogen 2.826 N/A LYS 42.A NZ ASP 46.A OD2 no hydrogen 2.866 N/A GLU 43.A N ASN 39.A O no hydrogen 3.030 N/A ALA 44.A N VAL 40.A O no hydrogen 2.999 N/A VAL 45.A N CYS 41.A O no hydrogen 3.137 N/A ASP 46.A N LYS 42.A O no hydrogen 2.983 N/A LEU 47.A N GLU 43.A O no hydrogen 3.243 N/A ARG 48.A N ALA 44.A O no hydrogen 3.231 N/A ARG 48.A NH1 LEU 514.A O no hydrogen 2.805 N/A ARG 48.A NH1 ALA 550.A O no hydrogen 2.928 N/A ARG 48.A NH2 ASP 178.A OD1 no hydrogen 3.460 N/A ARG 48.A NH2 ALA 550.A O no hydrogen 2.663 N/A ASP 49.A N VAL 45.A O no hydrogen 2.980 N/A ASN 51.A N SER 55.A OG no hydrogen 3.216 N/A HIS 54.A NE2 LEU 140.A O no hydrogen 3.298 N/A SER 55.A N ASN 51.A O no hydrogen 2.958 N/A SER 55.A OG ARG 48.A O no hydrogen 2.557 N/A ALA 57.A N PRO 53.A O no hydrogen 3.179 N/A MET 58.A N HIS 54.A O no hydrogen 2.826 N/A TYR 59.A N SER 55.A O no hydrogen 3.213 N/A TYR 59.A OH CYS 551.A O no hydrogen 2.703 N/A VAL 60.A N ARG 56.A O no hydrogen 3.060 N/A TYR 61.A N ALA 57.A O no hydrogen 2.791 N/A ASN 64.A ND2 GLU 137.A OE1 no hydrogen 3.559 N/A GLU 66.A N GLN 147.A O no hydrogen 2.868 N/A SER 67.A OG THR 480.A OG1 no hydrogen 2.906 N/A SER 67.A OG ASP 482.A OD2 no hydrogen 2.963 N/A HIS 74.A NE2 GLN 681.A OE1 no hydrogen 2.921 N/A TYR 76.A N PRO 72.A O no hydrogen 3.269 N/A ASN 77.A N LYS 73.A O no hydrogen 3.078 N/A LYS 78.A N ILE 75.A O no hydrogen 3.349 N/A LYS 78.A NZ MET 156.A O no hydrogen 2.819 N/A LEU 79.A N TYR 76.A O no hydrogen 3.154 N/A ASP 80.A N GLN 83.A O no hydrogen 3.159 N/A GLN 83.A NE2 ASN 103.A OD1 no hydrogen 2.938 N/A ILE 84.A N ILE 102.A O no hydrogen 2.715 N/A VAL 86.A N LEU 100.A O no hydrogen 2.825 N/A VAL 87.A N PRO 161.A O no hydrogen 3.018 N/A ILE 88.A N TYR 98.A O no hydrogen 3.031 N/A TRP 89.A N LEU 163.A O no hydrogen 2.741 N/A TRP 89.A NE1 ASN 162.A OD1 no hydrogen 3.038 N/A VAL 90.A N GLN 96.A O no hydrogen 2.864 N/A VAL 92.A N ASP 94.A O no hydrogen 2.965 N/A LYS 95.A NZ ILE 644.A O no hydrogen 3.292 N/A LYS 95.A NZ GLU 647.A OE2 no hydrogen 3.148 N/A GLN 96.A N VAL 90.A O no hydrogen 3.066 N/A TYR 98.A N ILE 88.A O no hydrogen 3.022 N/A TYR 98.A OH GLN 96.A OE1 no hydrogen 2.710 N/A LEU 100.A N VAL 86.A O no hydrogen 2.726 N/A LYS 101.A NZ ASP 80.A OD2 no hydrogen 2.818 N/A ILE 102.A N ILE 84.A O no hydrogen 3.063 N/A HIS 104.A N GLY 82.A O no hydrogen 3.388 N/A HIS 104.A ND1 SER 146.A OG no hydrogen 3.102 N/A CYS 106.A N ASN 103.A O no hydrogen 3.254 N/A CYS 106.A SG ASN 103.A O no hydrogen 3.291 N/A VAL 107.A N GLN 110.A OE1 no hydrogen 2.851 N/A VAL 111.A N VAL 107.A O no hydrogen 2.989 N/A ILE 112.A N PRO 108.A O no hydrogen 2.783 N/A ALA 113.A N GLU 109.A O no hydrogen 3.086 N/A GLU 114.A N GLN 110.A O no hydrogen 3.095 N/A ALA 115.A N VAL 111.A O no hydrogen 3.222 N/A ILE 116.A N ILE 112.A O no hydrogen 2.964 N/A ARG 117.A N ALA 113.A O no hydrogen 2.871 N/A LYS 118.A N GLU 114.A O no hydrogen 3.222 N/A LYS 118.A NZ THR 99.A O no hydrogen 2.888 N/A LYS 119.A N ALA 115.A O no hydrogen 3.084 N/A THR 120.A N ILE 116.A O no hydrogen 2.810 N/A THR 120.A OG1 ILE 116.A O no hydrogen 2.666 N/A ARG 121.A N ARG 117.A O no hydrogen 2.877 N/A SER 122.A N LYS 118.A O no hydrogen 3.374 N/A MET 123.A N THR 120.A O no hydrogen 3.192 N/A ILE 129.A N MET 166.A O no hydrogen 2.776 N/A LYS 131.A N MET 164.A O no hydrogen 2.946 N/A LYS 131.A NZ VAL 132.A O no hydrogen 2.863 N/A LYS 131.A NZ CYS 135.A O no hydrogen 2.928 N/A LYS 131.A NZ ASP 643.A OD1 no hydrogen 2.763 N/A VAL 132.A N GLU 137.A O no hydrogen 2.836 N/A CYS 133.A N ASN 162.A O no hydrogen 3.086 N/A CYS 133.A SG ASN 162.A O no hydrogen 3.287 N/A GLY 134.A N ASP 643.A OD2 no hydrogen 3.125 N/A ASP 136.A N ALA 614.A O no hydrogen 2.861 N/A GLU 137.A N CYS 135.A O no hydrogen 3.063 N/A PHE 139.A N LEU 130.A O no hydrogen 2.872 N/A LYS 142.A N GLU 141.A OE1 no hydrogen 3.277 N/A TYR 143.A N GLU 141.A O no hydrogen 2.873 N/A LEU 145.A N CYS 106.A O no hydrogen 2.845 N/A SER 146.A N HIS 104.A O no hydrogen 2.979 N/A SER 146.A OG HIS 104.A ND1 no hydrogen 3.102 N/A SER 146.A OG HIS 104.A O no hydrogen 3.360 N/A GLN 147.A N PRO 144.A O no hydrogen 2.964 N/A GLN 147.A NE2 GLU 66.A O no hydrogen 2.871 N/A TYR 148.A N LEU 145.A O no hydrogen 3.337 N/A TYR 148.A OH GLU 141.A O no hydrogen 2.719 N/A LYS 149.A N ASN 64.A O no hydrogen 2.897 N/A LYS 149.A NZ ASP 482.A OD1 no hydrogen 2.708 N/A ARG 152.A N TYR 148.A O no hydrogen 3.007 N/A ARG 152.A NE SER 146.A O no hydrogen 3.012 N/A ARG 152.A NH1 SER 68.A O no hydrogen 3.452 N/A ARG 152.A NH2 SER 68.A O no hydrogen 3.391 N/A ARG 152.A NH2 PRO 69.A O no hydrogen 3.367 N/A ARG 152.A NH2 SER 146.A O no hydrogen 3.426 N/A SER 153.A N LYS 149.A O no hydrogen 2.937 N/A CYS 154.A N TYR 150.A O no hydrogen 3.085 N/A CYS 154.A SG TYR 150.A O no hydrogen 3.247 N/A ILE 155.A N ILE 151.A O no hydrogen 3.124 N/A MET 156.A N ARG 152.A O no hydrogen 3.123 N/A LEU 157.A N SER 153.A O no hydrogen 2.816 N/A ARG 159.A N CYS 154.A O no hydrogen 2.754 N/A ASN 162.A N TYR 150.A OH no hydrogen 2.957 N/A ASN 162.A ND2 MET 160.A O no hydrogen 2.741 N/A LEU 163.A N VAL 87.A O no hydrogen 2.962 N/A MET 164.A N LYS 131.A O no hydrogen 2.699 N/A LEU 165.A N TRP 89.A O no hydrogen 2.793 N/A MET 166.A N ILE 129.A O no hydrogen 3.007 N/A LYS 168.A N LYS 127.A O no hydrogen 3.131 N/A LYS 168.A NZ GLY 126.A O no hydrogen 3.026 N/A SER 170.A N ALA 167.A O no hydrogen 3.143 N/A TYR 172.A N LYS 168.A O no hydrogen 2.973 N/A SER 173.A N GLU 169.A O no hydrogen 3.235 N/A LEU 175.A N TYR 172.A O no hydrogen 3.361 N/A SER 184.A N GLU 4.A OE2 no hydrogen 3.019 N/A SER 184.A OG GLU 4.A OE1 no hydrogen 3.210 N/A SER 184.A OG GLU 4.A OE2 no hydrogen 2.768 N/A SER 186.A N PRO 183.A O no hydrogen 3.166 N/A SER 186.A OG PRO 183.A O no hydrogen 2.602 N/A ARG 187.A N SER 184.A O no hydrogen 3.346 N/A LYS 191.A N VAL 339.A O no hydrogen 2.929 N/A LEU 193.A N LYS 341.A O no hydrogen 2.860 N/A SER 198.A N ILE 196.A O no hydrogen 3.132 N/A SER 198.A OG ALA 199.A O no hydrogen 3.247 N/A LEU 200.A N ILE 254.A O no hydrogen 3.032 N/A ILE 202.A N LEU 250.A O no hydrogen 3.092 N/A LYS 203.A N GLU 332.A O no hydrogen 2.839 N/A LYS 203.A NZ ASN 247.A OD1 no hydrogen 2.927 N/A ILE 204.A N GLU 248.A O no hydrogen 3.152 N/A LEU 205.A N GLU 330.A O no hydrogen 3.054 N/A CYS 206.A SG GLU 330.A OE1 no hydrogen 3.280 N/A ALA 207.A N PRO 244.A O no hydrogen 3.206 N/A THR 208.A N CYS 328.A O no hydrogen 3.186 N/A THR 208.A OG1 CYS 328.A O no hydrogen 3.521 N/A ASN 211.A N TYR 209.A O no hydrogen 3.056 N/A ILE 217.A N VAL 239.A O no hydrogen 2.533 N/A TYR 218.A N CYS 270.A O no hydrogen 3.231 N/A TYR 218.A OH HIS 275.A ND1 no hydrogen 2.755 N/A VAL 219.A N THR 236.A OG1 no hydrogen 2.823 N/A ARG 220.A N SER 268.A O no hydrogen 2.809 N/A ARG 220.A NH1 ASN 235.A OD1 no hydrogen 2.460 N/A THR 221.A N VAL 234.A O no hydrogen 3.029 N/A THR 221.A OG1 VAL 234.A O no hydrogen 2.680 N/A THR 221.A OG1 TYR 252.A OH no hydrogen 2.613 N/A GLY 222.A N CYS 266.A O no hydrogen 2.814 N/A TYR 224.A N ARG 264.A O no hydrogen 2.918 N/A HIS 225.A N GLU 228.A O no hydrogen 2.816 N/A GLU 228.A N HIS 225.A O no hydrogen 3.205 N/A LEU 230.A N ILE 223.A O no hydrogen 2.846 N/A CYS 231.A SG ASP 232.A O no hydrogen 3.642 N/A VAL 234.A N THR 221.A O no hydrogen 2.972 N/A THR 236.A N VAL 219.A O no hydrogen 3.229 N/A THR 236.A OG1 VAL 219.A O no hydrogen 3.404 N/A GLN 237.A N GLU 248.A OE1 no hydrogen 2.799 N/A ARG 238.A NH1 GLU 273.A OE2 no hydrogen 3.116 N/A ARG 238.A NH2 GLU 273.A OE1 no hydrogen 3.213 N/A ARG 238.A NH2 GLU 273.A OE2 no hydrogen 3.536 N/A VAL 239.A N ILE 217.A O no hydrogen 2.906 N/A CYS 241.A SG ILE 214.A O no hydrogen 3.919 N/A CYS 241.A SG ASP 215.A O no hydrogen 3.674 N/A TRP 246.A N LEU 205.A O no hydrogen 2.877 N/A ASN 247.A N LEU 205.A O no hydrogen 3.031 N/A GLU 248.A N ILE 204.A O no hydrogen 3.151 N/A LEU 250.A N ILE 202.A O no hydrogen 2.958 N/A TYR 252.A N LEU 200.A O no hydrogen 3.038 N/A TYR 252.A OH THR 221.A OG1 no hydrogen 2.613 N/A ILE 256.A N SER 198.A O no hydrogen 2.997 N/A ASP 258.A N TYR 255.A O no hydrogen 2.843 N/A LEU 259.A N ILE 256.A O no hydrogen 3.114 N/A ARG 261.A NE ASP 290.A OD1 no hydrogen 3.211 N/A ARG 261.A NH1 ARG 261.A O no hydrogen 2.905 N/A ARG 261.A NH1 TYR 500.A OH no hydrogen 2.673 N/A ARG 261.A NH2 ASP 287.A O no hydrogen 3.110 N/A ARG 261.A NH2 ASP 290.A OD1 no hydrogen 2.781 N/A ARG 261.A NH2 TYR 500.A OH no hydrogen 3.294 N/A ALA 263.A N PRO 260.A O no hydrogen 3.016 N/A ARG 264.A N TYR 224.A O no hydrogen 2.874 N/A ARG 264.A NH1 PRO 314.A O no hydrogen 2.735 N/A ARG 264.A NH2 PRO 314.A O no hydrogen 2.703 N/A LEU 265.A N ILE 283.A O no hydrogen 2.772 N/A CYS 266.A N GLY 222.A O no hydrogen 2.837 N/A CYS 266.A SG ASN 282.A OD1 no hydrogen 3.467 N/A LEU 267.A N GLY 281.A O no hydrogen 2.902 N/A SER 268.A N ARG 220.A O no hydrogen 2.937 N/A SER 268.A OG LEU 311.A O no hydrogen 2.733 N/A ILE 269.A N ALA 279.A O no hydrogen 2.904 N/A CYS 270.A N TYR 218.A O no hydrogen 2.870 N/A CYS 270.A SG SER 268.A OG no hydrogen 3.283 N/A SER 271.A N CYS 276.A O no hydrogen 2.765 N/A SER 271.A OG CYS 276.A O no hydrogen 3.082 N/A HIS 275.A ND1 TYR 218.A OH no hydrogen 2.755 N/A CYS 276.A N SER 271.A O no hydrogen 2.786 N/A CYS 276.A SG PRO 277.A O no hydrogen 3.939 N/A LEU 278.A N ILE 269.A O no hydrogen 2.776 N/A ALA 279.A N ILE 269.A O no hydrogen 3.417 N/A TRP 280.A N TRP 302.A O no hydrogen 3.121 N/A TRP 280.A NE1 PRO 303.A O no hydrogen 3.042 N/A GLY 281.A N LEU 267.A O no hydrogen 2.937 N/A ASN 282.A ND2 ASN 313.A O no hydrogen 2.927 N/A ASN 282.A ND2 GLY 316.A O no hydrogen 2.936 N/A ASN 282.A ND2 VAL 317.A O no hydrogen 3.344 N/A ILE 283.A N LEU 265.A O no hydrogen 2.764 N/A ASN 284.A ND2 GLN 499.A O no hydrogen 3.233 N/A LEU 285.A N ALA 263.A O no hydrogen 3.073 N/A ASP 287.A N THR 291.A O no hydrogen 2.847 N/A TYR 288.A OH ASP 32.A OD2 no hydrogen 2.726 N/A THR 289.A N ASP 287.A OD1 no hydrogen 3.086 N/A THR 289.A OG1 ASP 287.A OD1 no hydrogen 2.723 N/A THR 289.A OG1 ASP 287.A OD2 no hydrogen 3.296 N/A THR 289.A OG1 THR 291.A OG1 no hydrogen 2.793 N/A ASP 290.A N ASP 287.A O no hydrogen 3.119 N/A THR 291.A N ASP 287.A OD1 no hydrogen 2.936 N/A THR 291.A OG1 THR 289.A O no hydrogen 3.550 N/A THR 291.A OG1 THR 289.A OG1 no hydrogen 2.793 N/A LEU 292.A N VAL 340.A O no hydrogen 2.767 N/A VAL 293.A N LEU 285.A O no hydrogen 2.977 N/A MET 297.A N LEU 331.A O no hydrogen 2.805 N/A LEU 299.A N LEU 329.A O no hydrogen 2.869 N/A ASN 300.A N SER 320.A OG no hydrogen 3.074 N/A ASN 300.A ND2 LYS 324.A O no hydrogen 3.612 N/A ASN 300.A ND2 THR 326.A O no hydrogen 3.255 N/A ASN 300.A ND2 THR 326.A OG1 no hydrogen 3.241 N/A LEU 301.A N PRO 327.A O no hydrogen 2.724 N/A TRP 302.A N TRP 280.A O no hydrogen 2.825 N/A GLY 316.A N ASN 313.A O no hydrogen 3.141 N/A GLY 319.A N ASN 282.A O no hydrogen 2.831 N/A ASN 321.A N ASN 300.A O no hydrogen 2.932 N/A ASN 321.A ND2 LEU 301.A O no hydrogen 2.844 N/A ASN 323.A N ASN 321.A OD1 no hydrogen 3.054 N/A LYS 324.A NZ ASN 321.A O no hydrogen 2.993 N/A GLU 325.A N ASN 323.A OD1 no hydrogen 2.982 N/A THR 326.A OG1 ASN 323.A O no hydrogen 2.654 N/A CYS 328.A N THR 208.A O no hydrogen 2.899 N/A CYS 328.A SG ASN 300.A OD1 no hydrogen 3.907 N/A LEU 329.A N LEU 299.A O no hydrogen 2.969 N/A GLU 330.A N CYS 206.A O no hydrogen 2.725 N/A LEU 331.A N MET 297.A O no hydrogen 2.704 N/A GLU 332.A N LYS 203.A O no hydrogen 2.862 N/A PHE 333.A N GLY 295.A O no hydrogen 2.856 N/A SER 338.A OG PHE 336.A O no hydrogen 3.119 N/A VAL 339.A N SER 189.A O no hydrogen 2.769 N/A LYS 341.A N LYS 191.A O no hydrogen 3.057 N/A PHE 342.A N ASP 290.A O no hydrogen 2.718 N/A SER 346.A OG ASP 344.A OD1 no hydrogen 2.615 N/A ILE 348.A N ASP 344.A O no hydrogen 3.042 N/A GLU 349.A N MET 345.A O no hydrogen 2.662 N/A GLU 350.A N SER 346.A O no hydrogen 3.016 N/A HIS 351.A N VAL 347.A O no hydrogen 3.228 N/A HIS 351.A NE2 ASP 434.A OD1 no hydrogen 2.671 N/A ALA 352.A N ILE 348.A O no hydrogen 2.996 N/A ASN 353.A N GLU 349.A O no hydrogen 2.946 N/A TRP 354.A N GLU 350.A O no hydrogen 2.969 N/A SER 355.A N HIS 351.A O no hydrogen 2.895 N/A SER 355.A OG HIS 351.A O no hydrogen 3.007 N/A VAL 356.A N ALA 352.A O no hydrogen 2.844 N/A SER 357.A N ASN 353.A O no hydrogen 3.003 N/A ARG 358.A N TRP 354.A O no hydrogen 3.134 N/A GLU 359.A N SER 355.A O no hydrogen 3.005 N/A ALA 360.A N VAL 356.A O no hydrogen 3.121 N/A GLY 361.A N SER 357.A O no hydrogen 3.337 N/A GLY 361.A N ARG 358.A O no hydrogen 3.087 N/A PHE 362.A N GLU 359.A O no hydrogen 3.176 N/A SER 363.A OG SER 365.A OG no hydrogen 3.339 N/A SER 365.A OG SER 363.A OG no hydrogen 3.339 N/A HIS 366.A N SER 363.A OG no hydrogen 3.353 N/A ALA 367.A N SER 363.A O no hydrogen 3.034 N/A GLY 368.A N TYR 364.A O no hydrogen 3.000 N/A LEU 369.A N HIS 366.A O no hydrogen 2.985 N/A SER 370.A N ALA 367.A O no hydrogen 3.277 N/A ARG 372.A N SER 370.A OG no hydrogen 3.152 N/A ARG 372.A NE GLU 435.A OE2 no hydrogen 2.869 N/A ARG 372.A NH1 ASP 405.A OD1 no hydrogen 2.798 N/A ARG 372.A NH1 SER 427.A O no hydrogen 3.425 N/A ARG 372.A NH2 SER 427.A O no hydrogen 2.733 N/A ARG 372.A NH2 GLU 435.A OE1 no hydrogen 2.872 N/A ARG 372.A NH2 GLU 435.A OE2 no hydrogen 3.510 N/A LEU 373.A N SER 370.A O no hydrogen 3.079 N/A ARG 375.A NH1 GLU 378.A OE2 no hydrogen 3.566 N/A LEU 379.A N ASP 376.A O no hydrogen 3.406 N/A LYS 384.A N ARG 380.A O no hydrogen 3.361 N/A GLU 385.A N GLU 381.A O no hydrogen 3.231 N/A GLN 386.A N ASN 382.A O no hydrogen 3.157 N/A LEU 387.A N ASP 383.A O no hydrogen 3.011 N/A LYS 388.A N LYS 384.A O no hydrogen 3.198 N/A ALA 389.A N GLU 385.A O no hydrogen 2.815 N/A ILE 390.A N GLN 386.A O no hydrogen 2.893 N/A SER 391.A N LEU 387.A O no hydrogen 3.061 N/A SER 391.A OG LYS 388.A O no hydrogen 2.703 N/A THR 392.A OG1 ALA 389.A O no hydrogen 2.716 N/A ARG 393.A N ILE 390.A O no hydrogen 3.235 N/A ARG 393.A NE SER 397.A OG no hydrogen 2.867 N/A ARG 393.A NH1 GLU 403.A OE2 no hydrogen 3.127 N/A ARG 393.A NH2 GLU 398.A O no hydrogen 2.826 N/A ARG 393.A NH2 GLU 403.A OE1 no hydrogen 3.096 N/A ARG 393.A NH2 GLU 403.A OE2 no hydrogen 3.510 N/A LEU 396.A N ASP 394.A OD1 no hydrogen 3.071 N/A SER 397.A N ASP 394.A O no hydrogen 3.099 N/A THR 400.A N GLU 403.A OE1 no hydrogen 3.014 N/A THR 400.A OG1 GLU 403.A OE1 no hydrogen 3.249 N/A GLN 402.A N GLN 402.A OE1 no hydrogen 2.963 N/A GLU 403.A N THR 400.A OG1 no hydrogen 3.169 N/A LYS 404.A N THR 400.A O no hydrogen 2.872 N/A ASP 405.A N GLU 401.A O no hydrogen 3.138 N/A PHE 406.A N GLN 402.A O no hydrogen 2.966 N/A LEU 407.A N GLU 403.A O no hydrogen 2.753 N/A TRP 408.A N LYS 404.A O no hydrogen 2.936 N/A SER 409.A N ASP 405.A O no hydrogen 2.977 N/A SER 409.A OG ASP 405.A O no hydrogen 3.063 N/A SER 409.A OG PHE 406.A O no hydrogen 2.720 N/A HIS 410.A N PHE 406.A O no hydrogen 3.212 N/A ARG 411.A N TRP 408.A O no hydrogen 3.200 N/A ARG 411.A NH1 TRP 408.A O no hydrogen 2.754 N/A ARG 411.A NH2 GLU 359.A OE1 no hydrogen 2.785 N/A ARG 411.A NH2 GLN 438.A OE1 no hydrogen 2.856 N/A CYS 414.A N HIS 410.A O no hydrogen 3.144 N/A CYS 414.A SG LEU 407.A O no hydrogen 3.993 N/A CYS 414.A SG HIS 410.A O no hydrogen 3.456 N/A THR 416.A N TYR 413.A O no hydrogen 2.973 N/A THR 416.A OG1 TYR 413.A O no hydrogen 2.634 N/A ILE 417.A N CYS 414.A O no hydrogen 3.201 N/A GLU 419.A N GLU 419.A OE1 no hydrogen 2.852 N/A ILE 420.A N ILE 417.A O no hydrogen 3.075 N/A LEU 421.A N PRO 418.A O no hydrogen 3.305 N/A LYS 423.A N ILE 420.A O no hydrogen 2.894 N/A LYS 423.A NZ ARG 393.A O no hydrogen 2.867 N/A LEU 424.A N ILE 420.A O no hydrogen 3.142 N/A LEU 425.A N LEU 421.A O no hydrogen 2.924 N/A LEU 426.A N PRO 422.A O no hydrogen 3.361 N/A SER 427.A N LYS 423.A O no hydrogen 3.169 N/A SER 427.A N LEU 424.A O no hydrogen 3.038 N/A SER 427.A OG LYS 423.A O no hydrogen 2.780 N/A LYS 429.A N GLU 435.A OE1 no hydrogen 2.924 N/A LYS 429.A NZ GLU 401.A OE2 no hydrogen 3.298 N/A TRP 430.A NE1 LEU 425.A O no hydrogen 2.810 N/A ASN 431.A ND2 LEU 230.A O no hydrogen 2.869 N/A SER 432.A N LYS 429.A O no hydrogen 3.071 N/A ARG 433.A N.A ASP 258.A OD1 no hydrogen 3.095 N/A ARG 433.A N.B ASP 258.A OD1 no hydrogen 3.093 N/A ARG 433.A NH1.B ASP 258.A OD1 no hydrogen 3.119 N/A VAL 436.A N SER 432.A O no hydrogen 3.036 N/A ALA 437.A N ARG 433.A O.A no hydrogen 3.096 N/A ALA 437.A N ARG 433.A O.B no hydrogen 3.076 N/A GLN 438.A NE2 GLU 359.A OE2 no hydrogen 3.506 N/A GLN 438.A NE2 ASP 434.A O no hydrogen 2.991 N/A MET 439.A N GLU 435.A O no hydrogen 2.884 N/A TYR 440.A N VAL 436.A O no hydrogen 2.875 N/A TYR 440.A OH ASP 464.A OD1 no hydrogen 2.600 N/A CYS 441.A N ALA 437.A O no hydrogen 3.349 N/A CYS 441.A SG ALA 437.A O no hydrogen 3.560 N/A LEU 442.A N GLN 438.A O no hydrogen 3.152 N/A VAL 443.A N MET 439.A O no hydrogen 2.775 N/A LYS 444.A N TYR 440.A O no hydrogen 2.824 N/A LYS 444.A NZ GLU 349.A OE1 no hydrogen 3.370 N/A LYS 444.A NZ GLU 349.A OE2 no hydrogen 2.837 N/A ASP 445.A N CYS 441.A O no hydrogen 3.465 N/A TRP 446.A N VAL 443.A O no hydrogen 3.205 N/A TRP 446.A NE1 PRO 418.A O no hydrogen 3.042 N/A LYS 450.A N GLN 453.A OE1 no hydrogen 3.294 N/A GLU 452.A N GLU 452.A OE1 no hydrogen 2.801 N/A ALA 454.A N LYS 450.A O no hydrogen 2.891 N/A MET 455.A N PRO 451.A O no hydrogen 2.892 N/A LEU 457.A N ALA 454.A O no hydrogen 3.069 N/A LEU 458.A N MET 455.A O no hydrogen 3.175 N/A ASP 459.A N GLU 456.A O no hydrogen 3.160 N/A ASN 461.A N ASP 459.A OD1 no hydrogen 2.911 N/A TYR 462.A N ASP 459.A O no hydrogen 3.267 N/A TYR 462.A OH PRO 422.A O no hydrogen 2.885 N/A MET 466.A N ASP 464.A OD2 no hydrogen 3.043 N/A VAL 467.A N ASP 464.A OD2 no hydrogen 3.194 N/A ARG 468.A N ASP 464.A O no hydrogen 3.030 N/A ARG 468.A NE GLU 498.A OE2.A no hydrogen 2.793 N/A ARG 468.A NE GLU 498.A OE2.B no hydrogen 2.854 N/A ARG 468.A NH1 LEU 458.A O no hydrogen 2.938 N/A ARG 468.A NH1 ASP 459.A O no hydrogen 3.309 N/A ARG 468.A NH1 TYR 462.A O no hydrogen 3.001 N/A ARG 468.A NH2 LEU 458.A O no hydrogen 3.082 N/A ARG 468.A NH2 GLU 498.A OE2.A no hydrogen 2.957 N/A ARG 468.A NH2 GLU 498.A OE2.B no hydrogen 2.990 N/A GLY 469.A N PRO 465.A O no hydrogen 2.855 N/A PHE 470.A N MET 466.A O no hydrogen 2.992 N/A ALA 471.A N VAL 467.A O no hydrogen 3.094 N/A VAL 472.A N ARG 468.A O no hydrogen 3.015 N/A ARG 473.A N GLY 469.A O no hydrogen 3.017 N/A CYS 474.A N PHE 470.A O no hydrogen 3.063 N/A CYS 474.A SG ILE 449.A O no hydrogen 3.957 N/A CYS 474.A SG PHE 470.A O no hydrogen 3.319 N/A LEU 475.A N ALA 471.A O no hydrogen 3.137 N/A GLU 476.A N VAL 472.A O no hydrogen 2.845 N/A LYS 477.A N ARG 473.A O no hydrogen 3.130 N/A TYR 478.A N CYS 474.A O no hydrogen 2.912 N/A LEU 479.A N LEU 475.A O no hydrogen 2.837 N/A THR 480.A OG1 SER 67.A OG no hydrogen 2.906 N/A LYS 483.A N THR 480.A OG1 no hydrogen 3.312 N/A LEU 484.A N THR 480.A O no hydrogen 2.784 N/A SER 485.A N ASP 481.A O no hydrogen 2.985 N/A SER 485.A OG ASP 481.A O no hydrogen 3.171 N/A GLN 486.A N ASP 482.A O no hydrogen 3.052 N/A TYR 487.A N LYS 483.A O no hydrogen 2.939 N/A TYR 487.A OH GLU 452.A OE2 no hydrogen 3.291 N/A LEU 488.A N SER 485.A O no hydrogen 3.495 N/A GLN 490.A NE2 GLN 671.A OE1 no hydrogen 2.807 N/A GLN 490.A NE2 LEU 840.A O no hydrogen 3.555 N/A LEU 491.A N TYR 487.A O no hydrogen 3.135 N/A VAL 492.A N LEU 488.A O no hydrogen 2.886 N/A GLN 493.A N ILE 489.A O no hydrogen 3.083 N/A GLN 493.A NE2 GLU 530.A OE1 no hydrogen 2.567 N/A VAL 494.A N GLN 490.A O no hydrogen 3.012 N/A LEU 495.A N VAL 492.A O no hydrogen 3.338 N/A LYS 496.A N.A GLN 493.A O no hydrogen 3.138 N/A LYS 496.A N.B GLN 493.A O no hydrogen 3.129 N/A LYS 496.A NZ.A GLN 493.A OE1 no hydrogen 2.672 N/A LYS 496.A NZ.A GLU 530.A OE2 no hydrogen 2.794 N/A LYS 496.A NZ.B GLN 493.A OE1 no hydrogen 2.734 N/A LYS 496.A NZ.B GLU 530.A OE2 no hydrogen 2.755 N/A TYR 497.A N.A VAL 494.A O no hydrogen 3.233 N/A TYR 497.A N.B VAL 494.A O no hydrogen 3.121 N/A TYR 497.A OH.B ILE 315.A O.A no hydrogen 3.067 N/A TYR 497.A OH.B ILE 315.A O.B no hydrogen 3.098 N/A GLU 498.A N.A LEU 495.A O no hydrogen 3.276 N/A GLU 498.A N.B LEU 495.A O no hydrogen 3.452 N/A GLN 499.A NE2 ASN 284.A OD1 no hydrogen 2.837 N/A TYR 500.A OH PHE 286.A O no hydrogen 2.560 N/A LEU 501.A N GLU 29.A OE2 no hydrogen 3.043 N/A ASN 503.A ND2 TYR 500.A O no hydrogen 2.882 N/A VAL 506.A N ASN 503.A OD1 no hydrogen 2.934 N/A ARG 507.A N ASN 503.A O no hydrogen 3.399 N/A ARG 507.A NE ASP 502.A OD1 no hydrogen 2.705 N/A ARG 507.A NH2 ASN 36.A O no hydrogen 3.317 N/A ARG 507.A NH2 ASP 502.A OD1 no hydrogen 3.400 N/A ARG 507.A NH2 ASP 502.A OD2 no hydrogen 3.121 N/A PHE 508.A N LEU 504.A O no hydrogen 3.091 N/A LEU 509.A N LEU 505.A O no hydrogen 2.949 N/A LEU 510.A N VAL 506.A O no hydrogen 2.947 N/A LYS 511.A N ARG 507.A O no hydrogen 3.090 N/A LYS 512.A N PHE 508.A O no hydrogen 3.157 N/A LYS 512.A NZ ASP 481.A OD1 no hydrogen 3.089 N/A ALA 513.A N LEU 509.A O no hydrogen 2.923 N/A LEU 514.A N LEU 510.A O no hydrogen 2.891 N/A THR 515.A N LYS 512.A O no hydrogen 3.314 N/A THR 515.A OG1 LYS 511.A O no hydrogen 2.708 N/A THR 515.A OG1 LYS 512.A O no hydrogen 3.506 N/A ASN 516.A ND2 ASP 481.A OD2 no hydrogen 2.910 N/A GLN 517.A N TYR 59.A O no hydrogen 2.938 N/A ARG 518.A N.A ASN 516.A OD1 no hydrogen 3.109 N/A ARG 518.A N.B ASN 516.A OD1 no hydrogen 3.112 N/A ARG 518.A NE.A SER 485.A OG no hydrogen 3.342 N/A ARG 518.A NH1.B PRO 62.A O no hydrogen 2.985 N/A ARG 518.A NH2.A SER 485.A OG no hydrogen 2.885 N/A ARG 518.A NH2.B PRO 63.A O no hydrogen 2.969 N/A ILE 519.A N ASN 516.A OD1 no hydrogen 3.202 N/A GLY 520.A N ASN 516.A O no hydrogen 2.838 N/A HIS 521.A N GLN 517.A O no hydrogen 2.961 N/A HIS 521.A ND1 TYR 554.A OH no hydrogen 2.647 N/A HIS 521.A NE2 PRO 610.A O no hydrogen 2.793 N/A PHE 523.A N ILE 519.A O no hydrogen 2.867 N/A PHE 524.A N GLY 520.A O no hydrogen 2.924 N/A TRP 525.A N HIS 521.A O no hydrogen 3.189 N/A TRP 525.A NE1 GLN 561.A OE1 no hydrogen 2.950 N/A HIS 526.A N PHE 522.A O no hydrogen 2.808 N/A LEU 527.A N PHE 523.A O no hydrogen 3.182 N/A LYS 528.A N PHE 524.A O no hydrogen 2.781 N/A LYS 528.A NZ ALA 14.A O no hydrogen 2.815 N/A SER 529.A N TRP 525.A O no hydrogen 2.903 N/A SER 529.A OG TRP 525.A O no hydrogen 3.111 N/A SER 529.A OG HIS 526.A O no hydrogen 2.806 N/A GLU 530.A N LEU 527.A O no hydrogen 3.265 N/A MET 531.A N LYS 528.A O no hydrogen 3.237 N/A ASN 533.A N GLU 530.A O no hydrogen 3.049 N/A THR 535.A N ASN 533.A OD1 no hydrogen 3.123 N/A THR 535.A OG1 ASN 533.A OD1 no hydrogen 3.341 N/A VAL 536.A N ASN 533.A O no hydrogen 3.164 N/A ARG 539.A NH1 TYR 500.A O no hydrogen 3.044 N/A PHE 540.A N VAL 536.A O no hydrogen 2.861 N/A GLY 541.A N SER 537.A O no hydrogen 2.841 N/A LEU 542.A N GLN 538.A O no hydrogen 2.933 N/A LEU 543.A N ARG 539.A O no hydrogen 3.022 N/A LEU 544.A N PHE 540.A O no hydrogen 2.808 N/A GLU 545.A N GLY 541.A O no hydrogen 2.980 N/A SER 546.A N LEU 542.A O no hydrogen 3.216 N/A SER 546.A OG LEU 543.A O no hydrogen 2.662 N/A TYR 547.A N LEU 543.A O no hydrogen 3.030 N/A CYS 548.A N LEU 544.A O no hydrogen 2.818 N/A CYS 548.A SG LEU 544.A O no hydrogen 3.218 N/A ARG 549.A N GLU 545.A O no hydrogen 3.002 N/A ARG 549.A NH1 ASN 8.A OD1 no hydrogen 3.130 N/A ARG 549.A NH2 ASN 8.A OD1 no hydrogen 2.829 N/A ARG 549.A NH2 GLU 545.A OE2 no hydrogen 2.960 N/A ALA 550.A N TYR 547.A O no hydrogen 3.187 N/A CYS 551.A N TYR 547.A O no hydrogen 2.860 N/A CYS 551.A SG CYS 548.A O no hydrogen 3.970 N/A CYS 551.A SG GLY 552.A O no hydrogen 3.933 N/A TYR 554.A OH HIS 521.A ND1 no hydrogen 2.647 N/A LEU 555.A N GLY 552.A O no hydrogen 3.307 N/A LYS 556.A N MET 553.A O no hydrogen 3.097 N/A LYS 556.A NZ GLU 10.A OE2 no hydrogen 2.772 N/A LEU 558.A N TYR 554.A O no hydrogen 2.687 N/A ASN 559.A N LEU 555.A O no hydrogen 2.878 N/A ASN 559.A ND2 GLU 10.A O no hydrogen 3.073 N/A ARG 560.A N LYS 556.A O no hydrogen 3.236 N/A ARG 560.A NH1 ASP 602.A O no hydrogen 3.491 N/A ARG 560.A NH2 ASP 602.A O no hydrogen 3.400 N/A ARG 560.A NH2 GLN 605.A O no hydrogen 2.619 N/A ARG 560.A NH2 GLY 606.A O no hydrogen 2.750 N/A GLN 561.A N HIS 557.A O no hydrogen 3.358 N/A GLN 561.A NE2 TYR 554.A OH no hydrogen 3.209 N/A GLN 561.A NE2 HIS 557.A O no hydrogen 3.555 N/A VAL 562.A N LEU 558.A O no hydrogen 2.846 N/A GLU 563.A N ASN 559.A O no hydrogen 3.053 N/A ALA 564.A N ARG 560.A O no hydrogen 2.981 N/A MET 565.A N GLN 561.A O no hydrogen 2.849 N/A GLU 566.A N.A VAL 562.A O no hydrogen 2.918 N/A GLU 566.A N.B VAL 562.A O no hydrogen 2.926 N/A LYS 567.A N GLU 563.A O no hydrogen 3.036 N/A LEU 568.A N ALA 564.A O no hydrogen 3.211 N/A ILE 569.A N MET 565.A O no hydrogen 2.894 N/A ASN 570.A N GLU 566.A O.A no hydrogen 2.948 N/A ASN 570.A N GLU 566.A O.B no hydrogen 2.969 N/A LEU 571.A N LYS 567.A O no hydrogen 3.053 N/A THR 572.A N LEU 568.A O no hydrogen 3.048 N/A THR 572.A OG1 LEU 568.A O no hydrogen 2.767 N/A THR 572.A OG1 ILE 569.A O no hydrogen 3.089 N/A ASP 573.A N ILE 569.A O no hydrogen 2.936 N/A ILE 574.A N ASN 570.A O no hydrogen 3.273 N/A LEU 575.A N LEU 571.A O no hydrogen 3.127 N/A LYS 576.A N THR 572.A O no hydrogen 2.894 N/A LYS 576.A NZ ASN 659.A O no hydrogen 3.422 N/A LYS 576.A NZ ASN 659.A OD1 no hydrogen 3.290 N/A GLN 577.A N ASP 573.A O no hydrogen 2.993 N/A GLU 578.A N ILE 574.A O no hydrogen 2.759 N/A LYS 579.A N ILE 574.A O no hydrogen 3.216 N/A GLN 584.A NE2 ILE 627.A O no hydrogen 2.772 N/A GLN 587.A N THR 583.A O no hydrogen 3.002 N/A GLN 587.A NE2 LYS 579.A O no hydrogen 2.611 N/A GLN 587.A NE2 LYS 580.A O no hydrogen 3.426 N/A MET 588.A N GLN 584.A O no hydrogen 3.018 N/A LYS 589.A N LYS 585.A O no hydrogen 3.115 N/A PHE 590.A N VAL 586.A O no hydrogen 3.009 N/A LEU 591.A N GLN 587.A O no hydrogen 2.867 N/A VAL 592.A N MET 588.A O no hydrogen 2.922 N/A GLU 593.A N LYS 589.A O no hydrogen 3.115 N/A GLN 594.A N PHE 590.A O no hydrogen 3.005 N/A MET 595.A N LEU 591.A O no hydrogen 2.963 N/A ARG 596.A N VAL 592.A O no hydrogen 3.123 N/A ARG 597.A N GLN 594.A O no hydrogen 3.344 N/A ARG 597.A NH1 GLN 594.A OE1 no hydrogen 2.830 N/A PHE 600.A N ASP 599.A OD1 no hydrogen 2.897 N/A MET 601.A N ARG 597.A O no hydrogen 2.801 N/A ASP 602.A N PRO 598.A O no hydrogen 3.421 N/A ALA 603.A N ASP 599.A O no hydrogen 3.285 N/A LEU 604.A N PHE 600.A O no hydrogen 2.897 N/A GLN 605.A N ASP 602.A O no hydrogen 3.481 N/A GLN 605.A NE2 MET 601.A O no hydrogen 3.412 N/A GLY 606.A N GLY 618.A O no hydrogen 3.143 N/A PHE 607.A N LEU 617.A O no hydrogen 2.992 N/A SER 609.A N HIS 615.A O no hydrogen 3.053 N/A ASN 612.A N SER 609.A O no hydrogen 3.253 N/A ALA 614.A N ASN 612.A OD1 no hydrogen 3.076 N/A HIS 615.A N ASN 612.A O no hydrogen 2.932 N/A LEU 617.A N PHE 607.A O no hydrogen 2.739 N/A GLY 618.A N GLU 640.A O no hydrogen 2.818 N/A LEU 620.A N GLN 605.A OE1 no hydrogen 2.761 N/A ARG 621.A N ASN 638.A O no hydrogen 2.869 N/A ARG 621.A NE GLU 640.A OE2 no hydrogen 3.535 N/A GLU 623.A N GLU 623.A OE1 no hydrogen 2.786 N/A GLU 624.A N ARG 621.A O no hydrogen 2.961 N/A CYS 625.A N LEU 622.A O no hydrogen 3.294 N/A CYS 625.A SG ARG 621.A O no hydrogen 3.420 N/A ARG 626.A N TRP 636.A O no hydrogen 2.850 N/A MET 628.A N PRO 634.A O no hydrogen 2.980 N/A LYS 632.A NZ ASP 661.A OD1 no hydrogen 2.921 N/A ARG 633.A N SER 630.A O no hydrogen 3.117 N/A ARG 633.A NE MET 628.A O no hydrogen 3.437 N/A LEU 635.A N PHE 657.A O no hydrogen 2.792 N/A TRP 636.A N ARG 626.A O no hydrogen 2.683 N/A TRP 636.A NE1 GLU 654.A OE2 no hydrogen 3.165 N/A LEU 637.A N ILE 655.A O no hydrogen 2.871 N/A TRP 639.A N ASN 653.A O no hydrogen 3.044 N/A TRP 639.A NE1 LEU 604.A O no hydrogen 2.807 N/A GLU 640.A N ASN 619.A O no hydrogen 2.846 N/A ASN 641.A N GLN 651.A O no hydrogen 2.920 N/A ASN 641.A ND2 GLY 134.A O no hydrogen 2.805 N/A ASN 641.A ND2 PHE 650.A O no hydrogen 3.017 N/A ASP 643.A N ASN 641.A OD1 no hydrogen 3.111 N/A MET 645.A N ASP 643.A OD2 no hydrogen 2.858 N/A SER 646.A N ASP 643.A O no hydrogen 3.192 N/A SER 646.A OG ASP 643.A O no hydrogen 3.478 N/A GLU 647.A N GLU 647.A OE1 no hydrogen 2.738 N/A LEU 649.A N SER 646.A O no hydrogen 2.991 N/A ASN 653.A N TRP 639.A O no hydrogen 2.849 N/A ILE 655.A N LEU 637.A O no hydrogen 3.002 N/A ILE 656.A N ILE 704.A O no hydrogen 2.835 N/A PHE 657.A N LEU 635.A O no hydrogen 2.813 N/A LYS 658.A N GLY 702.A O no hydrogen 3.066 N/A LYS 658.A NZ ASP 661.A OD2 no hydrogen 2.726 N/A ASN 659.A ND2 THR 572.A OG1 no hydrogen 2.761 N/A ASN 659.A ND2 ASP 573.A OD1 no hydrogen 2.694 N/A GLY 660.A N CYS 700.A O no hydrogen 2.713 N/A ARG 664.A N ASP 662.A OD1 no hydrogen 3.196 N/A ARG 664.A NE ASP 662.A OD1 no hydrogen 3.218 N/A ARG 664.A NH2 ASP 662.A OD2 no hydrogen 3.199 N/A GLN 665.A NE2 ASP 662.A OD2 no hydrogen 3.385 N/A MET 667.A N LEU 663.A O no hydrogen 3.001 N/A LEU 668.A N ARG 664.A O no hydrogen 3.099 N/A THR 669.A N GLN 665.A O no hydrogen 2.984 N/A THR 669.A OG1 GLN 665.A O no hydrogen 2.985 N/A LEU 670.A N ASP 666.A O no hydrogen 2.779 N/A GLN 671.A N MET 667.A O no hydrogen 3.024 N/A GLN 671.A NE2 GLN 486.A O no hydrogen 2.640 N/A GLN 671.A NE2 GLN 490.A OE1 no hydrogen 2.692 N/A ILE 672.A N LEU 668.A O no hydrogen 2.984 N/A ILE 673.A N THR 669.A O no hydrogen 2.884 N/A ARG 674.A N LEU 670.A O no hydrogen 3.189 N/A ILE 675.A N GLN 671.A O no hydrogen 3.087 N/A MET 676.A N ILE 672.A O no hydrogen 2.805 N/A GLU 677.A N ILE 673.A O no hydrogen 2.888 N/A ASN 678.A N ARG 674.A O no hydrogen 2.940 N/A ILE 679.A N ILE 675.A O no hydrogen 2.952 N/A TRP 680.A N MET 676.A O no hydrogen 2.988 N/A TRP 680.A NE1 ALA 826.A O no hydrogen 2.987 N/A GLN 681.A N GLU 677.A O no hydrogen 2.912 N/A GLN 681.A NE2 ASP 686.A OD1 no hydrogen 2.886 N/A ASN 682.A N ASN 678.A O no hydrogen 3.212 N/A ASN 682.A ND2 ASN 678.A OD1 no hydrogen 3.502 N/A GLN 683.A N ILE 679.A O no hydrogen 3.218 N/A GLN 683.A N TRP 680.A O no hydrogen 3.252 N/A GLY 684.A N GLN 681.A O no hydrogen 3.134 N/A LEU 685.A N TRP 680.A O no hydrogen 2.891 N/A LEU 687.A N LEU 685.A O no hydrogen 3.002 N/A MET 689.A N GLU 677.A OE2 no hydrogen 2.829 N/A LEU 690.A N TYR 751.A OH no hydrogen 2.971 N/A TYR 692.A N LEU 690.A O no hydrogen 2.901 N/A GLY 693.A N GLU 705.A OE1 no hydrogen 2.831 N/A CYS 694.A SG LEU 703.A O no hydrogen 3.849 N/A LEU 695.A N LEU 703.A O no hydrogen 2.886 N/A ILE 697.A N VAL 701.A O no hydrogen 3.039 N/A CYS 700.A SG ASP 699.A OD1 no hydrogen 3.656 N/A GLY 702.A N LYS 658.A O no hydrogen 3.047 N/A LEU 703.A N LEU 695.A O no hydrogen 2.819 N/A ILE 704.A N ILE 656.A O no hydrogen 2.870 N/A GLU 705.A N GLY 693.A O no hydrogen 2.799 N/A VAL 706.A N GLU 654.A O no hydrogen 3.322 N/A SER 710.A OG VAL 707.A O no hydrogen 2.732 N/A HIS 711.A N VAL 770.A O no hydrogen 2.963 N/A THR 712.A N GLN 715.A OE1 no hydrogen 3.212 N/A ILE 713.A N ILE 768.A O no hydrogen 3.176 N/A MET 714.A N ASN 765.A O no hydrogen 3.289 N/A GLN 715.A N THR 712.A OG1 no hydrogen 3.209 N/A ILE 716.A N THR 712.A O no hydrogen 3.213 N/A GLN 717.A N ILE 713.A O no hydrogen 3.088 N/A CYS 718.A N MET 714.A O no hydrogen 2.888 N/A CYS 718.A SG MET 714.A O no hydrogen 3.266 N/A LYS 719.A N ILE 716.A O no hydrogen 3.269 N/A THR 723.A OG1 ASN 720.A O no hydrogen 2.968 N/A HIS 725.A NE2 TYR 737.A OH no hydrogen 2.670 N/A GLN 726.A N HIS 722.A O no hydrogen 2.963 N/A TRP 727.A N THR 723.A O no hydrogen 2.998 N/A LEU 728.A N LEU 724.A O no hydrogen 3.181 N/A LYS 729.A N HIS 725.A O no hydrogen 2.896 N/A ASP 730.A N GLN 726.A O no hydrogen 2.903 N/A LYS 731.A N TRP 727.A O no hydrogen 2.834 N/A LYS 731.A NZ ASP 772.A OD2 no hydrogen 3.252 N/A ASN 732.A N LEU 728.A O no hydrogen 2.743 N/A ASN 732.A ND2 LEU 728.A O no hydrogen 3.408 N/A ASN 732.A ND2 ASP 772.A O no hydrogen 2.743 N/A LYS 733.A NZ ASP 730.A OD1 no hydrogen 3.407 N/A TYR 737.A N GLY 734.A O no hydrogen 3.372 N/A TYR 737.A OH HIS 725.A NE2 no hydrogen 2.670 N/A ALA 740.A N ILE 736.A O no hydrogen 3.353 N/A ILE 741.A N TYR 737.A O no hydrogen 3.130 N/A ASP 742.A N ASP 738.A O no hydrogen 2.962 N/A LEU 743.A N ALA 739.A O no hydrogen 2.953 N/A PHE 744.A N ALA 740.A O no hydrogen 2.905 N/A THR 745.A N ILE 741.A O no hydrogen 2.965 N/A ARG 746.A N ASP 742.A O no hydrogen 3.096 N/A ARG 746.A NE ASP 742.A OD1 no hydrogen 3.150 N/A ARG 746.A NE ASP 742.A OD2 no hydrogen 3.376 N/A ARG 746.A NH1 ASP 686.A O no hydrogen 3.084 N/A SER 747.A N LEU 743.A O no hydrogen 3.019 N/A SER 747.A OG LEU 743.A O no hydrogen 2.907 N/A SER 747.A OG PHE 744.A O no hydrogen 3.038 N/A SER 747.A OG LEU 776.A O no hydrogen 3.519 N/A CYS 748.A N PHE 744.A O no hydrogen 2.899 N/A ALA 749.A N THR 745.A O no hydrogen 3.016 N/A GLY 750.A N ARG 746.A O no hydrogen 3.231 N/A TYR 751.A N SER 747.A O no hydrogen 3.134 N/A CYS 752.A N CYS 748.A O no hydrogen 2.979 N/A CYS 752.A SG CYS 748.A O no hydrogen 3.161 N/A VAL 753.A N ALA 749.A O no hydrogen 3.142 N/A ALA 754.A N GLY 750.A O no hydrogen 2.895 N/A THR 755.A N TYR 751.A O no hydrogen 3.010 N/A THR 755.A OG1 TYR 751.A O no hydrogen 2.550 N/A THR 755.A OG1 CYS 752.A O no hydrogen 3.358 N/A PHE 756.A N CYS 752.A O no hydrogen 3.215 N/A ILE 757.A N VAL 753.A O no hydrogen 2.978 N/A LEU 758.A N ALA 754.A O no hydrogen 3.109 N/A GLY 759.A N THR 755.A O no hydrogen 2.908 N/A ILE 760.A N THR 755.A O no hydrogen 3.314 N/A GLY 761.A N HIS 783.A O no hydrogen 3.341 N/A ARG 763.A N PRO 792.A O no hydrogen 2.946 N/A ARG 763.A NE GLY 761.A O no hydrogen 2.926 N/A ARG 763.A NH1 ILE 779.A O no hydrogen 2.740 N/A ARG 763.A NH2 GLY 761.A O no hydrogen 3.058 N/A ARG 763.A NH2 ASP 780.A O no hydrogen 3.087 N/A HIS 764.A N ASN 767.A OD1 no hydrogen 2.865 N/A ASN 767.A N HIS 764.A O no hydrogen 3.216 N/A ASN 767.A ND2 ASP 762.A O no hydrogen 3.151 N/A MET 769.A N PHE 777.A O no hydrogen 2.728 N/A VAL 770.A N HIS 711.A O no hydrogen 2.825 N/A LYS 771.A N GLN 775.A O no hydrogen 2.864 N/A ASP 772.A N ASN 709.A O no hydrogen 3.234 N/A GLY 774.A N LYS 771.A O no hydrogen 3.287 N/A GLN 775.A N ASP 773.A OD1 no hydrogen 3.460 N/A LEU 776.A N SER 747.A OG no hydrogen 3.026 N/A PHE 777.A N MET 769.A O no hydrogen 2.872 N/A ILE 779.A N ASN 767.A O no hydrogen 3.046 N/A ASP 780.A N TYR 692.A OH no hydrogen 3.023 N/A HIS 783.A ND1 GLU 851.A OE2 no hydrogen 2.600 N/A LEU 785.A N LEU 758.A O no hydrogen 2.659 N/A HIS 787.A N LEU 785.A O no hydrogen 2.831 N/A ARG 788.A NH2 ASP 884.A OD2 no hydrogen 3.566 N/A ARG 790.A N TYR 860.A OH no hydrogen 3.161 N/A ARG 790.A NH1 GLY 759.A O no hydrogen 3.360 N/A ARG 790.A NH1 ILE 760.A O no hydrogen 3.203 N/A ARG 790.A NH2 ILE 760.A O no hydrogen 2.941 N/A ARG 790.A NH2 ASP 762.A OD1 no hydrogen 2.926 N/A PHE 799.A N THR 796.A O no hydrogen 2.997 N/A LEU 800.A N THR 796.A O no hydrogen 3.391 N/A ILE 801.A N GLN 797.A O no hydrogen 2.963 N/A ILE 803.A N PHE 799.A O no hydrogen 3.266 N/A SER 804.A N LEU 800.A O no hydrogen 3.052 N/A SER 804.A OG LEU 800.A O no hydrogen 3.349 N/A SER 804.A OG CYS 810.A O no hydrogen 2.878 N/A SER 804.A OG THR 813.A OG1 no hydrogen 2.972 N/A LYS 805.A N VAL 802.A O no hydrogen 3.336 N/A LYS 805.A NZ ASP 738.A OD1 no hydrogen 3.217 N/A GLY 806.A N ILE 801.A O no hydrogen 2.962 N/A THR 813.A OG1 SER 804.A OG no hydrogen 2.972 N/A THR 813.A OG1 CYS 810.A O no hydrogen 2.792 N/A GLU 815.A N GLU 815.A OE1 no hydrogen 2.824 N/A PHE 816.A N THR 813.A OG1 no hydrogen 3.342 N/A GLU 817.A N THR 813.A O no hydrogen 3.039 N/A ARG 818.A N ARG 814.A O no hydrogen 3.050 N/A ARG 818.A NE ARG 814.A O no hydrogen 3.570 N/A PHE 819.A N GLU 815.A O no hydrogen 2.930 N/A GLN 820.A N PHE 816.A O no hydrogen 2.861 N/A GLN 820.A NE2 GLY 889.A O no hydrogen 3.455 N/A GLU 821.A N GLU 817.A O no hydrogen 3.066 N/A MET 822.A N ARG 818.A O no hydrogen 3.046 N/A CYS 823.A N PHE 819.A O no hydrogen 3.201 N/A CYS 823.A SG PHE 819.A O no hydrogen 3.288 N/A TYR 824.A N GLN 820.A O no hydrogen 2.931 N/A LYS 825.A N GLU 821.A O no hydrogen 3.072 N/A ALA 826.A N MET 822.A O no hydrogen 2.921 N/A TYR 827.A N CYS 823.A O no hydrogen 2.902 N/A TYR 827.A OH THR 864.A O no hydrogen 2.610 N/A LEU 828.A N TYR 824.A O no hydrogen 3.053 N/A ALA 829.A N LYS 825.A O no hydrogen 3.116 N/A ILE 830.A N ALA 826.A O no hydrogen 3.306 N/A ARG 831.A N TYR 827.A O no hydrogen 3.204 N/A ARG 831.A NH1 LEU 865.A O no hydrogen 3.369 N/A GLN 832.A N LEU 828.A O no hydrogen 3.275 N/A HIS 833.A N ILE 830.A O no hydrogen 3.002 N/A ALA 834.A N ARG 831.A O no hydrogen 3.337 N/A ILE 838.A N ALA 834.A O no hydrogen 2.924 N/A ASN 839.A N ASN 835.A O no hydrogen 2.827 N/A LEU 840.A N LEU 836.A O no hydrogen 2.766 N/A PHE 841.A N PHE 837.A O no hydrogen 3.063 N/A SER 842.A N ILE 838.A O no hydrogen 2.829 N/A SER 842.A OG ILE 838.A O no hydrogen 2.725 N/A MET 843.A N ASN 839.A O no hydrogen 2.871 N/A MET 844.A N PHE 841.A O no hydrogen 3.086 N/A LEU 845.A N SER 842.A O no hydrogen 3.394 N/A LEU 852.A N MET 849.A O no hydrogen 3.061 N/A GLN 853.A N ASP 857.A OD2 no hydrogen 2.751 N/A SER 854.A N ASP 857.A OD2 no hydrogen 3.166 N/A ASP 857.A N SER 854.A O no hydrogen 3.212 N/A ALA 859.A N PHE 855.A O no hydrogen 3.117 N/A TYR 860.A N ASP 857.A O no hydrogen 3.464 N/A ILE 861.A N ILE 858.A O no hydrogen 2.905 N/A ARG 862.A NE ASP 394.A OD2 no hydrogen 3.419 N/A LYS 863.A N ALA 859.A O no hydrogen 3.197 N/A THR 864.A N TYR 860.A O no hydrogen 2.945 N/A THR 864.A OG1 ILE 757.A O no hydrogen 2.793 N/A THR 864.A OG1 TYR 860.A O no hydrogen 3.454 N/A THR 864.A OG1 ILE 861.A O no hydrogen 3.232 N/A LEU 865.A N ILE 861.A O no hydrogen 2.868 N/A ALA 866.A N LYS 863.A O no hydrogen 3.185 N/A LEU 867.A N ARG 862.A O no hydrogen 3.300 N/A THR 870.A N GLU 873.A OE1 no hydrogen 3.096 N/A THR 870.A OG1 GLU 873.A OE1 no hydrogen 2.708 N/A GLN 872.A NE2 GLU 876.A OE2 no hydrogen 3.519 N/A GLU 873.A N THR 870.A OG1 no hydrogen 3.377 N/A ALA 874.A N THR 870.A O no hydrogen 2.844 N/A LEU 875.A N GLU 871.A O no hydrogen 3.241 N/A GLU 876.A N GLN 872.A O no hydrogen 3.063 N/A TYR 877.A N GLU 873.A O no hydrogen 2.914 N/A TYR 877.A OH GLU 789.A OE2 no hydrogen 2.717 N/A PHE 878.A N ALA 874.A O no hydrogen 2.957 N/A MET 879.A N LEU 875.A O no hydrogen 2.857 N/A LYS 880.A N GLU 876.A O no hydrogen 3.033 N/A GLN 881.A N TYR 877.A O no hydrogen 3.079 N/A GLN 881.A NE2 GLU 789.A O no hydrogen 3.328 N/A MET 882.A N PHE 878.A O no hydrogen 3.119 N/A ASN 883.A N MET 879.A O no hydrogen 2.739 N/A ASP 884.A N LYS 880.A O no hydrogen 2.975 N/A ALA 885.A N GLN 881.A O no hydrogen 3.267 N/A HIS 886.A N MET 882.A O no hydrogen 3.213 N/A HIS 886.A ND1 MET 882.A O no hydrogen 2.588 N/A GLY 888.A N ASN 883.A O no hydrogen 3.014 N/A TRP 890.A N ASN 883.A OD1 no hydrogen 2.864 N/A