Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1avk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N SER 2.A OG no hydrogen 3.361 N/A ARG 5.A N SER 2.A O no hydrogen 3.441 N/A ARG 5.A NE SER 2.A O no hydrogen 3.124 N/A SER 8.A N GLU 11.A OE1 no hydrogen 3.075 N/A SER 8.A OG GLU 11.A OE1 no hydrogen 3.377 N/A GLU 11.A N SER 8.A OG no hydrogen 3.215 N/A ILE 12.A N SER 8.A O no hydrogen 3.180 N/A SER 13.A N ALA 9.A O no hydrogen 2.931 N/A SER 13.A OG ALA 9.A O no hydrogen 3.522 N/A GLU 14.A N GLY 10.A O no hydrogen 2.897 N/A VAL 15.A N GLU 11.A O no hydrogen 2.991 N/A GLN 16.A N ILE 12.A O no hydrogen 3.064 N/A GLN 16.A NE2 PHE 324.A O no hydrogen 2.935 N/A GLY 17.A N SER 13.A O no hydrogen 2.717 N/A ILE 18.A N GLU 14.A O no hydrogen 2.733 N/A LEU 19.A N VAL 15.A O no hydrogen 2.769 N/A ARG 20.A N GLN 16.A O no hydrogen 2.861 N/A THR 21.A N GLY 17.A O no hydrogen 2.865 N/A THR 21.A OG1 GLY 17.A O no hydrogen 3.393 N/A ALA 22.A N ILE 18.A O no hydrogen 3.255 N/A GLY 23.A N ARG 20.A O no hydrogen 2.881 N/A LEU 24.A N LEU 19.A O no hydrogen 2.912 N/A LEU 25.A N LEU 19.A O no hydrogen 3.106 N/A LYS 29.A N GLY 26.A O no hydrogen 3.287 N/A LYS 29.A NZ ASP 58.A OD2 no hydrogen 2.835 N/A ARG 30.A N HIS 57.A O no hydrogen 2.964 N/A ARG 30.A NE GLU 95.A OE1 no hydrogen 3.350 N/A ARG 30.A NE GLU 95.A OE2 no hydrogen 3.287 N/A ARG 30.A NH1 PRO 27.A O no hydrogen 3.280 N/A ARG 30.A NH1 LYS 29.A O no hydrogen 3.234 N/A ILE 31.A N ALA 323.A O no hydrogen 2.760 N/A ALA 32.A N PHE 55.A O no hydrogen 2.786 N/A TYR 33.A OH ASP 242.A OD1 no hydrogen 2.730 N/A GLY 35.A N ARG 53.A O no hydrogen 3.084 N/A LEU 37.A N ARG 51.A O no hydrogen 3.103 N/A ARG 41.A NE ASP 573.A OD2 no hydrogen 2.917 N/A ARG 41.A NH1 ASP 432.A OD2 no hydrogen 3.229 N/A ARG 41.A NH2 ASP 432.A OD1 no hydrogen 3.198 N/A ARG 41.A NH2 ASP 432.A OD2 no hydrogen 3.030 N/A ARG 41.A NH2 ASP 573.A OD1 no hydrogen 2.829 N/A ARG 41.A NH2 ASP 573.A OD2 no hydrogen 3.104 N/A SER 45.A N GLY 42.A O no hydrogen 3.341 N/A ARG 50.A N THR 72.A OG1 no hydrogen 2.916 N/A ARG 50.A NE GLU 11.A OE1 no hydrogen 3.484 N/A ARG 50.A NE GLU 11.A OE2 no hydrogen 2.764 N/A ARG 50.A NH1 ARG 5.A O no hydrogen 3.131 N/A ARG 50.A NH2 ARG 5.A O no hydrogen 2.613 N/A ARG 50.A NH2 GLU 11.A OE1 no hydrogen 3.150 N/A ARG 51.A NE ASP 49.A OD2 no hydrogen 3.496 N/A PHE 52.A N VAL 69.A O no hydrogen 2.778 N/A ARG 53.A N GLY 35.A O no hydrogen 2.808 N/A ARG 53.A NE GLU 66.A OE2 no hydrogen 3.345 N/A ARG 53.A NH1 ASP 548.A OD1 no hydrogen 2.848 N/A ARG 53.A NH2 GLU 66.A OE1 no hydrogen 3.512 N/A ARG 53.A NH2 GLU 66.A OE2 no hydrogen 3.564 N/A VAL 54.A N VAL 67.A O no hydrogen 2.736 N/A PHE 55.A N TYR 33.A O no hydrogen 2.821 N/A ILE 56.A N GLN 65.A O no hydrogen 2.886 N/A HIS 57.A N ARG 30.A O no hydrogen 2.615 N/A VAL 59.A N GLU 28.A O no hydrogen 3.328 N/A SER 60.A N ASP 58.A OD1 no hydrogen 3.223 N/A SER 60.A OG ASP 58.A OD1 no hydrogen 2.736 N/A GLY 61.A N ASP 58.A OD1 no hydrogen 3.343 N/A ALA 62.A N ASP 58.A OD1 no hydrogen 3.046 N/A ARG 63.A NH1 GLU 81.A OE1 no hydrogen 3.077 N/A GLN 65.A N ILE 56.A O no hydrogen 3.035 N/A GLU 66.A N VAL 80.A O no hydrogen 2.850 N/A VAL 67.A N VAL 54.A O no hydrogen 2.819 N/A THR 68.A N SER 78.A O no hydrogen 2.989 N/A VAL 69.A N PHE 52.A O no hydrogen 3.026 N/A SER 70.A N THR 75.A O no hydrogen 2.794 N/A SER 70.A OG ASP 49.A OD1 no hydrogen 2.706 N/A THR 72.A OG1 GLU 48.A OE2 no hydrogen 3.384 N/A GLY 74.A N SER 70.A O no hydrogen 2.814 N/A THR 75.A N SER 70.A O no hydrogen 3.337 N/A ILE 77.A N THR 68.A O no hydrogen 2.721 N/A SER 78.A N THR 68.A O no hydrogen 3.290 N/A VAL 80.A N GLU 66.A O no hydrogen 3.074 N/A LEU 82.A N PRO 64.A O no hydrogen 2.844 N/A THR 84.A OG1 GLU 89.A OE1 no hydrogen 3.243 N/A THR 84.A OG1 GLU 89.A OE2 no hydrogen 2.721 N/A ALA 86.A N ASP 83.A O no hydrogen 2.804 N/A THR 87.A N ASP 83.A O no hydrogen 3.101 N/A GLY 88.A N THR 84.A O no hydrogen 2.835 N/A GLU 89.A N ASN 551.A O no hydrogen 2.968 N/A VAL 92.A N GLU 293.A O no hydrogen 3.083 N/A GLU 96.A N LEU 93.A O no hydrogen 2.939 N/A PHE 97.A N GLU 94.A O no hydrogen 3.128 N/A VAL 99.A N GLU 96.A O no hydrogen 3.384 N/A LEU 103.A N VAL 99.A O no hydrogen 2.835 N/A ALA 105.A N GLU 101.A O no hydrogen 3.138 N/A THR 106.A N LEU 103.A O no hydrogen 3.309 N/A THR 106.A OG1 LEU 103.A O no hydrogen 3.159 N/A ASP 107.A N LEU 104.A O no hydrogen 3.123 N/A ARG 109.A N ASP 107.A OD1 no hydrogen 3.025 N/A ARG 109.A NH1 ASP 107.A OD1 no hydrogen 3.255 N/A ARG 109.A NH1 VAL 178.A O no hydrogen 3.461 N/A ARG 109.A NH2 VAL 178.A O no hydrogen 2.966 N/A TRP 110.A N ASP 107.A O no hydrogen 3.222 N/A TRP 110.A N ASP 107.A OD1 no hydrogen 3.299 N/A LEU 111.A N ASP 107.A O no hydrogen 2.987 N/A LYS 112.A N GLU 108.A O no hydrogen 3.049 N/A ALA 113.A N ARG 109.A O no hydrogen 3.233 N/A LEU 114.A N TRP 110.A O no hydrogen 3.028 N/A ALA 115.A N LEU 111.A O no hydrogen 3.021 N/A ALA 116.A N LYS 112.A O no hydrogen 3.249 N/A ARG 117.A N LEU 114.A O no hydrogen 3.281 N/A ARG 117.A NE ALA 113.A O no hydrogen 3.232 N/A ARG 117.A NH1 GLY 185.A O no hydrogen 3.085 N/A ARG 117.A NH2 ASP 183.A OD2 no hydrogen 2.766 N/A ARG 117.A NH2 GLY 185.A O no hydrogen 3.395 N/A ASN 118.A N ALA 115.A O no hydrogen 2.958 N/A LEU 119.A N LEU 114.A O no hydrogen 2.856 N/A SER 122.A OG ASP 120.A OD2 no hydrogen 2.976 N/A LYS 123.A N ASP 120.A O no hydrogen 2.779 N/A LYS 123.A NZ ASP 153.A O no hydrogen 3.165 N/A VAL 124.A N VAL 121.A O no hydrogen 3.390 N/A ARG 125.A N PHE 150.A O no hydrogen 2.795 N/A ARG 125.A NE GLU 101.A OE2 no hydrogen 2.950 N/A ARG 125.A NH1 GLN 152.A OE1 no hydrogen 3.386 N/A ARG 125.A NH2 SER 122.A O no hydrogen 2.575 N/A VAL 126.A N GLU 101.A OE1 no hydrogen 3.155 N/A ALA 127.A N LEU 148.A O no hydrogen 2.891 N/A LEU 129.A N ARG 146.A O no hydrogen 2.678 N/A SER 130.A N TYR 294.A OH no hydrogen 2.989 N/A SER 130.A OG GLU 293.A OE1 no hydrogen 2.754 N/A TYR 136.A OH TYR 170.A OH no hydrogen 2.795 N/A GLU 139.A N TYR 136.A O no hydrogen 3.319 N/A ARG 142.A N GLU 139.A O no hydrogen 2.916 N/A ARG 142.A NE ASP 172.A OD2 no hydrogen 2.779 N/A ARG 142.A NH1 GLU 138.A O no hydrogen 3.502 N/A ARG 142.A NH2 ASP 172.A OD2 no hydrogen 2.992 N/A ARG 143.A NH1 PRO 91.A O no hydrogen 3.334 N/A ARG 143.A NH1 GLU 96.A OE1 no hydrogen 2.853 N/A ARG 143.A NH1 GLU 96.A OE2 no hydrogen 2.994 N/A ARG 143.A NH2 PRO 91.A O no hydrogen 3.035 N/A ILE 144.A N GLN 552.A OE1 no hydrogen 2.958 N/A LEU 145.A N VAL 171.A O no hydrogen 3.157 N/A ARG 146.A N LEU 129.A O no hydrogen 2.806 N/A ARG 146.A NH2 GLU 139.A OE2 no hydrogen 3.533 N/A GLY 147.A N ALA 169.A O no hydrogen 2.926 N/A LEU 148.A N ALA 127.A O no hydrogen 3.312 N/A PHE 150.A N ARG 125.A O no hydrogen 2.773 N/A VAL 151.A N HIS 162.A O no hydrogen 2.834 N/A GLN 152.A N LYS 123.A O no hydrogen 2.828 N/A GLN 152.A NE2 ASP 157.A O no hydrogen 2.988 N/A ASP 153.A N ASP 157.A OD2 no hydrogen 3.128 N/A ASP 157.A N PHE 154.A O no hydrogen 3.011 N/A SER 158.A N ASN 195.A OD1 no hydrogen 2.822 N/A ALA 161.A N SER 158.A O no hydrogen 3.043 N/A HIS 162.A N ALA 159.A O no hydrogen 2.961 N/A HIS 162.A ND1 VAL 151.A O no hydrogen 3.012 N/A VAL 164.A N ALA 149.A O no hydrogen 2.815 N/A GLY 166.A N ASP 165.A OD1 no hydrogen 2.903 N/A VAL 168.A N ILE 182.A O no hydrogen 3.117 N/A ALA 169.A N GLY 147.A O no hydrogen 3.471 N/A TYR 170.A N ARG 180.A O no hydrogen 3.061 N/A TYR 170.A OH TYR 136.A OH no hydrogen 2.795 N/A VAL 171.A N LEU 145.A O no hydrogen 2.934 N/A ASP 172.A N GLU 177.A O no hydrogen 2.853 N/A VAL 173.A N ARG 143.A O no hydrogen 3.297 N/A SER 175.A N ASP 172.A OD1 no hydrogen 2.900 N/A SER 175.A OG GLU 177.A OE2 no hydrogen 3.347 N/A GLU 177.A N ASP 172.A O no hydrogen 3.074 N/A THR 179.A N TYR 170.A O no hydrogen 2.993 N/A THR 179.A OG1 TYR 170.A O no hydrogen 3.283 N/A ARG 180.A N TYR 170.A O no hydrogen 3.443 N/A ILE 182.A N VAL 168.A O no hydrogen 2.733 N/A THR 184.A N GLY 166.A O no hydrogen 2.839 N/A THR 184.A OG1 GLY 166.A O no hydrogen 3.510 N/A ASN 195.A ND2 ASP 157.A OD1 no hydrogen 2.953 N/A ASP 198.A N ASN 195.A O no hydrogen 2.939 N/A GLU 200.A N ASP 198.A OD1 no hydrogen 3.358 N/A THR 202.A N ASP 198.A O no hydrogen 3.002 N/A THR 202.A OG1 GLY 203.A O no hydrogen 2.920 N/A GLY 203.A N PRO 199.A O no hydrogen 3.047 N/A GLY 219.A N GLN 216.A O no hydrogen 2.732 N/A SER 221.A N GLU 338.A OE2 no hydrogen 2.938 N/A SER 221.A OG GLU 338.A OE1 no hydrogen 3.281 N/A SER 221.A OG GLU 338.A OE2 no hydrogen 2.869 N/A THR 223.A N GLU 231.A O no hydrogen 3.069 N/A THR 225.A N HIS 229.A O no hydrogen 2.935 N/A ASN 228.A ND2 PHE 4.A O no hydrogen 3.047 N/A ASN 228.A ND2 VAL 239.A O no hydrogen 2.979 N/A HIS 229.A N THR 225.A O no hydrogen 2.968 N/A ILE 230.A N LEU 237.A O no hydrogen 2.854 N/A GLU 231.A N THR 223.A O no hydrogen 3.082 N/A TRP 232.A N TRP 235.A O no hydrogen 2.978 N/A TRP 232.A NE1 GLU 338.A OE1 no hydrogen 2.736 N/A LYS 234.A NZ ASP 616.A OD1 no hydrogen 3.285 N/A LYS 234.A NZ ASP 616.A OD2 no hydrogen 2.761 N/A TRP 235.A N TRP 232.A O no hydrogen 2.749 N/A TRP 235.A NE1 TYR 383.A O no hydrogen 2.889 N/A SER 236.A N ALA 253.A O no hydrogen 2.765 N/A SER 236.A OG GLU 231.A OE2 no hydrogen 2.878 N/A LEU 237.A N ILE 230.A O no hydrogen 3.186 N/A ASP 238.A N HIS 250.A O no hydrogen 2.821 N/A VAL 239.A N ASN 228.A O no hydrogen 2.991 N/A GLY 240.A N VAL 248.A O no hydrogen 2.764 N/A ASP 242.A N GLY 246.A O no hydrogen 2.861 N/A ARG 244.A N ASP 242.A OD2 no hydrogen 2.726 N/A ARG 244.A NH1 ASP 548.A O no hydrogen 3.012 N/A ARG 244.A NH2 GLY 547.A O no hydrogen 3.014 N/A ARG 244.A NH2 ASP 548.A O no hydrogen 3.484 N/A GLU 245.A N ASP 242.A OD2 no hydrogen 3.224 N/A GLY 246.A N ASP 242.A O no hydrogen 2.697 N/A VAL 248.A N GLY 240.A O no hydrogen 2.963 N/A LEU 249.A N ALA 267.A O no hydrogen 2.793 N/A HIS 250.A N ASP 238.A O no hydrogen 2.867 N/A ASN 251.A N ASN 265.A O no hydrogen 2.749 N/A ASN 251.A ND2 ASP 238.A OD2 no hydrogen 2.663 N/A ILE 252.A N ILE 264.A O no hydrogen 2.695 N/A ALA 253.A N SER 236.A O no hydrogen 2.748 N/A PHE 254.A N ARG 261.A O no hydrogen 2.753 N/A ARG 255.A N LYS 234.A O no hydrogen 2.646 N/A ARG 255.A NH2 GLU 231.A OE1 no hydrogen 3.005 N/A ARG 261.A N PHE 254.A O no hydrogen 2.874 N/A ARG 261.A NE ASP 256.A OD2 no hydrogen 3.223 N/A ARG 261.A NH1 ASP 436.A OD1 no hydrogen 3.251 N/A ARG 261.A NH1 ASP 436.A OD2 no hydrogen 2.778 N/A ARG 261.A NH2 ASP 256.A OD2 no hydrogen 3.191 N/A ARG 261.A NH2 PHE 608.A O no hydrogen 2.653 N/A ILE 263.A N ILE 252.A O no hydrogen 2.834 N/A ILE 264.A N ILE 252.A O no hydrogen 3.152 N/A ASN 265.A N ASP 432.A O no hydrogen 2.781 N/A ARG 266.A N ASP 432.A O no hydrogen 3.342 N/A ARG 266.A NH1 GLU 245.A OE1 no hydrogen 3.017 N/A ARG 266.A NH1 GLU 245.A OE2 no hydrogen 3.284 N/A ARG 266.A NH2 GLU 245.A OE1 no hydrogen 2.737 N/A ALA 267.A N LEU 249.A O no hydrogen 2.808 N/A SER 268.A N ARG 430.A O no hydrogen 3.206 N/A SER 268.A OG GLU 245.A OE2 no hydrogen 2.629 N/A ALA 270.A N SER 428.A O no hydrogen 2.872 N/A MET 272.A N GLU 271.A OE1 no hydrogen 2.807 N/A VAL 273.A N ILE 426.A O no hydrogen 2.851 N/A VAL 274.A N TYR 288.A O no hydrogen 2.819 N/A TYR 276.A N GLN 286.A O no hydrogen 3.220 N/A GLY 277.A N PHE 422.A O no hydrogen 2.531 N/A SER 280.A N ASP 278.A OD1 no hydrogen 3.109 N/A ILE 282.A N SER 280.A OG no hydrogen 3.152 N/A ARG 283.A N SER 280.A O no hydrogen 2.821 N/A ARG 283.A NH2 ASP 165.A OD1 no hydrogen 2.664 N/A ARG 283.A NH2 ASP 165.A OD2 no hydrogen 2.659 N/A SER 284.A N SER 280.A O no hydrogen 2.766 N/A SER 284.A OG SER 280.A O no hydrogen 3.309 N/A TRP 285.A NE1 ILE 282.A O no hydrogen 3.036 N/A GLN 286.A N ARG 283.A O no hydrogen 2.913 N/A GLN 286.A NE2 TYR 288.A OH no hydrogen 3.254 N/A ASN 287.A ND2 TRP 285.A O no hydrogen 3.579 N/A TYR 288.A N VAL 274.A O no hydrogen 3.330 N/A PHE 289.A N GLU 293.A OE1 no hydrogen 3.123 N/A GLY 292.A N GLU 271.A OE1 no hydrogen 2.873 N/A GLU 293.A N PHE 289.A O no hydrogen 2.746 N/A GLN 298.A N LEU 295.A O no hydrogen 3.232 N/A TYR 299.A N VAL 296.A O no hydrogen 3.203 N/A ASN 301.A N PHE 368.A O no hydrogen 2.947 N/A SER 302.A OG ARG 331.A O no hydrogen 2.837 N/A LEU 303.A N ASN 332.A O no hydrogen 2.765 N/A GLU 304.A N ASP 308.A OD2 no hydrogen 2.868 N/A GLY 306.A N CYS 309.A O no hydrogen 2.999 N/A ASP 308.A N GLU 304.A O no hydrogen 2.994 N/A CYS 309.A N GLU 304.A O no hydrogen 3.331 N/A THR 314.A N MET 336.A O no hydrogen 3.002 N/A LEU 316.A N ILE 334.A O no hydrogen 3.267 N/A ILE 320.A N ARG 328.A O no hydrogen 2.723 N/A SER 321.A OG ASP 322.A O no hydrogen 2.929 N/A ASP 322.A N ASN 326.A O no hydrogen 2.958 N/A PHE 324.A N ASP 322.A OD1 no hydrogen 3.160 N/A GLY 325.A N ASP 322.A O no hydrogen 3.443 N/A ASN 326.A N ASP 322.A OD1 no hydrogen 2.702 N/A ARG 328.A N ILE 320.A O no hydrogen 2.725 N/A ILE 330.A N PRO 318.A O no hydrogen 3.039 N/A ASN 332.A N SER 317.A OG no hydrogen 3.028 N/A ILE 334.A N LEU 316.A O no hydrogen 3.136 N/A CYS 335.A N SER 366.A O no hydrogen 2.745 N/A HIS 337.A N VAL 364.A O no hydrogen 3.085 N/A GLU 339.A N ARG 362.A O no hydrogen 2.827 N/A TRP 341.A N ASN 360.A O no hydrogen 2.839 N/A GLY 342.A N ASP 340.A OD2 no hydrogen 3.279 N/A LEU 344.A N ARG 358.A O no hydrogen 2.669 N/A ALA 345.A N ARG 358.A O no hydrogen 3.369 N/A HIS 347.A N TYR 356.A O no hydrogen 2.920 N/A HIS 347.A NE2 ASP 349.A OD1 no hydrogen 2.847 N/A SER 348.A OG ASN 355.A OD1 no hydrogen 3.560 N/A ASP 349.A N ILE 354.A O no hydrogen 3.013 N/A SER 352.A N ASP 349.A OD2 no hydrogen 3.034 N/A SER 352.A OG ASP 349.A OD2 no hydrogen 3.169 N/A GLY 353.A N ASP 349.A O no hydrogen 3.026 N/A ILE 354.A N SER 352.A OG no hydrogen 3.412 N/A TYR 356.A N HIS 347.A O no hydrogen 2.812 N/A ARG 358.A N ALA 345.A O no hydrogen 2.887 N/A ARG 358.A NE THR 357.A O no hydrogen 2.916 N/A ARG 358.A NH1 VAL 617.A O no hydrogen 3.519 N/A ARG 359.A NH1 ASP 340.A OD1 no hydrogen 3.449 N/A ASN 360.A N GLY 342.A O no hydrogen 2.783 N/A ARG 361.A N ASN 360.A OD1 no hydrogen 2.758 N/A ARG 361.A NE GLU 338.A OE1 no hydrogen 3.465 N/A ARG 361.A NH2 GLU 338.A OE1 no hydrogen 3.222 N/A ARG 361.A NH2 GLU 338.A OE2 no hydrogen 3.318 N/A ARG 362.A N GLU 339.A O no hydrogen 2.984 N/A ARG 362.A NE TYR 383.A OH no hydrogen 3.372 N/A ARG 362.A NH1 GLU 339.A OE1 no hydrogen 2.727 N/A ARG 362.A NH2 TYR 383.A OH no hydrogen 3.222 N/A MET 363.A N LEU 382.A O no hydrogen 2.745 N/A VAL 364.A N HIS 337.A O no hydrogen 2.720 N/A ILE 365.A N TRP 380.A O no hydrogen 3.206 N/A SER 366.A N CYS 335.A O no hydrogen 2.888 N/A PHE 367.A N PHE 378.A O no hydrogen 3.252 N/A THR 369.A N TYR 376.A O no hydrogen 2.886 N/A THR 369.A OG1 VAL 296.A O no hydrogen 2.948 N/A THR 370.A N TYR 299.A O no hydrogen 3.294 N/A THR 370.A OG1 ASN 301.A OD1 no hydrogen 2.797 N/A THR 370.A OG1 ASP 375.A OD2 no hydrogen 2.997 N/A ILE 371.A N TYR 374.A O no hydrogen 2.729 N/A ASN 373.A ND2 VAL 397.A O no hydrogen 2.929 N/A TYR 374.A OH HIS 423.A NE2 no hydrogen 2.782 N/A ASP 375.A N THR 395.A O no hydrogen 3.237 N/A TYR 376.A N THR 369.A O no hydrogen 2.780 N/A TYR 376.A OH HIS 425.A ND1 no hydrogen 2.681 N/A GLY 377.A N LYS 393.A O no hydrogen 2.825 N/A PHE 378.A N PHE 367.A O no hydrogen 2.887 N/A TYR 379.A N GLU 391.A O no hydrogen 2.825 N/A TRP 380.A N ILE 365.A O no hydrogen 3.027 N/A TYR 381.A N GLU 389.A O no hydrogen 2.695 N/A TYR 381.A OH GLU 391.A OE1 no hydrogen 2.677 N/A LEU 382.A N MET 363.A O no hydrogen 3.192 N/A TYR 383.A N THR 387.A O no hydrogen 2.969 N/A TYR 383.A OH GLU 389.A OE1 no hydrogen 2.446 N/A LEU 384.A N ARG 361.A O no hydrogen 3.383 N/A GLY 386.A N TYR 383.A O no hydrogen 3.122 N/A THR 387.A OG1 ASP 385.A OD1 no hydrogen 3.375 N/A THR 387.A OG1 ASP 385.A OD2 no hydrogen 2.980 N/A ILE 388.A N LEU 603.A O no hydrogen 2.886 N/A GLU 389.A N TYR 381.A O no hydrogen 2.902 N/A PHE 390.A N PHE 601.A O no hydrogen 3.029 N/A GLU 391.A N TYR 379.A O no hydrogen 2.824 N/A ALA 392.A N VAL 599.A O no hydrogen 2.967 N/A LYS 393.A N GLY 377.A O no hydrogen 3.000 N/A ALA 394.A N ASP 597.A O no hydrogen 2.869 N/A THR 395.A N ASP 375.A O no hydrogen 2.996 N/A VAL 397.A N ASN 373.A O no hydrogen 2.979 N/A THR 400.A OG1 TRP 160.A O no hydrogen 2.461 N/A SER 401.A N GLY 419.A O no hydrogen 3.056 N/A SER 401.A OG ALA 402.A O no hydrogen 3.385 N/A ALA 402.A N ASP 165.A OD2 no hydrogen 2.873 N/A PHE 403.A N GLY 417.A O no hydrogen 2.948 N/A GLY 407.A N PRO 404.A O no hydrogen 3.043 N/A ASN 410.A N SER 408.A OG no hydrogen 3.150 N/A SER 412.A N ALA 420.A O no hydrogen 2.925 N/A SER 412.A OG PRO 586.A O no hydrogen 2.806 N/A GLN 413.A NE2 ALA 415.A O no hydrogen 3.110 N/A LEU 414.A N LEU 418.A O no hydrogen 2.836 N/A LEU 418.A N ALA 415.A O no hydrogen 3.161 N/A GLY 419.A N SER 401.A O no hydrogen 2.872 N/A PHE 422.A N ASN 410.A O no hydrogen 3.077 N/A HIS 423.A N HIS 584.A O no hydrogen 3.141 N/A HIS 423.A ND1 PRO 421.A O no hydrogen 3.022 N/A HIS 423.A NE2 TYR 374.A OH no hydrogen 2.782 N/A GLN 424.A N PRO 275.A O no hydrogen 3.196 N/A HIS 425.A N LEU 582.A O no hydrogen 2.809 N/A HIS 425.A ND1 TYR 376.A OH no hydrogen 2.681 N/A ILE 426.A N VAL 273.A O no hydrogen 2.737 N/A PHE 427.A N PHE 580.A O no hydrogen 2.679 N/A SER 428.A N GLU 271.A O no hydrogen 3.060 N/A ALA 429.A N HIS 578.A O no hydrogen 3.079 N/A ARG 430.A N SER 268.A O no hydrogen 2.780 N/A LEU 431.A N VAL 576.A O no hydrogen 2.680 N/A ASP 432.A N ARG 266.A O no hydrogen 2.806 N/A MET 433.A N ILE 574.A O no hydrogen 3.394 N/A ALA 434.A N ILE 263.A O no hydrogen 2.991 N/A ASP 436.A N PRO 262.A O no hydrogen 2.798 N/A GLY 437.A N ALA 434.A O no hydrogen 3.320 N/A ASN 440.A N GLN 572.A O no hydrogen 2.875 N/A ARG 441.A N SER 490.A O no hydrogen 2.824 N/A ARG 441.A NE ASP 570.A OD1 no hydrogen 3.240 N/A ARG 441.A NH2 ASP 570.A OD1 no hydrogen 3.311 N/A GLU 443.A N ILE 488.A O no hydrogen 2.871 N/A GLU 444.A N THR 467.A O no hydrogen 2.817 N/A GLU 445.A N THR 486.A O no hydrogen 2.787 N/A ASP 446.A N LYS 465.A O no hydrogen 2.945 N/A VAL 447.A N THR 483.A O no hydrogen 2.849 N/A VAL 448.A N SER 463.A O no hydrogen 2.935 N/A GLY 453.A N ASN 456.A O no hydrogen 3.211 N/A ASN 460.A ND2 GLU 457.A O no hydrogen 3.378 N/A SER 463.A N VAL 448.A O no hydrogen 2.751 N/A LYS 465.A N ASP 446.A O no hydrogen 2.690 N/A ARG 466.A NE GLU 445.A OE1 no hydrogen 2.835 N/A ARG 466.A NH2 GLU 445.A OE1 no hydrogen 3.343 N/A THR 467.A N GLU 444.A O no hydrogen 3.129 N/A LEU 469.A N VAL 442.A O no hydrogen 2.853 N/A THR 470.A N GLU 474.A OE2 no hydrogen 2.781 N/A THR 470.A OG1 GLU 474.A OE2 no hydrogen 2.783 N/A ARG 471.A NE ASP 566.A O no hydrogen 3.390 N/A GLU 472.A N ARG 567.A O no hydrogen 2.949 N/A SER 473.A N ASP 566.A OD1 no hydrogen 3.224 N/A SER 473.A OG ASP 566.A OD1 no hydrogen 2.790 N/A GLU 474.A N ARG 471.A O no hydrogen 3.072 N/A ALA 475.A N GLU 472.A O no hydrogen 3.162 N/A ARG 477.A N LEU 533.A O no hydrogen 2.964 N/A ARG 477.A NE GLU 444.A OE2 no hydrogen 2.867 N/A ARG 477.A NH1 GLU 474.A O no hydrogen 2.927 N/A ARG 477.A NH2 GLU 444.A OE1 no hydrogen 2.817 N/A ALA 479.A N ASP 532.A OD1 no hydrogen 2.998 N/A THR 483.A N ASP 480.A O no hydrogen 3.332 N/A THR 483.A OG1 ASP 480.A O no hydrogen 3.471 N/A GLY 484.A N ALA 481.A O no hydrogen 3.138 N/A ARG 485.A N ASP 480.A O no hydrogen 3.096 N/A ARG 485.A NE ASP 446.A OD1 no hydrogen 2.985 N/A ARG 485.A NH1 GLU 478.A O no hydrogen 2.713 N/A ARG 485.A NH2 ASP 446.A OD2 no hydrogen 3.169 N/A THR 486.A N GLU 445.A O no hydrogen 2.963 N/A TRP 487.A NE1 GLU 444.A OE2 no hydrogen 2.814 N/A ILE 488.A N GLU 443.A O no hydrogen 2.885 N/A ILE 489.A N TYR 504.A O no hydrogen 3.051 N/A SER 490.A N ARG 441.A O no hydrogen 2.969 N/A ASN 491.A N VAL 502.A O no hydrogen 3.210 N/A ASN 491.A ND2 ILE 435.A O no hydrogen 2.743 N/A GLU 493.A N ASN 491.A OD1 no hydrogen 3.385 N/A SER 494.A N ASN 491.A O no hydrogen 3.088 N/A SER 494.A OG ASP 436.A OD2 no hydrogen 2.590 N/A ASN 496.A N GLU 500.A O no hydrogen 2.831 N/A ASN 496.A ND2 GLY 607.A O no hydrogen 2.992 N/A ARG 497.A N ASP 610.A OD1 no hydrogen 2.719 N/A ARG 497.A NE ASP 610.A O no hydrogen 3.528 N/A LEU 498.A N ASN 496.A OD1 no hydrogen 3.221 N/A ASN 499.A N ASN 496.A O no hydrogen 2.663 N/A GLU 500.A N ASN 496.A OD1 no hydrogen 2.910 N/A VAL 502.A N SER 494.A O no hydrogen 3.209 N/A TYR 504.A N ILE 489.A O no hydrogen 3.105 N/A TYR 504.A OH GLY 386.A O no hydrogen 2.592 N/A LYS 505.A N ARG 604.A O no hydrogen 2.526 N/A LYS 505.A NZ GLU 445.A OE2 no hydrogen 2.525 N/A LEU 506.A N TRP 487.A O no hydrogen 2.758 N/A HIS 507.A N LYS 602.A O no hydrogen 2.986 N/A LEU 514.A N ALA 529.A O no hydrogen 3.043 N/A GLY 519.A N ASP 517.A OD1 no hydrogen 2.855 N/A SER 520.A N ASP 517.A O no hydrogen 3.123 N/A SER 520.A OG ASP 517.A O no hydrogen 3.053 N/A SER 521.A OG VAL 133.A O no hydrogen 3.000 N/A ALA 523.A N SER 520.A OG no hydrogen 3.116 N/A ARG 524.A N SER 520.A O no hydrogen 3.313 N/A ARG 525.A N SER 521.A O no hydrogen 3.009 N/A ARG 525.A NE HIS 553.A O no hydrogen 2.960 N/A ARG 525.A NH2 GLU 293.A OE2 no hydrogen 3.118 N/A ARG 525.A NH2 VAL 550.A O no hydrogen 3.071 N/A ALA 526.A N ILE 522.A O no hydrogen 2.814 N/A ALA 529.A N ALA 526.A O no hydrogen 2.972 N/A THR 530.A N ALA 527.A O no hydrogen 2.950 N/A THR 530.A OG1 ALA 527.A O no hydrogen 2.641 N/A LEU 533.A N ARG 477.A O no hydrogen 3.128 N/A TRP 534.A N TRP 577.A O no hydrogen 2.919 N/A TRP 534.A NE1 PHE 528.A O no hydrogen 3.089 N/A VAL 535.A N ALA 475.A O no hydrogen 3.318 N/A THR 536.A N VAL 575.A O no hydrogen 2.885 N/A ARG 537.A N GLU 472.A OE2 no hydrogen 2.818 N/A ARG 537.A NH1 ASP 568.A O no hydrogen 3.052 N/A TYR 538.A N ASP 573.A O no hydrogen 2.772 N/A TYR 538.A OH ASP 540.A OD1 no hydrogen 2.904 N/A GLU 542.A N ALA 539.A O no hydrogen 3.342 N/A THR 546.A OG1 GLU 271.A OE2 no hydrogen 2.618 N/A GLY 547.A N TYR 544.A O no hydrogen 3.164 N/A ASN 551.A ND2 LEU 90.A O no hydrogen 2.943 N/A GLN 552.A NE2 ARG 142.A O no hydrogen 3.189 N/A HIS 553.A N VAL 550.A O no hydrogen 3.185 N/A GLY 555.A N HIS 553.A ND1 no hydrogen 2.924 N/A GLY 556.A N ARG 524.A O no hydrogen 3.283 N/A LEU 559.A N PRO 545.A O no hydrogen 3.048 N/A SER 561.A N GLY 558.A O no hydrogen 3.077 N/A SER 561.A OG ALA 557.A O no hydrogen 3.279 N/A SER 561.A OG GLY 558.A O no hydrogen 2.855 N/A TYR 562.A N GLY 558.A O no hydrogen 3.343 N/A TYR 562.A OH TYR 544.A O no hydrogen 3.023 N/A ILE 563.A N LEU 559.A O no hydrogen 2.918 N/A ALA 564.A N SER 561.A O no hydrogen 3.127 N/A GLN 565.A N TYR 562.A O no hydrogen 3.218 N/A GLN 565.A NE2 GLU 542.A OE2 no hydrogen 2.787 N/A GLN 565.A NE2 TYR 562.A O no hydrogen 3.079 N/A ASP 566.A N ILE 563.A O no hydrogen 3.152 N/A ARG 567.A N GLU 472.A OE1 no hydrogen 3.288 N/A ARG 567.A NE GLU 472.A OE1 no hydrogen 2.988 N/A ARG 567.A NE GLU 472.A OE2 no hydrogen 3.120 N/A ARG 567.A NH1 GLU 542.A OE1 no hydrogen 3.397 N/A ARG 567.A NH2 GLU 472.A OE2 no hydrogen 2.748 N/A ARG 567.A NH2 GLU 542.A OE1 no hydrogen 2.804 N/A ARG 567.A NH2 GLU 542.A OE2 no hydrogen 3.014 N/A ILE 569.A N THR 470.A O no hydrogen 2.769 N/A GLN 572.A N ASN 440.A O no hydrogen 2.997 N/A GLN 572.A NE2 ASP 568.A OD2 no hydrogen 2.899 N/A VAL 575.A N THR 536.A O no hydrogen 2.701 N/A VAL 576.A N LEU 431.A O no hydrogen 2.773 N/A TRP 577.A N TRP 534.A O no hydrogen 2.725 N/A TRP 577.A NE1 THR 536.A OG1 no hydrogen 2.715 N/A HIS 578.A N ALA 429.A O no hydrogen 3.050 N/A THR 579.A N ASP 532.A O no hydrogen 2.957 N/A THR 579.A OG1 PHE 528.A O no hydrogen 2.683 N/A THR 579.A OG1 LYS 531.A O no hydrogen 3.020 N/A PHE 580.A N PHE 427.A O no hydrogen 3.000 N/A LEU 582.A N HIS 425.A O no hydrogen 2.930 N/A THR 583.A OG1 GLN 424.A OE1 no hydrogen 3.278 N/A HIS 584.A N HIS 423.A O no hydrogen 2.731 N/A HIS 584.A ND1.B HIS 425.A NE2 no hydrogen 2.960 N/A HIS 584.A NE2.B ASP 597.A OD2 no hydrogen 2.880 N/A ARG 587.A N ASP 590.A OD2 no hydrogen 2.940 N/A ARG 587.A NE ASP 590.A OD1 no hydrogen 3.373 N/A ARG 587.A NE ASP 590.A OD2 no hydrogen 3.351 N/A GLU 589.A N GLU 589.A OE1 no hydrogen 2.829 N/A ASP 590.A N ARG 587.A O no hydrogen 2.835 N/A TRP 591.A N VAL 588.A O no hydrogen 3.075 N/A MET 594.A N GLY 396.A O no hydrogen 2.854 N/A ASP 597.A N ALA 394.A O no hydrogen 3.116 N/A THR 598.A N ASP 597.A OD1 no hydrogen 3.033 N/A VAL 599.A N ALA 392.A O no hydrogen 3.293 N/A PHE 601.A N PHE 390.A O no hydrogen 3.235 N/A LYS 602.A N HIS 507.A O no hydrogen 3.230 N/A LEU 603.A N ILE 388.A O no hydrogen 2.702 N/A ARG 604.A N LYS 505.A O no hydrogen 2.854 N/A GLU 606.A N GLY 503.A O no hydrogen 2.975 N/A VAL 617.A N VAL 614.A O no hydrogen 3.205 N/A