Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8usc_U.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 ILE 1.A O no hydrogen 2.627 N/A THR 2.A OG1 THR 2.A O no hydrogen 2.470 N/A SER 9.A N GLY 6.A O no hydrogen 3.228 N/A LEU 10.A N ILE 7.A O no hydrogen 2.908 N/A LEU 11.A N ILE 8.A O no hydrogen 2.910 N/A ASP 12.A N SER 9.A O no hydrogen 2.906 N/A GLU 13.A N LEU 10.A O no hydrogen 3.352 N/A GLU 15.A N GLU 15.A OE1 no hydrogen 2.808 N/A LYS 19.A NZ LEU 11.A O no hydrogen 3.236 N/A LYS 19.A NZ GLU 13.A O no hydrogen 3.278 N/A GLU 20.A N PRO 16.A O no hydrogen 2.905 N/A PHE 21.A N GLN 17.A O no hydrogen 2.920 N/A ALA 22.A N LEU 18.A O no hydrogen 2.919 N/A LEU 23.A N LYS 19.A O no hydrogen 2.871 N/A HIS 24.A N GLU 20.A O no hydrogen 2.932 N/A LYS 25.A N PHE 21.A O no hydrogen 2.913 N/A LEU 26.A N ALA 22.A O no hydrogen 2.883 N/A ASN 27.A N LEU 23.A O no hydrogen 2.893 N/A ALA 28.A N HIS 24.A O no hydrogen 2.939 N/A VAL 29.A N LYS 25.A O no hydrogen 2.924 N/A VAL 29.A N LEU 26.A O no hydrogen 2.752 N/A GLU 36.A N PHE 33.A O no hydrogen 2.916 N/A GLU 36.A N GLU 36.A OE1 no hydrogen 3.041 N/A SER 38.A N TRP 34.A O no hydrogen 3.063 N/A SER 38.A OG TRP 34.A O no hydrogen 3.261 N/A SER 38.A OG ALA 35.A O no hydrogen 2.218 N/A SER 38.A OG GLU 39.A OE1 no hydrogen 2.823 N/A GLU 39.A N GLU 36.A O no hydrogen 2.903 N/A SER 40.A N ILE 37.A O no hydrogen 3.116 N/A SER 40.A OG ILE 37.A O no hydrogen 2.755 N/A LYS 43.A N SER 40.A O no hydrogen 3.051 N/A ILE 44.A N VAL 41.A O no hydrogen 2.903 N/A GLU 45.A N VAL 41.A O no hydrogen 3.071 N/A VAL 46.A N ASP 42.A O no hydrogen 2.840 N/A TYR 48.A N ILE 44.A O no hydrogen 3.443 N/A TYR 48.A OH GLY 82.A O no hydrogen 3.277 N/A GLU 49.A N GLU 45.A O no hydrogen 2.722 N/A ASP 50.A N VAL 46.A O no hydrogen 2.830 N/A GLY 52.A N ASP 50.A OD1 no hydrogen 2.850 N/A ARG 56.A NE ASP 50.A O no hydrogen 2.534 N/A ALA 59.A N SER 55.A O no hydrogen 3.383 N/A ALA 60.A N ARG 56.A O no hydrogen 2.882 N/A LEU 61.A N GLN 57.A O no hydrogen 2.912 N/A VAL 62.A N PHE 58.A O no hydrogen 2.914 N/A ALA 63.A N ALA 59.A O no hydrogen 2.889 N/A SER 64.A N ALA 60.A O no hydrogen 2.870 N/A SER 64.A OG LEU 61.A O no hydrogen 2.779 N/A SER 64.A OG TYR 95.A OH no hydrogen 2.252 N/A LYS 65.A N LEU 61.A O no hydrogen 2.935 N/A VAL 66.A N VAL 62.A O no hydrogen 2.910 N/A PHE 67.A N ALA 63.A O no hydrogen 2.877 N/A TYR 68.A N SER 64.A O no hydrogen 2.888 N/A TYR 68.A OH GLU 94.A OE1 no hydrogen 2.462 N/A HIS 69.A N LYS 65.A O no hydrogen 2.932 N/A LEU 70.A N VAL 66.A O no hydrogen 2.883 N/A GLY 71.A N PHE 67.A O no hydrogen 2.718 N/A PHE 73.A N GLY 71.A O no hydrogen 2.922 N/A GLU 74.A N GLU 74.A OE1 no hydrogen 2.858 N/A GLU 75.A N ALA 72.A O no hydrogen 3.288 N/A SER 76.A N ALA 72.A O no hydrogen 3.239 N/A SER 76.A OG SER 64.A O no hydrogen 2.541 N/A LEU 77.A N PHE 73.A O no hydrogen 2.909 N/A TYR 79.A N GLU 75.A O no hydrogen 2.944 N/A ALA 80.A N SER 76.A O no hydrogen 2.872 N/A LEU 81.A N LEU 77.A O no hydrogen 2.889 N/A GLY 82.A N ASN 78.A O no hydrogen 2.912 N/A ALA 83.A N TYR 79.A O no hydrogen 3.395 N/A VAL 89.A N ASP 85.A O no hydrogen 3.343 N/A ASP 91.A N ASN 88.A O no hydrogen 3.007 N/A ASN 92.A N ASN 90.A OD1 no hydrogen 3.066 N/A TYR 95.A OH SER 64.A OG no hydrogen 2.252 N/A VAL 96.A N SER 93.A OG no hydrogen 2.995 N/A GLU 97.A N SER 93.A O no hydrogen 3.107 N/A THR 98.A N GLU 94.A O no hydrogen 2.914 N/A THR 98.A OG1 GLU 94.A O no hydrogen 3.294 N/A THR 98.A OG1 GLU 94.A OE2 no hydrogen 2.657 N/A ILE 99.A N TYR 95.A O no hydrogen 2.920 N/A ILE 100.A N VAL 96.A O no hydrogen 2.876 N/A ALA 101.A N GLU 97.A O no hydrogen 2.953 N/A LYS 102.A N THR 98.A O no hydrogen 2.957 N/A LYS 102.A NZ THR 98.A O no hydrogen 2.983 N/A CYS 103.A N ILE 99.A O no hydrogen 2.892 N/A CYS 103.A SG ILE 99.A O no hydrogen 3.151 N/A CYS 103.A SG ILE 100.A O no hydrogen 3.127 N/A ILE 104.A N ILE 100.A O no hydrogen 2.938 N/A ASP 105.A N ALA 101.A O no hydrogen 2.941 N/A HIS 106.A N LYS 102.A O no hydrogen 2.955 N/A TYR 107.A N CYS 103.A O no hydrogen 2.858 N/A THR 108.A N ILE 104.A O no hydrogen 2.869 N/A THR 108.A OG1 GLU 155.A O no hydrogen 3.193 N/A LYS 109.A N ASP 105.A O no hydrogen 2.980 N/A GLN 110.A N HIS 106.A O no hydrogen 2.910 N/A CYS 111.A N TYR 107.A O no hydrogen 2.824 N/A CYS 111.A SG THR 156.A O no hydrogen 3.354 N/A CYS 111.A SG THR 156.A OG1 no hydrogen 2.893 N/A VAL 112.A N THR 108.A O no hydrogen 2.929 N/A GLU 113.A N LYS 109.A O no hydrogen 2.970 N/A ASN 114.A N GLN 110.A O no hydrogen 2.848 N/A ASN 114.A ND2 GLN 110.A OE1 no hydrogen 3.167 N/A ASN 114.A ND2 LYS 123.A O no hydrogen 2.866 N/A ALA 115.A N CYS 111.A O no hydrogen 2.886 N/A ASP 116.A N VAL 112.A O no hydrogen 2.938 N/A LEU 117.A N GLU 113.A O no hydrogen 3.225 N/A GLU 119.A N GLU 119.A OE1 no hydrogen 2.701 N/A LYS 123.A NZ GLU 121.A O no hydrogen 2.378 N/A GLU 130.A N ASP 126.A O no hydrogen 3.200 N/A GLY 131.A N GLN 127.A O no hydrogen 2.877 N/A ILE 132.A N ARG 128.A O no hydrogen 2.915 N/A VAL 133.A N LEU 129.A O no hydrogen 2.933 N/A ASN 134.A N GLU 130.A O no hydrogen 2.913 N/A ASN 134.A ND2 GLU 130.A OE2 no hydrogen 2.715 N/A LYS 135.A N GLY 131.A O no hydrogen 2.886 N/A MET 136.A N ILE 132.A O no hydrogen 2.920 N/A PHE 137.A N VAL 133.A O no hydrogen 2.912 N/A GLN 138.A N ASN 134.A O no hydrogen 2.881 N/A GLN 138.A NE2 GLN 138.A O no hydrogen 2.931 N/A ARG 139.A N LYS 135.A O no hydrogen 2.900 N/A CYS 140.A N MET 136.A O no hydrogen 2.926 N/A CYS 140.A SG MET 136.A O no hydrogen 3.067 N/A CYS 140.A SG PHE 137.A O no hydrogen 3.092 N/A LEU 141.A N PHE 137.A O no hydrogen 2.896 N/A ASP 142.A N GLN 138.A O no hydrogen 2.922 N/A HIS 144.A NE2 GLN 148.A OE1 no hydrogen 2.428 N/A ILE 152.A N GLN 148.A O no hydrogen 2.959 N/A ALA 153.A N ALA 149.A O no hydrogen 2.863 N/A LEU 154.A N ILE 150.A O no hydrogen 2.936 N/A GLU 155.A N GLY 151.A O no hydrogen 2.907 N/A THR 156.A N ILE 152.A O no hydrogen 2.943 N/A THR 156.A OG1 THR 156.A O no hydrogen 2.518 N/A ARG 157.A NE GLU 155.A O no hydrogen 3.390 N/A ARG 157.A NH2 GLU 155.A O no hydrogen 2.853 N/A ARG 158.A NE ASP 160.A OD1 no hydrogen 2.496 N/A ARG 158.A NH1 TYR 107.A OH no hydrogen 3.435 N/A PHE 162.A N ARG 158.A O no hydrogen 3.265 N/A GLU 163.A N LEU 159.A O no hydrogen 2.892 N/A LYS 164.A N ASP 160.A O no hydrogen 2.911 N/A THR 165.A N VAL 161.A O no hydrogen 2.840 N/A THR 165.A OG1 VAL 161.A O no hydrogen 2.885 N/A THR 165.A OG1 PHE 162.A O no hydrogen 2.438 N/A ILE 166.A N PHE 162.A O no hydrogen 3.003 N/A LEU 167.A N GLU 163.A O no hydrogen 2.870 N/A SER 169.A OG TYR 146.A OH no hydrogen 2.779 N/A ASN 170.A ND2 GLU 168.A O no hydrogen 2.429 N/A TYR 178.A N GLY 174.A O no hydrogen 3.093 N/A SER 179.A N MET 175.A O no hydrogen 2.696 N/A LEU 180.A N LEU 176.A O no hydrogen 2.840 N/A LYS 181.A N ALA 177.A O no hydrogen 2.804 N/A LEU 182.A N TYR 178.A O no hydrogen 2.972 N/A CYS 183.A N SER 179.A O no hydrogen 2.750 N/A MET 184.A N LEU 180.A O no hydrogen 2.967 N/A MET 184.A N LYS 181.A O no hydrogen 2.957 N/A SER 185.A N LEU 182.A O no hydrogen 2.960 N/A SER 185.A OG LYS 181.A O no hydrogen 2.278 N/A LEU 186.A N LEU 182.A O no hydrogen 3.024 N/A GLN 191.A N GLN 191.A OE1 no hydrogen 2.460 N/A ARG 193.A N ASN 189.A O no hydrogen 2.711 N/A ARG 193.A NE CYS 183.A O no hydrogen 2.749 N/A ASN 194.A N LYS 190.A O no hydrogen 2.920 N/A VAL 196.A N PHE 192.A O no hydrogen 2.959 N/A LEU 197.A N ARG 193.A O no hydrogen 2.883 N/A ARG 198.A N ASN 194.A O no hydrogen 2.907 N/A VAL 199.A N LYS 195.A O no hydrogen 2.939 N/A LEU 200.A N VAL 196.A O no hydrogen 2.917 N/A VAL 201.A N LEU 197.A O no hydrogen 2.886 N/A LYS 202.A N ARG 198.A O no hydrogen 2.946 N/A ILE 203.A N VAL 199.A O no hydrogen 2.937 N/A TYR 204.A N LEU 200.A O no hydrogen 2.895 N/A MET 205.A N VAL 201.A O no hydrogen 2.880 N/A ASN 206.A N LYS 202.A O no hydrogen 2.975 N/A LEU 207.A N TYR 204.A O no hydrogen 3.295 N/A GLU 208.A N GLU 208.A OE1 no hydrogen 2.682 N/A ASN 214.A ND2 TYR 204.A OH no hydrogen 2.628 N/A VAL 215.A N ASP 211.A O no hydrogen 3.030 N/A CYS 216.A N PHE 212.A O no hydrogen 2.914 N/A CYS 216.A SG ILE 213.A O no hydrogen 3.092 N/A GLN 217.A N ILE 213.A O no hydrogen 2.930 N/A CYS 218.A N ASN 214.A O no hydrogen 2.907 N/A CYS 218.A SG ASN 214.A O no hydrogen 3.155 N/A LEU 219.A N VAL 215.A O no hydrogen 2.868 N/A ILE 220.A N CYS 216.A O no hydrogen 2.949 N/A LEU 222.A N CYS 218.A O no hydrogen 2.917 N/A ASP 223.A N LEU 219.A O no hydrogen 2.907 N/A GLN 226.A N GLN 226.A OE1 no hydrogen 2.602 N/A VAL 228.A N ASP 224.A O no hydrogen 3.258 N/A SER 229.A N PRO 225.A O no hydrogen 2.909 N/A SER 229.A OG PRO 225.A O no hydrogen 3.442 N/A SER 229.A OG GLN 226.A O no hydrogen 2.483 N/A ASP 230.A N GLN 226.A O no hydrogen 2.919 N/A ILE 231.A N ALA 227.A O no hydrogen 2.909 N/A LEU 232.A N VAL 228.A O no hydrogen 2.895 N/A GLU 233.A N SER 229.A O no hydrogen 2.910 N/A LYS 234.A N ASP 230.A O no hydrogen 2.892 N/A LYS 234.A NZ ASP 230.A O no hydrogen 2.714 N/A LYS 234.A NZ ASP 230.A OD1 no hydrogen 2.954 N/A LEU 235.A N ILE 231.A O no hydrogen 2.899 N/A VAL 236.A N LEU 232.A O no hydrogen 2.903 N/A LYS 237.A N GLU 233.A O no hydrogen 2.903 N/A GLU 238.A N LEU 235.A O no hydrogen 3.204 N/A ASP 239.A N VAL 236.A O no hydrogen 3.041 N/A ASN 240.A N LEU 235.A O no hydrogen 3.170 N/A LEU 242.A N ASN 240.A O no hydrogen 2.419 N/A ALA 244.A N ASN 240.A OD1 no hydrogen 3.150 N/A TYR 245.A N LEU 241.A O no hydrogen 2.561 N/A TYR 245.A OH GLN 271.A OE1 no hydrogen 2.327 N/A GLN 246.A N LEU 242.A O no hydrogen 2.958 N/A GLN 246.A NE2 ILE 825.A O no hydrogen 3.021 N/A ILE 247.A N MET 243.A O no hydrogen 2.862 N/A CYS 248.A N ALA 244.A O no hydrogen 2.923 N/A PHE 249.A N TYR 245.A O no hydrogen 2.989 N/A ASP 250.A N GLN 246.A O no hydrogen 2.934 N/A LEU 251.A N ILE 247.A O no hydrogen 2.851 N/A TYR 252.A N CYS 248.A O no hydrogen 2.947 N/A GLU 253.A N PHE 249.A O no hydrogen 2.913 N/A SER 254.A N ASP 250.A O no hydrogen 2.916 N/A SER 254.A N LEU 251.A O no hydrogen 3.334 N/A SER 254.A OG SER 694.A OG no hydrogen 3.249 N/A ALA 255.A N LEU 251.A O no hydrogen 2.645 N/A GLN 258.A N GLN 258.A OE1 no hydrogen 2.561 N/A PHE 259.A N SER 256.A OG no hydrogen 3.380 N/A LEU 260.A N SER 256.A O no hydrogen 3.198 N/A SER 261.A N GLN 257.A O no hydrogen 2.908 N/A SER 261.A OG GLN 258.A O no hydrogen 2.874 N/A SER 262.A N GLN 258.A O no hydrogen 2.910 N/A SER 262.A OG GLN 258.A O no hydrogen 2.719 N/A SER 262.A OG PHE 259.A O no hydrogen 2.650 N/A VAL 263.A N PHE 259.A O no hydrogen 2.900 N/A ILE 264.A N LEU 260.A O no hydrogen 2.912 N/A GLN 265.A N SER 261.A O no hydrogen 2.917 N/A GLN 265.A NE2 ASN 266.A OD1 no hydrogen 2.755 N/A ASN 266.A N SER 262.A O no hydrogen 2.904 N/A LEU 267.A N VAL 263.A O no hydrogen 2.899 N/A ARG 268.A N ILE 264.A O no hydrogen 2.907 N/A THR 269.A N ASN 266.A O no hydrogen 3.170 N/A THR 269.A OG1 ASN 266.A O no hydrogen 2.255 N/A LYS 274.A NZ LYS 274.A O no hydrogen 3.016 N/A MET 275.A N GLN 271.A O no hydrogen 2.903 N/A ILE 276.A N THR 272.A O no hydrogen 2.887 N/A LYS 277.A N LEU 273.A O no hydrogen 2.864 N/A ILE 278.A N LYS 274.A O no hydrogen 2.973 N/A LEU 279.A N MET 275.A O no hydrogen 2.887 N/A SER 280.A N ILE 276.A O no hydrogen 2.876 N/A SER 280.A OG ILE 276.A O no hydrogen 2.821 N/A SER 280.A OG LYS 277.A O no hydrogen 2.695 N/A ILE 285.A N GLY 281.A O no hydrogen 2.845 N/A GLU 286.A N GLU 282.A O no hydrogen 2.917 N/A LEU 287.A N MET 283.A O no hydrogen 2.870 N/A HIS 288.A N ALA 284.A O no hydrogen 2.929 N/A LEU 289.A N ILE 285.A O no hydrogen 2.890 N/A GLN 290.A N GLU 286.A O no hydrogen 2.869 N/A PHE 291.A N LEU 287.A O no hydrogen 2.916 N/A LEU 292.A N HIS 288.A O no hydrogen 2.932 N/A ILE 293.A N LEU 289.A O no hydrogen 2.876 N/A ARG 294.A N GLN 290.A O no hydrogen 2.912 N/A ASN 295.A N PHE 291.A O no hydrogen 3.021 N/A ASN 296.A N ILE 293.A O no hydrogen 3.347 N/A THR 298.A OG1 HIS 327.A NE2 no hydrogen 3.274 N/A LYS 304.A N LEU 300.A O no hydrogen 2.879 N/A ASN 305.A N MET 301.A O no hydrogen 2.917 N/A THR 306.A N ILE 302.A O no hydrogen 2.917 N/A THR 306.A OG1 ILE 302.A O no hydrogen 3.194 N/A LYS 307.A N LEU 303.A O no hydrogen 2.879 N/A ASP 308.A N LYS 304.A O no hydrogen 3.260 N/A ALA 309.A N THR 306.A O no hydrogen 2.842 N/A VAL 310.A N THR 306.A O no hydrogen 3.255 N/A ARG 311.A NH2 ASP 308.A O no hydrogen 3.542 N/A CYS 315.A N SER 313.A OG no hydrogen 3.174 N/A CYS 315.A SG SER 313.A OG no hydrogen 2.598 N/A THR 317.A N VAL 314.A O no hydrogen 2.941 N/A THR 317.A OG1 VAL 314.A O no hydrogen 2.448 N/A THR 319.A N CYS 315.A O no hydrogen 2.993 N/A THR 319.A OG1 HIS 316.A O no hydrogen 2.225 N/A VAL 320.A N HIS 316.A O no hydrogen 2.729 N/A ILE 321.A N THR 317.A O no hydrogen 3.062 N/A ALA 322.A N ALA 318.A O no hydrogen 2.691 N/A ASN 323.A N THR 319.A O no hydrogen 3.208 N/A ASN 323.A ND2 THR 319.A O no hydrogen 2.388 N/A ASN 323.A ND2 VAL 320.A O no hydrogen 2.809 N/A SER 324.A OG ILE 321.A O no hydrogen 2.485 N/A PHE 325.A N ILE 321.A O no hydrogen 2.821 N/A MET 326.A N ALA 322.A O no hydrogen 2.971 N/A HIS 327.A N SER 324.A O no hydrogen 2.928 N/A CYS 328.A N PHE 325.A O no hydrogen 3.414 N/A THR 330.A N HIS 327.A O no hydrogen 3.245 N/A THR 330.A OG1 HIS 327.A O no hydrogen 3.182 N/A THR 330.A OG1 SER 332.A OG no hydrogen 2.314 N/A THR 331.A N ILE 361.A O no hydrogen 2.978 N/A THR 331.A OG1 THR 330.A O no hydrogen 2.686 N/A SER 332.A N THR 330.A OG1 no hydrogen 3.340 N/A SER 332.A OG THR 330.A OG1 no hydrogen 2.314 N/A ARG 337.A N ASP 333.A O no hydrogen 2.800 N/A ASP 338.A N GLN 334.A O no hydrogen 2.884 N/A ASN 339.A N PHE 335.A O no hydrogen 2.837 N/A ALA 344.A N LEU 340.A O no hydrogen 2.931 N/A ARG 345.A N TRP 342.A O no hydrogen 2.959 N/A ASN 348.A N THR 347.A OG1 no hydrogen 2.592 N/A ALA 350.A N THR 347.A O no hydrogen 3.065 N/A LYS 351.A N ASN 348.A O no hydrogen 3.175 N/A LYS 351.A NZ SER 379.A OG no hydrogen 2.325 N/A THR 353.A N TRP 349.A O no hydrogen 2.918 N/A THR 353.A OG1 TRP 349.A O no hydrogen 2.795 N/A ALA 354.A N ALA 350.A O no hydrogen 2.848 N/A THR 355.A N LYS 351.A O no hydrogen 2.935 N/A THR 355.A OG1 LYS 351.A O no hydrogen 3.229 N/A THR 355.A OG1 PHE 352.A O no hydrogen 2.726 N/A ALA 356.A N PHE 352.A O no hydrogen 2.931 N/A SER 357.A N THR 353.A O no hydrogen 2.863 N/A SER 357.A OG VAL 320.A O no hydrogen 2.741 N/A LEU 358.A N ALA 354.A O no hydrogen 2.905 N/A GLY 359.A N THR 355.A O no hydrogen 2.944 N/A VAL 360.A N ALA 356.A O no hydrogen 2.869 N/A ILE 361.A N SER 357.A O no hydrogen 2.912 N/A HIS 362.A N LEU 358.A O no hydrogen 3.366 N/A LYS 363.A NZ SER 724.A O no hydrogen 3.127 N/A GLY 364.A N ILE 393.A O no hydrogen 3.251 N/A ALA 369.A N GLU 366.A O no hydrogen 3.118 N/A LEU 372.A N GLU 368.A O no hydrogen 2.893 N/A MET 373.A N ALA 369.A O no hydrogen 2.879 N/A THR 375.A N GLN 371.A O no hydrogen 2.936 N/A THR 375.A N LEU 372.A O no hydrogen 3.158 N/A THR 375.A OG1 GLN 371.A O no hydrogen 3.509 N/A THR 375.A OG1 LEU 372.A O no hydrogen 2.277 N/A TYR 376.A OH HIS 362.A NE2 no hydrogen 2.807 N/A LEU 377.A N MET 373.A O no hydrogen 3.282 N/A GLU 383.A N SER 379.A O no hydrogen 3.253 N/A GLY 384.A N ALA 380.A O no hydrogen 2.938 N/A GLY 385.A N TYR 381.A O no hydrogen 2.888 N/A GLY 386.A N GLN 382.A O no hydrogen 2.874 N/A LEU 387.A N GLU 383.A O no hydrogen 2.939 N/A TYR 388.A N GLY 384.A O no hydrogen 2.944 N/A TYR 388.A OH PRO 718.A O no hydrogen 2.895 N/A ALA 389.A N GLY 385.A O no hydrogen 2.826 N/A LEU 390.A N GLY 386.A O no hydrogen 2.884 N/A GLY 391.A N LEU 387.A O no hydrogen 2.954 N/A LEU 392.A N TYR 388.A O no hydrogen 2.885 N/A ILE 393.A N ALA 389.A O no hydrogen 2.904 N/A HIS 394.A N LEU 390.A O no hydrogen 3.293 N/A HIS 394.A ND1 LEU 390.A O no hydrogen 3.011 N/A HIS 397.A N HIS 394.A O no hydrogen 3.157 N/A ILE 401.A N GLY 398.A O no hydrogen 3.158 N/A TYR 404.A N ASP 400.A O no hydrogen 3.294 N/A LEU 405.A N ILE 401.A O no hydrogen 2.979 N/A LEU 406.A N ILE 402.A O no hydrogen 2.628 N/A ASN 407.A N ASP 403.A O no hydrogen 2.945 N/A GLN 408.A N TYR 404.A O no hydrogen 2.537 N/A LEU 409.A N LEU 406.A O no hydrogen 2.973 N/A LYS 410.A N LEU 406.A O no hydrogen 3.365 N/A ASN 411.A N ASN 407.A O no hydrogen 3.266 N/A HIS 419.A N ASP 415.A O no hydrogen 2.999 N/A HIS 419.A ND1 VAL 451.A O no hydrogen 2.864 N/A GLY 420.A N ILE 416.A O no hydrogen 2.904 N/A GLY 421.A N VAL 417.A O no hydrogen 2.900 N/A SER 422.A N ARG 418.A O no hydrogen 2.865 N/A SER 422.A OG HIS 419.A O no hydrogen 3.094 N/A LEU 423.A N HIS 419.A O no hydrogen 2.953 N/A GLY 424.A N GLY 420.A O no hydrogen 2.911 N/A LEU 425.A N GLY 421.A O no hydrogen 2.882 N/A GLY 426.A N SER 422.A O no hydrogen 2.884 N/A LEU 427.A N LEU 423.A O no hydrogen 2.927 N/A ALA 428.A N GLY 424.A O no hydrogen 2.899 N/A ALA 429.A N LEU 425.A O no hydrogen 2.960 N/A GLY 431.A N LEU 462.A O no hydrogen 2.863 N/A THR 432.A OG1 ALA 429.A O no hydrogen 3.498 N/A TYR 438.A N ARG 434.A O no hydrogen 3.183 N/A TYR 438.A OH ASP 475.A OD2 no hydrogen 2.999 N/A ASP 439.A N GLN 435.A O no hydrogen 2.882 N/A LEU 440.A N ASP 436.A O no hydrogen 2.947 N/A LEU 441.A N VAL 437.A O no hydrogen 2.919 N/A LYS 442.A N TYR 438.A O no hydrogen 2.842 N/A LYS 442.A NZ ASP 475.A OD2 no hydrogen 3.085 N/A THR 443.A N ASP 439.A O no hydrogen 2.935 N/A THR 443.A OG1 ASP 439.A O no hydrogen 3.550 N/A THR 443.A OG1 LEU 440.A O no hydrogen 2.362 N/A ASN 444.A N LEU 440.A O no hydrogen 2.943 N/A LEU 445.A N LEU 441.A O no hydrogen 2.871 N/A TYR 446.A N LYS 442.A O no hydrogen 2.888 N/A GLN 447.A N THR 443.A O no hydrogen 2.924 N/A GLN 447.A N ASN 444.A O no hydrogen 3.159 N/A ASP 448.A N LEU 445.A O no hydrogen 3.268 N/A THR 452.A N ASP 449.A O no hydrogen 3.201 N/A GLU 454.A N ALA 450.A O no hydrogen 2.716 N/A ALA 455.A N VAL 451.A O no hydrogen 2.953 N/A ALA 456.A N THR 452.A O no hydrogen 2.873 N/A GLY 457.A N GLY 453.A O no hydrogen 2.910 N/A ALA 459.A N ALA 455.A O no hydrogen 2.929 N/A LEU 460.A N ALA 456.A O no hydrogen 2.849 N/A GLY 461.A N GLY 457.A O no hydrogen 2.944 N/A LEU 462.A N LEU 458.A O no hydrogen 2.878 N/A VAL 463.A N ALA 459.A O no hydrogen 2.912 N/A MET 464.A N LEU 460.A O no hydrogen 3.115 N/A LEU 465.A N LEU 462.A O no hydrogen 3.274 N/A GLY 466.A N LEU 498.A O no hydrogen 2.825 N/A SER 467.A N MET 464.A O no hydrogen 3.025 N/A SER 467.A OG MET 464.A O no hydrogen 2.929 N/A LYS 468.A N VAL 499.A O no hydrogen 3.245 N/A LYS 468.A NZ GLU 506.A O no hydrogen 2.885 N/A ASN 469.A N SER 467.A OG no hydrogen 3.373 N/A GLN 471.A N ASN 469.A OD1 no hydrogen 3.153 N/A ILE 473.A N ASN 469.A O no hydrogen 3.016 N/A GLU 474.A N ALA 470.A O no hydrogen 2.912 N/A ASP 475.A N GLN 471.A O no hydrogen 2.914 N/A MET 476.A N ALA 472.A O no hydrogen 2.918 N/A VAL 477.A N ILE 473.A O no hydrogen 2.927 N/A GLY 478.A N GLU 474.A O no hydrogen 2.891 N/A TYR 479.A N ASP 475.A O no hydrogen 2.955 N/A TYR 479.A OH ASP 448.A OD2 no hydrogen 3.169 N/A ALA 480.A N MET 476.A O no hydrogen 2.859 N/A GLN 481.A N VAL 477.A O no hydrogen 3.010 N/A GLU 482.A N TYR 479.A O no hydrogen 3.204 N/A THR 483.A OG1 ASP 448.A OD2 no hydrogen 2.627 N/A THR 483.A OG1 GLN 484.A O no hydrogen 3.138 N/A ILE 488.A N HIS 485.A O no hydrogen 2.469 N/A ARG 490.A N GLU 486.A O no hydrogen 2.863 N/A GLY 491.A N LYS 487.A O no hydrogen 2.948 N/A LEU 492.A N ILE 488.A O no hydrogen 2.895 N/A ALA 493.A N LEU 489.A O no hydrogen 2.867 N/A GLY 495.A N GLY 491.A O no hydrogen 2.966 N/A ILE 496.A N LEU 492.A O no hydrogen 2.888 N/A ALA 497.A N ALA 493.A O no hydrogen 2.926 N/A LEU 498.A N VAL 494.A O no hydrogen 2.912 N/A MET 500.A N ALA 497.A O no hydrogen 3.470 N/A TYR 501.A N LEU 498.A O no hydrogen 3.280 N/A TYR 501.A OH THR 699.A OG1 no hydrogen 3.183 N/A GLY 502.A N MET 532.A O no hydrogen 2.381 N/A ARG 503.A NH1 GLY 466.A O no hydrogen 2.364 N/A MET 504.A N ALA 533.A O no hydrogen 2.846 N/A GLU 506.A N ARG 503.A O no hydrogen 3.014 N/A GLU 512.A N ASP 508.A O no hydrogen 3.063 N/A SER 513.A N ALA 509.A O no hydrogen 2.902 N/A LEU 514.A N LEU 510.A O no hydrogen 2.873 N/A CYS 515.A N ILE 511.A O no hydrogen 2.910 N/A ARG 516.A N GLU 512.A O no hydrogen 2.899 N/A ASP 517.A N LEU 514.A O no hydrogen 3.409 N/A LEU 522.A N ASP 519.A OD2 no hydrogen 2.688 N/A ARG 523.A N ASP 519.A O no hydrogen 3.172 N/A ARG 523.A NE ASP 517.A O no hydrogen 3.370 N/A ARG 523.A NH1 ASP 553.A OD2 no hydrogen 3.079 N/A ARG 523.A NH2 LYS 518.A O no hydrogen 2.983 N/A ARG 524.A N PRO 520.A O no hydrogen 2.938 N/A SER 525.A N ILE 521.A O no hydrogen 2.850 N/A SER 525.A OG ALA 493.A O no hydrogen 2.784 N/A GLY 526.A N LEU 522.A O no hydrogen 2.856 N/A MET 527.A N ARG 523.A O no hydrogen 2.992 N/A TYR 528.A N ARG 524.A O no hydrogen 2.955 N/A THR 529.A N SER 525.A O no hydrogen 2.793 N/A THR 529.A OG1 SER 525.A O no hydrogen 2.225 N/A VAL 530.A N GLY 526.A O no hydrogen 2.905 N/A ALA 531.A N MET 527.A O no hydrogen 2.960 N/A MET 532.A N TYR 528.A O no hydrogen 2.916 N/A ALA 533.A N THR 529.A O no hydrogen 2.838 N/A TYR 534.A N VAL 530.A O no hydrogen 2.964 N/A TYR 534.A OH ASP 508.A OD1 no hydrogen 3.336 N/A CYS 535.A SG ALA 531.A O no hydrogen 3.094 N/A CYS 535.A SG MET 532.A O no hydrogen 3.268 N/A GLY 536.A N PHE 568.A O no hydrogen 3.453 N/A SER 537.A N CYS 535.A O no hydrogen 3.019 N/A ASN 539.A N SER 537.A O no hydrogen 2.632 N/A LYS 541.A N ASN 539.A OD1 no hydrogen 3.189 N/A LYS 541.A NZ LYS 541.A O no hydrogen 3.476 N/A ILE 543.A N ASN 539.A O no hydrogen 3.179 N/A ARG 544.A N ASN 540.A O no hydrogen 2.887 N/A ARG 545.A N LYS 541.A O no hydrogen 2.932 N/A ARG 545.A NH1 ILE 511.A O no hydrogen 3.470 N/A LEU 546.A N ALA 542.A O no hydrogen 2.937 N/A LEU 547.A N ILE 543.A O no hydrogen 2.907 N/A HIS 548.A N ARG 544.A O no hydrogen 2.899 N/A VAL 549.A N ARG 545.A O no hydrogen 2.954 N/A ALA 550.A N LEU 546.A O no hydrogen 2.879 N/A VAL 551.A N LEU 547.A O no hydrogen 2.933 N/A SER 552.A N HIS 548.A O no hydrogen 2.893 N/A SER 552.A N VAL 549.A O no hydrogen 3.239 N/A SER 552.A OG HIS 548.A O no hydrogen 3.259 N/A ASP 553.A N VAL 549.A O no hydrogen 2.794 N/A VAL 554.A N ASP 553.A OD1 no hydrogen 2.677 N/A ARG 559.A N ASN 555.A O no hydrogen 3.385 N/A ARG 559.A NH1 ASP 553.A O no hydrogen 2.344 N/A ARG 560.A N ASP 556.A O no hydrogen 2.898 N/A ALA 561.A N ASP 557.A O no hydrogen 2.946 N/A ALA 562.A N VAL 558.A O no hydrogen 2.866 N/A VAL 563.A N ARG 559.A O no hydrogen 2.956 N/A GLU 564.A N ARG 560.A O no hydrogen 2.886 N/A SER 565.A N ALA 561.A O no hydrogen 2.915 N/A SER 565.A OG MET 527.A O no hydrogen 3.157 N/A SER 565.A OG ALA 561.A O no hydrogen 2.949 N/A LEU 566.A N VAL 563.A O no hydrogen 2.939 N/A GLY 567.A N GLU 564.A O no hydrogen 3.236 N/A ILE 569.A N SER 565.A O no hydrogen 2.911 N/A LEU 570.A N GLY 567.A O no hydrogen 3.260 N/A ARG 572.A NH1 GLY 697.A O no hydrogen 2.859 N/A THR 573.A N LEU 570.A O no hydrogen 3.170 N/A GLN 576.A N THR 573.A O no hydrogen 3.278 N/A CYS 577.A N PRO 574.A O no hydrogen 3.369 N/A CYS 577.A SG ALA 599.A O no hydrogen 3.882 N/A SER 579.A OG GLN 576.A O no hydrogen 2.319 N/A VAL 580.A N GLN 576.A O no hydrogen 3.389 N/A VAL 581.A N CYS 577.A O no hydrogen 3.202 N/A SER 582.A OG PRO 578.A O no hydrogen 2.152 N/A SER 582.A OG SER 579.A O no hydrogen 2.771 N/A SER 585.A OG SER 582.A O no hydrogen 3.414 N/A GLU 586.A N LEU 583.A O no hydrogen 3.042 N/A SER 587.A OG ASN 589.A O no hydrogen 2.718 N/A SER 587.A OG ASN 589.A OD1 no hydrogen 3.183 N/A ARG 593.A NE ASN 589.A O no hydrogen 3.589 N/A TYR 594.A N PRO 590.A O no hydrogen 2.905 N/A GLY 595.A N HIS 591.A O no hydrogen 2.924 N/A ALA 596.A N VAL 592.A O no hydrogen 2.846 N/A ALA 597.A N ARG 593.A O no hydrogen 2.923 N/A MET 598.A N TYR 594.A O no hydrogen 2.925 N/A ALA 599.A N GLY 595.A O no hydrogen 2.880 N/A LEU 600.A N ALA 596.A O no hydrogen 2.910 N/A GLY 601.A N ALA 597.A O no hydrogen 2.917 N/A ILE 602.A N MET 598.A O no hydrogen 2.899 N/A CYS 603.A N ALA 599.A O no hydrogen 2.911 N/A CYS 603.A SG ALA 599.A O no hydrogen 3.065 N/A CYS 603.A SG LEU 600.A O no hydrogen 3.222 N/A CYS 604.A SG LEU 600.A O no hydrogen 3.078 N/A ASN 609.A N THR 607.A O no hydrogen 2.744 N/A LYS 610.A NZ THR 646.A O no hydrogen 3.505 N/A LEU 615.A N GLU 611.A O no hydrogen 2.902 N/A LEU 616.A N ALA 612.A O no hydrogen 2.902 N/A GLU 617.A N ASN 614.A O no hydrogen 3.363 N/A THR 620.A N LEU 616.A O no hydrogen 3.336 N/A ASN 621.A N PRO 618.A O no hydrogen 2.958 N/A ASP 622.A N MET 619.A O no hydrogen 2.870 N/A TYR 626.A N ASN 625.A OD1 no hydrogen 2.569 N/A ARG 628.A NH1 ASP 622.A O no hydrogen 2.664 N/A ARG 628.A NH1 PRO 623.A O no hydrogen 3.002 N/A GLN 629.A N ASN 625.A O no hydrogen 2.946 N/A GLY 630.A N TYR 626.A O no hydrogen 2.905 N/A ALA 631.A N VAL 627.A O no hydrogen 2.871 N/A LEU 632.A N ARG 628.A O no hydrogen 2.913 N/A ILE 633.A N GLN 629.A O no hydrogen 2.964 N/A ALA 634.A N GLY 630.A O no hydrogen 2.890 N/A SER 635.A N ALA 631.A O no hydrogen 2.869 N/A SER 635.A OG LEU 632.A O no hydrogen 2.973 N/A SER 635.A OG TYR 657.A OH no hydrogen 2.323 N/A ALA 636.A N LEU 632.A O no hydrogen 2.938 N/A LEU 637.A N ILE 633.A O no hydrogen 2.911 N/A ILE 638.A N ALA 634.A O no hydrogen 2.924 N/A MET 639.A N ALA 636.A O no hydrogen 3.118 N/A THR 643.A N THR 646.A OG1 no hydrogen 2.543 N/A THR 646.A OG1 THR 643.A O no hydrogen 2.374 N/A CYS 647.A N THR 643.A O no hydrogen 2.788 N/A CYS 647.A SG GLN 642.A OE1 no hydrogen 3.155 N/A CYS 647.A SG THR 643.A O no hydrogen 3.726 N/A CYS 647.A SG THR 646.A OG1 no hydrogen 3.304 N/A LYS 649.A NZ GLN 652.A OE1 no hydrogen 2.727 N/A ASN 651.A N GLU 644.A OE2 no hydrogen 3.065 N/A PHE 653.A N LYS 649.A O no hydrogen 2.892 N/A ARG 654.A N VAL 650.A O no hydrogen 2.893 N/A ARG 654.A NH1 ASP 682.A OD2 no hydrogen 2.811 N/A ARG 654.A NH2 ASP 682.A OD1 no hydrogen 2.338 N/A ARG 654.A NH2 ASP 682.A OD2 no hydrogen 3.218 N/A GLN 655.A N ASN 651.A O no hydrogen 2.948 N/A LEU 656.A N GLN 652.A O no hydrogen 2.893 N/A TYR 657.A N PHE 653.A O no hydrogen 2.860 N/A TYR 657.A OH SER 635.A OG no hydrogen 2.323 N/A SER 658.A N ARG 654.A O no hydrogen 2.982 N/A SER 658.A OG ARG 654.A O no hydrogen 3.337 N/A SER 658.A OG GLN 655.A O no hydrogen 2.539 N/A LYS 659.A N GLN 655.A O no hydrogen 2.878 N/A VAL 660.A N LEU 656.A O no hydrogen 2.950 N/A ILE 661.A N TYR 657.A O no hydrogen 2.930 N/A ASN 662.A N SER 658.A O no hydrogen 2.925 N/A ASP 663.A N VAL 660.A O no hydrogen 3.234 N/A LYS 664.A N ASP 663.A OD1 no hydrogen 2.868 N/A LYS 671.A N ASP 667.A O no hydrogen 3.170 N/A LYS 671.A NZ ASP 663.A O no hydrogen 3.194 N/A PHE 672.A N VAL 668.A O no hydrogen 2.890 N/A GLY 673.A N MET 669.A O no hydrogen 2.899 N/A ALA 674.A N ALA 670.A O no hydrogen 2.911 N/A ILE 675.A N LYS 671.A O no hydrogen 2.896 N/A LEU 676.A N PHE 672.A O no hydrogen 2.936 N/A ALA 677.A N GLY 673.A O no hydrogen 2.855 N/A GLN 678.A N ALA 674.A O no hydrogen 2.915 N/A GLY 679.A N ILE 675.A O no hydrogen 2.909 N/A ILE 680.A N LEU 676.A O no hydrogen 2.891 N/A LEU 681.A N ALA 677.A O no hydrogen 2.913 N/A ALA 683.A N ILE 680.A O no hydrogen 3.199 N/A GLY 684.A N PHE 325.A O no hydrogen 2.362 N/A GLY 685.A N ASP 682.A O no hydrogen 3.276 N/A ASN 687.A ND2 ASN 295.A O no hydrogen 2.345 N/A ASN 687.A ND2 GLY 684.A O no hydrogen 3.676 N/A THR 689.A N THR 728.A O no hydrogen 2.628 N/A SER 691.A OG GLN 693.A O no hydrogen 3.087 N/A SER 694.A N HIS 698.A O no hydrogen 2.394 N/A SER 694.A OG SER 254.A OG no hydrogen 3.249 N/A THR 696.A N SER 694.A OG no hydrogen 3.189 N/A THR 696.A OG1 THR 696.A O no hydrogen 2.431 N/A GLY 697.A N SER 694.A O no hydrogen 3.340 N/A HIS 698.A N SER 694.A OG no hydrogen 3.128 N/A THR 699.A OG1 TYR 501.A OH no hydrogen 3.183 N/A HIS 700.A N LEU 692.A O no hydrogen 2.490 N/A SER 703.A OG HIS 700.A O no hydrogen 2.407 N/A VAL 704.A N HIS 700.A O no hydrogen 3.212 N/A VAL 705.A N MET 701.A O no hydrogen 2.969 N/A GLY 706.A N PRO 702.A O no hydrogen 2.872 N/A VAL 707.A N SER 703.A O no hydrogen 2.913 N/A LEU 708.A N VAL 704.A O no hydrogen 2.935 N/A VAL 709.A N VAL 705.A O no hydrogen 2.992 N/A PHE 710.A N GLY 706.A O no hydrogen 2.858 N/A THR 711.A N VAL 707.A O no hydrogen 2.899 N/A THR 711.A OG1 VAL 707.A O no hydrogen 2.950 N/A THR 711.A OG1 LEU 708.A O no hydrogen 2.490 N/A GLN 712.A N LEU 708.A O no hydrogen 2.919 N/A TRP 716.A N PHE 713.A O no hydrogen 3.292 N/A TRP 716.A NE1 HIS 419.A NE2 no hydrogen 3.259 N/A LEU 719.A N TRP 716.A O no hydrogen 3.436 N/A SER 720.A N PHE 717.A O no hydrogen 2.905 N/A SER 720.A OG PHE 717.A O no hydrogen 2.350 N/A PHE 722.A N LEU 719.A O no hydrogen 2.912 N/A LEU 723.A N SER 720.A O no hydrogen 2.936 N/A SER 724.A N HIS 721.A O no hydrogen 2.920 N/A SER 724.A OG HIS 721.A O no hydrogen 3.354 N/A LEU 725.A N PHE 722.A O no hydrogen 2.941 N/A ALA 726.A N LEU 723.A O no hydrogen 2.904 N/A TYR 727.A N SER 724.A O no hydrogen 3.240 N/A THR 728.A N THR 689.A O no hydrogen 2.373 N/A THR 728.A OG1 THR 689.A O no hydrogen 2.708 N/A THR 730.A N ASN 687.A O no hydrogen 2.950 N/A THR 730.A OG1 ASN 687.A O no hydrogen 3.569 N/A THR 730.A OG1 THR 730.A O no hydrogen 2.302 N/A THR 730.A OG1 VAL 798.A O no hydrogen 3.135 N/A CYS 731.A SG HIS 288.A ND1 no hydrogen 4.004 N/A VAL 732.A N ALA 796.A O no hydrogen 3.002 N/A GLY 734.A N ASN 794.A O no hydrogen 3.287 N/A ASN 736.A N LYS 740.A O no hydrogen 3.446 N/A LYS 737.A N ASN 736.A OD1 no hydrogen 2.671 N/A LYS 737.A NZ ASP 830.A OD2 no hydrogen 2.472 N/A LYS 740.A NZ GLU 836.A O no hydrogen 3.306 N/A VAL 744.A N PRO 742.A O no hydrogen 2.741 N/A SER 748.A OG VAL 805.A O no hydrogen 3.262 N/A CYS 750.A SG SER 748.A OG no hydrogen 2.796 N/A CYS 750.A SG GLN 790.A OE1 no hydrogen 3.941 N/A TYR 757.A OH ASN 295.A O no hydrogen 3.380 N/A THR 770.A N VAL 766.A O no hydrogen 3.294 N/A ALA 773.A N ILE 769.A O no hydrogen 2.889 N/A LYS 774.A N THR 770.A O no hydrogen 2.863 N/A LYS 775.A N ALA 771.A O no hydrogen 2.925 N/A LYS 776.A N LYS 772.A O no hydrogen 2.916 N/A GLU 777.A N ALA 773.A O no hydrogen 2.862 N/A LYS 778.A N LYS 774.A O no hydrogen 2.873 N/A GLU 779.A N LYS 775.A O no hydrogen 2.973 N/A LYS 780.A N LYS 776.A O no hydrogen 2.900 N/A LYS 780.A NZ GLU 777.A OE1 no hydrogen 2.715 N/A GLU 781.A N GLU 777.A O no hydrogen 2.837 N/A LYS 782.A N LYS 778.A O no hydrogen 2.900 N/A LYS 782.A NZ GLU 779.A O no hydrogen 2.967 N/A LYS 783.A N GLU 779.A O no hydrogen 2.911 N/A GLU 784.A N LYS 780.A O no hydrogen 2.889 N/A GLU 785.A N GLU 781.A O no hydrogen 3.169 N/A ASN 794.A N ASP 793.A OD1 no hydrogen 2.771 N/A ASN 794.A ND2 GLY 734.A O no hydrogen 2.752 N/A ASN 794.A ND2 PRO 742.A O no hydrogen 2.305 N/A ALA 796.A N VAL 732.A O no hydrogen 3.436 N/A ALA 796.A N ASN 794.A O no hydrogen 3.040 N/A VAL 798.A N THR 730.A O no hydrogen 2.900 N/A GLN 802.A N MET 799.A O no hydrogen 2.869 N/A VAL 805.A N GLN 802.A O no hydrogen 3.416 N/A THR 807.A N LYS 747.A O no hydrogen 2.790 N/A THR 807.A OG1 LYS 747.A O no hydrogen 3.208 N/A THR 807.A OG1 SER 748.A O no hydrogen 3.035 N/A GLU 810.A N MET 808.A O no hydrogen 2.575 N/A CYS 812.A SG GLN 745.A OE1 no hydrogen 3.435 N/A CYS 812.A SG TYR 814.A O no hydrogen 3.550 N/A PHE 817.A N ILE 827.A O no hydrogen 3.274 N/A LYS 818.A NZ ASP 250.A OD1 no hydrogen 3.288 N/A GLY 824.A N CYS 731.A O no hydrogen 2.941 N/A ILE 826.A N ILE 733.A O no hydrogen 3.327 N/A THR 831.A OG1 ARG 813.A O no hydrogen 3.239 N/A