Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u1t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 8.A NZ ASP 60.A OD2 no hydrogen 2.745 N/A LYS 8.A NZ ASP 65.A OD2 no hydrogen 2.688 N/A ARG 9.A N TYR 20.A O no hydrogen 2.873 N/A ARG 9.A NH1 ASP 22.A OD2 no hydrogen 2.795 N/A VAL 11.A N ILE 18.A O no hydrogen 2.948 N/A VAL 13.A N ALA 16.A O no hydrogen 2.664 N/A ALA 16.A N VAL 13.A O no hydrogen 2.920 N/A ILE 18.A N VAL 11.A O no hydrogen 2.800 N/A ALA 19.A N SER 66.A OG no hydrogen 3.049 N/A TYR 20.A N ARG 9.A O no hydrogen 2.887 N/A VAL 21.A N ALA 58.A O no hydrogen 2.835 N/A GLU 23.A N ALA 56.A O no hydrogen 2.992 N/A GLN 27.A NE2 ASP 92.A O no hydrogen 2.986 N/A GLN 27.A NE2 PRO 284.A O no hydrogen 2.882 N/A VAL 29.A N ARG 55.A O no hydrogen 2.735 N/A LEU 30.A N VAL 93.A O no hydrogen 2.720 N/A PHE 31.A N VAL 57.A O no hydrogen 2.794 N/A LEU 32.A N VAL 95.A O no hydrogen 2.874 N/A HIS 33.A ND1 GLY 34.A O no hydrogen 2.778 N/A ASN 35.A N ASP 98.A OD2 no hydrogen 2.899 N/A ASN 35.A ND2 THR 192.A O no hydrogen 3.310 N/A THR 37.A N GLY 34.A O no hydrogen 3.024 N/A THR 37.A OG1 HIS 33.A ND1 no hydrogen 3.398 N/A THR 37.A OG1 GLY 34.A O no hydrogen 3.059 N/A SER 39.A N ASP 60.A OD1 no hydrogen 2.862 N/A SER 39.A OG ASP 60.A OD1 no hydrogen 2.724 N/A TYR 40.A N SER 38.A OG no hydrogen 3.133 N/A TYR 40.A OH SER 2.A O no hydrogen 2.602 N/A LEU 41.A N SER 38.A O no hydrogen 2.972 N/A TRP 42.A N SER 39.A O no hydrogen 3.017 N/A ARG 43.A N TYR 40.A O no hydrogen 3.087 N/A ARG 43.A NE SER 1.A O no hydrogen 2.830 N/A ARG 43.A NH1 TYR 40.A O no hydrogen 2.919 N/A ARG 43.A NH1 GLU 265.A OE2 no hydrogen 2.822 N/A ARG 43.A NH2 SER 1.A O no hydrogen 3.090 N/A ARG 43.A NH2 GLU 176.A OE2 no hydrogen 2.898 N/A ARG 43.A NH2 GLU 265.A OE1 no hydrogen 2.967 N/A ARG 43.A NH2 GLU 265.A OE2 no hydrogen 3.461 N/A ASN 44.A ND2 SER 1.A O no hydrogen 2.937 N/A ILE 45.A N TRP 42.A O no hydrogen 2.964 N/A ILE 46.A N TRP 42.A O no hydrogen 2.981 N/A TYR 48.A N ILE 45.A O no hydrogen 2.951 N/A TYR 48.A OH HIS 269.A ND1 no hydrogen 2.662 N/A VAL 50.A N ILE 46.A O no hydrogen 3.226 N/A ALA 51.A N PRO 47.A O no hydrogen 3.035 N/A ALA 52.A N TYR 48.A O no hydrogen 3.059 N/A GLY 53.A N VAL 50.A O no hydrogen 2.858 N/A TYR 54.A N VAL 49.A O no hydrogen 2.987 N/A ARG 55.A N GLN 27.A O no hydrogen 2.813 N/A ARG 55.A NE ASP 22.A OD1 no hydrogen 2.924 N/A ARG 55.A NH2 ASP 22.A OD2 no hydrogen 3.064 N/A ALA 56.A N GLU 23.A O no hydrogen 2.671 N/A VAL 57.A N VAL 29.A O no hydrogen 2.856 N/A ALA 58.A N VAL 21.A O no hydrogen 2.984 N/A ASP 60.A N ALA 19.A O no hydrogen 2.921 N/A LEU 61.A N HIS 33.A NE2 no hydrogen 3.050 N/A GLY 63.A N ALA 67.A O no hydrogen 2.822 N/A ASP 65.A N ASP 60.A OD2 no hydrogen 2.861 N/A SER 66.A OG ASP 60.A O no hydrogen 2.651 N/A ALA 67.A N THR 17.A O no hydrogen 2.856 N/A LYS 68.A NZ PRO 182.A O no hydrogen 2.766 N/A ILE 71.A N PRO 69.A O no hydrogen 2.930 N/A TYR 73.A OH PRO 69.A O no hydrogen 2.667 N/A ARG 74.A N ASP 77.A OD2 no hydrogen 2.781 N/A ARG 74.A NE ASP 77.A OD2 no hydrogen 3.127 N/A ARG 74.A NH2 ASP 77.A OD1 no hydrogen 3.199 N/A LEU 75.A N GLU 198.A OE1 no hydrogen 2.848 N/A GLN 76.A N GLN 76.A OE1 no hydrogen 2.749 N/A HIS 78.A N ARG 74.A O no hydrogen 3.045 N/A VAL 79.A N LEU 75.A O no hydrogen 2.937 N/A ALA 80.A N GLN 76.A O no hydrogen 3.382 N/A TYR 81.A N ASP 77.A O no hydrogen 3.316 N/A GLY 83.A N ALA 80.A O no hydrogen 3.028 N/A PHE 84.A N TYR 81.A O no hydrogen 2.918 N/A ASP 86.A N ASP 82.A O no hydrogen 3.016 N/A ALA 87.A N GLY 83.A O no hydrogen 2.802 N/A LEU 88.A N PHE 84.A O no hydrogen 3.074 N/A GLY 89.A N ASP 86.A O no hydrogen 3.065 N/A LEU 90.A N ILE 85.A O no hydrogen 3.172 N/A ASP 92.A N ASP 91.A OD1 no hydrogen 2.974 N/A LEU 94.A N ALA 116.A O no hydrogen 2.970 N/A VAL 95.A N LEU 30.A O no hydrogen 2.827 N/A ILE 96.A N ALA 118.A O no hydrogen 2.859 N/A HIS 97.A N LEU 32.A O no hydrogen 3.226 N/A HIS 97.A NE2 HIS 261.A O no hydrogen 3.068 N/A ASP 98.A N GLU 120.A O no hydrogen 3.130 N/A SER 101.A N HIS 97.A O no hydrogen 3.269 N/A SER 101.A N ASP 98.A O no hydrogen 2.932 N/A SER 101.A OG ASP 98.A O no hydrogen 2.600 N/A ILE 103.A N TRP 99.A O no hydrogen 3.108 N/A GLY 104.A N GLY 100.A O no hydrogen 2.786 N/A ARG 105.A NH1 ASP 82.A OD1 no hydrogen 2.885 N/A HIS 106.A N ILE 103.A O no hydrogen 3.086 N/A HIS 106.A ND1 ASP 82.A OD2 no hydrogen 2.892 N/A ALA 107.A N GLY 104.A O no hydrogen 3.054 N/A ARG 108.A NH1 GLU 211.A OE1 no hydrogen 3.089 N/A ARG 108.A NH1 ASN 215.A OD1 no hydrogen 2.784 N/A ARG 108.A NH2 GLU 211.A OE1 no hydrogen 3.232 N/A LEU 109.A N ARG 105.A O no hydrogen 2.901 N/A ASN 110.A N HIS 106.A O no hydrogen 2.854 N/A ARG 113.A N ASN 110.A O no hydrogen 2.841 N/A ARG 113.A NE ASP 112.A OD2.A no hydrogen 2.754 N/A ARG 113.A NH1 ASP 112.A OD2.A no hydrogen 3.368 N/A VAL 117.A N PRO 224.A O no hydrogen 3.184 N/A ALA 118.A N LEU 94.A O no hydrogen 2.749 N/A PHE 119.A N LEU 226.A O no hydrogen 2.851 N/A LEU 122.A N SER 101.A OG no hydrogen 3.130 N/A LEU 127.A N VAL 123.A O no hydrogen 3.059 N/A SER 130.A OG GLU 132.A OE1 no hydrogen 3.463 N/A ALA 133.A N SER 130.A OG no hydrogen 3.119 N/A GLY 138.A N GLY 134.A O no hydrogen 3.120 N/A LEU 140.A N GLN 136.A O no hydrogen 3.194 N/A PHE 141.A N LEU 137.A O no hydrogen 2.893 N/A ARG 142.A N GLY 138.A O no hydrogen 2.981 N/A ASP 143.A N PRO 139.A O no hydrogen 2.875 N/A LEU 144.A N LEU 140.A O no hydrogen 2.957 N/A ARG 145.A N PHE 141.A O no hydrogen 2.941 N/A ARG 145.A NE TYR 131.A OH no hydrogen 2.835 N/A ARG 145.A NH1 VAL 199.A O no hydrogen 3.327 N/A ARG 145.A NH1 GLU 204.A O no hydrogen 2.938 N/A ARG 145.A NH2 PRO 196.A O no hydrogen 2.953 N/A ARG 145.A NH2 VAL 199.A O no hydrogen 2.700 N/A THR 146.A N ASP 143.A O no hydrogen 2.918 N/A THR 146.A OG1 ARG 142.A O no hydrogen 2.616 N/A ASP 148.A N GLU 151.A OE2 no hydrogen 2.821 N/A GLY 150.A N THR 146.A O no hydrogen 3.024 N/A GLU 151.A N GLU 151.A OE2 no hydrogen 2.818 N/A LYS 152.A N ASP 148.A O no hydrogen 2.953 N/A LEU 154.A N GLU 151.A O no hydrogen 2.829 N/A ASP 155.A N GLU 151.A O no hydrogen 3.135 N/A GLY 156.A N LYS 152.A O no hydrogen 3.052 N/A ASN 157.A N VAL 153.A O no hydrogen 2.859 N/A GLU 161.A N ASN 157.A O no hydrogen 2.887 N/A THR 162.A N PHE 158.A O no hydrogen 2.932 N/A ILE 163.A N PHE 158.A O no hydrogen 3.114 N/A LEU 164.A N PHE 159.A O no hydrogen 2.983 N/A GLU 166.A N THR 162.A O no hydrogen 2.824 N/A VAL 169.A N ASP 266.A OD2 no hydrogen 2.777 N/A ARG 170.A N ASP 266.A OD1 no hydrogen 2.894 N/A ARG 170.A NE GLU 265.A O no hydrogen 2.731 N/A ARG 170.A NH1 GLU 176.A OE1 no hydrogen 2.993 N/A ARG 170.A NH2 GLU 176.A OE1 no hydrogen 3.369 N/A ARG 170.A NH2 GLU 176.A OE2 no hydrogen 2.963 N/A SER 173.A N GLU 176.A OE1 no hydrogen 2.767 N/A GLU 176.A N SER 173.A OG no hydrogen 3.111 N/A ALA 178.A N ALA 175.A O no hydrogen 3.133 N/A TYR 179.A N GLU 176.A O no hydrogen 2.976 N/A TYR 179.A OH GLU 265.A OE2 no hydrogen 2.468 N/A ARG 180.A NE GLU 161.A OE2 no hydrogen 2.671 N/A ARG 180.A NH2 GLU 161.A OE1 no hydrogen 2.982 N/A ARG 180.A NH2 GLU 161.A OE2 no hydrogen 3.451 N/A ALA 181.A N ALA 177.A O no hydrogen 2.979 N/A PHE 183.A N ARG 180.A O no hydrogen 2.779 N/A THR 185.A N SER 188.A OG no hydrogen 3.184 N/A ARG 186.A NE.A ASP 155.A OD1 no hydrogen 2.746 N/A SER 188.A N THR 185.A OG1 no hydrogen 3.205 N/A SER 188.A OG THR 185.A O no hydrogen 2.674 N/A SER 188.A OG THR 185.A OG1 no hydrogen 3.200 N/A ARG 189.A N ARG 186.A O no hydrogen 3.153 N/A ARG 189.A NE PHE 183.A O no hydrogen 2.851 N/A ARG 189.A NH1 LEU 154.A O no hydrogen 2.869 N/A ARG 189.A NH2 PHE 183.A O no hydrogen 3.155 N/A LEU 190.A N GLN 187.A O no hydrogen 3.208 N/A THR 192.A N ARG 189.A O no hydrogen 2.891 N/A THR 192.A OG1 ARG 189.A O no hydrogen 2.737 N/A LEU 193.A N ARG 189.A O no hydrogen 3.314 N/A LEU 193.A N LEU 190.A O no hydrogen 2.960 N/A GLN 194.A N LEU 190.A O no hydrogen 2.796 N/A GLN 194.A NE2 GLU 198.A OE2 no hydrogen 2.991 N/A TRP 195.A N PRO 191.A O no hydrogen 3.100 N/A ARG 197.A NE LEU 144.A O no hydrogen 2.890 N/A ARG 197.A NH1 LEU 144.A O no hydrogen 3.255 N/A ARG 197.A NH1 GLU 151.A OE1 no hydrogen 3.327 N/A ARG 197.A NH1 GLU 151.A OE2 no hydrogen 2.925 N/A ARG 197.A NH2 GLU 151.A OE1 no hydrogen 2.858 N/A GLU 198.A N TRP 195.A O no hydrogen 2.889 N/A ILE 201.A N GLU 204.A O no hydrogen 2.892 N/A GLU 204.A N ILE 201.A O no hydrogen 3.068 N/A GLU 209.A N PRO 205.A O no hydrogen 3.141 N/A ALA 210.A N ALA 206.A O no hydrogen 3.002 N/A GLU 211.A N PHE 207.A O no hydrogen 2.969 N/A VAL 212.A N ALA 208.A O no hydrogen 2.937 N/A LEU 213.A N GLU 209.A O no hydrogen 3.017 N/A LYS 214.A N ALA 210.A O no hydrogen 2.940 N/A ASN 215.A N GLU 211.A O no hydrogen 2.887 N/A ASN 215.A ND2 VAL 102.A O no hydrogen 3.042 N/A GLY 216.A N VAL 212.A O no hydrogen 2.994 N/A GLU 217.A N LEU 213.A O no hydrogen 3.108 N/A TRP 218.A N LYS 214.A O no hydrogen 2.942 N/A LEU 219.A N ASN 215.A O no hydrogen 2.857 N/A SER 221.A N TRP 218.A O no hydrogen 2.757 N/A ILE 223.A N SER 221.A OG no hydrogen 3.411 N/A LYS 225.A N ASN 250.A O no hydrogen 2.836 N/A LYS 225.A NZ SER 221.A O no hydrogen 2.701 N/A LYS 225.A NZ ILE 223.A O no hydrogen 2.777 N/A LYS 225.A NZ PRO 249.A O no hydrogen 2.849 N/A LEU 226.A N VAL 117.A O no hydrogen 2.987 N/A LEU 227.A N GLU 252.A O no hydrogen 2.790 N/A PHE 228.A N PHE 119.A O no hydrogen 3.137 N/A HIS 229.A N ARG 254.A O no hydrogen 3.318 N/A GLU 231.A N GLY 257.A O no hydrogen 2.765 N/A GLY 233.A N GLY 259.A O no hydrogen 2.943 N/A ALA 234.A N GLU 120.A OE2 no hydrogen 3.039 N/A LEU 235.A N GLU 120.A OE1 no hydrogen 2.753 N/A ALA 236.A N GLU 120.A OE2 no hydrogen 3.058 N/A LYS 238.A NZ ASP 242.A OD2 no hydrogen 3.155 N/A VAL 240.A N PRO 237.A O no hydrogen 2.998 N/A VAL 241.A N PRO 237.A O no hydrogen 3.173 N/A ASP 242.A N LYS 238.A O no hydrogen 2.871 N/A TYR 243.A N PRO 239.A O no hydrogen 3.183 N/A LEU 244.A N VAL 240.A O no hydrogen 3.000 N/A SER 245.A N VAL 241.A O no hydrogen 2.808 N/A SER 245.A OG ASP 242.A O no hydrogen 2.927 N/A GLU 246.A N ASP 242.A O no hydrogen 3.289 N/A GLU 246.A N TYR 243.A O no hydrogen 3.150 N/A ASN 247.A N LEU 244.A O no hydrogen 3.125 N/A ASN 247.A ND2 TYR 243.A O no hydrogen 2.841 N/A VAL 248.A N LEU 244.A O no hydrogen 2.897 N/A ASN 250.A ND2 PRO 222.A O no hydrogen 2.768 N/A GLU 252.A N LYS 225.A O no hydrogen 2.804 N/A ARG 254.A N LEU 227.A O no hydrogen 2.772 N/A ARG 254.A NE GLU 252.A OE2 no hydrogen 2.783 N/A ARG 254.A NH2 GLU 252.A OE2 no hydrogen 2.966 N/A ARG 254.A NH2 ASP 277.A OD2 no hydrogen 3.126 N/A VAL 256.A N HIS 229.A O no hydrogen 2.880 N/A GLY 259.A N GLU 231.A O no hydrogen 2.964 N/A HIS 261.A N GLY 167.A O no hydrogen 3.306 N/A HIS 261.A N THR 260.A OG1 no hydrogen 2.740 N/A HIS 261.A ND1 GLU 120.A OE1 no hydrogen 2.851 N/A PHE 262.A N GLY 167.A O no hydrogen 2.778 N/A LEU 263.A N HIS 261.A O no hydrogen 2.974 N/A GLN 264.A N GLN 264.A OE1 no hydrogen 2.708 N/A GLU 265.A N PHE 262.A O no hydrogen 2.970 N/A ASP 266.A N LEU 263.A O no hydrogen 3.096 N/A HIS 267.A N LEU 263.A O no hydrogen 2.840 N/A HIS 267.A NE2 ALA 258.A O no hydrogen 2.617 N/A HIS 269.A ND1 TYR 48.A OH no hydrogen 2.662 N/A ILE 271.A N HIS 267.A O no hydrogen 3.194 N/A GLY 272.A N PRO 268.A O no hydrogen 2.741 N/A GLN 273.A N HIS 269.A O no hydrogen 2.779 N/A GLY 274.A N LEU 270.A O no hydrogen 2.845 N/A ILE 275.A N ILE 271.A O no hydrogen 2.968 N/A ALA 276.A N GLY 272.A O no hydrogen 3.198 N/A ASP 277.A N GLN 273.A O no hydrogen 2.905 N/A TRP 278.A N GLY 274.A O no hydrogen 3.013 N/A LEU 279.A N ILE 275.A O no hydrogen 2.871 N/A ARG 280.A N ALA 276.A O no hydrogen 2.889 N/A ARG 280.A NH2 ASP 277.A OD1 no hydrogen 2.778 N/A ARG 281.A N ASP 277.A O no hydrogen 3.079 N/A ARG 281.A NE ASP 277.A OD2 no hydrogen 2.782 N/A ARG 281.A NH1 GLU 252.A OE1 no hydrogen 3.065 N/A ARG 281.A NH1 GLU 252.A OE2 no hydrogen 2.855 N/A ARG 281.A NH1 ASP 277.A OD2 no hydrogen 2.839 N/A ARG 281.A NH2 GLU 252.A OE1 no hydrogen 2.942 N/A ASN 282.A N TRP 278.A O no hydrogen 2.964 N/A ASN 282.A ND2 TRP 278.A O no hydrogen 2.998 N/A LYS 283.A N LEU 279.A O no hydrogen 2.802 N/A HIS 285.A ND1 ASP 92.A OD2 no hydrogen 2.692 N/A ALA 286.A N ASP 92.A OD1 no hydrogen 2.656 N/A