Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1vky_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N SER 1.A OG no hydrogen 2.925 N/A ASP 4.A N SER 1.A O no hydrogen 3.332 N/A TYR 5.A OH HIS 237.A O no hydrogen 2.562 N/A GLU 10.A N GLU 10.A OE1 no hydrogen 2.814 N/A LEU 11.A N PRO 8.A O no hydrogen 2.943 N/A ILE 12.A N PRO 9.A O no hydrogen 3.179 N/A ALA 13.A N PHE 270.A O no hydrogen 3.218 N/A ALA 22.A N PRO 19.A O no hydrogen 3.110 N/A SER 23.A N ARG 20.A O no hydrogen 3.397 N/A SER 23.A OG ARG 20.A O no hydrogen 3.297 N/A SER 23.A OG HIS 141.A ND1 no hydrogen 2.891 N/A ARG 24.A N ASP 275.A OD1 no hydrogen 2.821 N/A ARG 24.A NH1 ARG 266.A O no hydrogen 2.836 N/A LEU 25.A N ARG 38.A O no hydrogen 2.912 N/A MET 26.A N ALA 276.A O no hydrogen 2.915 N/A VAL 27.A N GLU 36.A O no hydrogen 2.921 N/A LEU 28.A N LEU 278.A O no hydrogen 2.792 N/A HIS 29.A N ARG 34.A O no hydrogen 2.945 N/A HIS 29.A NE2 GLU 36.A OE1 no hydrogen 2.802 N/A ARG 30.A N LEU 280.A O no hydrogen 2.982 N/A ARG 30.A NE LEU 280.A O no hydrogen 3.028 N/A ARG 30.A NH1 PHE 250.A O no hydrogen 3.055 N/A ARG 30.A NH2 LEU 280.A OXT no hydrogen 3.027 N/A THR 32.A OG1 HIS 29.A O no hydrogen 3.550 N/A GLN 33.A NE2 ARG 30.A O no hydrogen 2.840 N/A ARG 34.A N THR 32.A OG1 no hydrogen 3.392 N/A GLU 36.A N VAL 27.A O no hydrogen 2.907 N/A HIS 37.A ND1 TYR 268.A OH no hydrogen 2.747 N/A ARG 38.A N LEU 25.A O no hydrogen 2.770 N/A ARG 38.A NH1 GLU 45.A OE1 no hydrogen 3.020 N/A ARG 38.A NH1 TYR 46.A OH no hydrogen 2.921 N/A ARG 38.A NH2 GLU 45.A OE1 no hydrogen 3.094 N/A ILE 39.A N GLU 42.A OE1 no hydrogen 2.927 N/A PHE 40.A N SER 23.A O no hydrogen 2.868 N/A ARG 41.A N ASP 21.A O no hydrogen 2.899 N/A GLU 42.A N ILE 39.A O no hydrogen 2.881 N/A ILE 43.A N PHE 40.A O no hydrogen 2.894 N/A GLU 45.A N GLU 42.A O no hydrogen 2.887 N/A TYR 46.A N ILE 43.A O no hydrogen 2.990 N/A TYR 46.A OH GLU 36.A OE1 no hydrogen 2.746 N/A LEU 47.A N ILE 44.A O no hydrogen 3.291 N/A GLU 48.A N ASP 51.A OD2 no hydrogen 2.977 N/A GLY 50.A N GLY 154.A O no hydrogen 2.829 N/A ASP 51.A N GLU 48.A O no hydrogen 3.073 N/A LEU 52.A N ARG 188.A O no hydrogen 2.902 N/A LEU 53.A N GLN 156.A O no hydrogen 2.861 N/A VAL 54.A N VAL 190.A O no hydrogen 2.928 N/A LEU 55.A N ALA 158.A O no hydrogen 3.020 N/A VAL 57.A N VAL 160.A O no hydrogen 2.810 N/A LYS 59.A N LEU 162.A O no hydrogen 2.872 N/A ILE 61.A N VAL 164.A O no hydrogen 3.189 N/A ARG 64.A N GLY 136.A O no hydrogen 3.227 N/A LEU 65.A N ILE 74.A O no hydrogen 2.732 N/A ALA 67.A N ILE 72.A O no hydrogen 2.705 N/A ARG 68.A N VAL 102.A O no hydrogen 3.133 N/A LYS 69.A NZ LYS 94.A O no hydrogen 2.569 N/A ILE 72.A N ALA 67.A O no hydrogen 2.684 N/A GLU 73.A N ARG 90.A O no hydrogen 2.785 N/A ILE 74.A N LEU 65.A O no hydrogen 2.663 N/A LEU 75.A N LEU 88.A O no hydrogen 2.810 N/A LEU 76.A N ALA 63.A O no hydrogen 3.070 N/A ILE 77.A N LYS 86.A O no hydrogen 2.887 N/A GLU 78.A N LYS 86.A O no hydrogen 3.171 N/A ARG 79.A NE ASP 129.A OD2 no hydrogen 2.706 N/A ARG 79.A NH2 GLU 82.A OE1 no hydrogen 3.202 N/A LEU 80.A N ILE 84.A O no hydrogen 2.760 N/A GLU 81.A N ILE 84.A O no hydrogen 3.289 N/A GLY 83.A N ASP 129.A OD1 no hydrogen 2.928 N/A ILE 84.A N GLU 81.A O no hydrogen 3.043 N/A TRP 85.A N LEU 122.A O no hydrogen 3.078 N/A TRP 85.A NE1 ASP 129.A OD1 no hydrogen 3.063 N/A LYS 86.A N GLU 78.A O no hydrogen 2.763 N/A LYS 86.A NZ ASP 117.A OD2 no hydrogen 2.533 N/A LYS 86.A NZ GLU 211.A OE2 no hydrogen 3.516 N/A CYS 87.A N ARG 120.A O no hydrogen 2.767 N/A CYS 87.A SG TRP 85.A O no hydrogen 3.719 N/A LEU 88.A N LEU 75.A O no hydrogen 2.898 N/A ARG 90.A N GLU 73.A O no hydrogen 2.828 N/A ARG 90.A NH1 GLU 166.A OE2 no hydrogen 3.172 N/A ARG 90.A NH2 GLU 73.A OE1 no hydrogen 3.259 N/A ARG 90.A NH2 GLU 166.A OE1 no hydrogen 3.015 N/A ARG 90.A NH2 GLU 166.A OE2 no hydrogen 3.390 N/A VAL 95.A N GLY 92.A O no hydrogen 2.948 N/A LYS 96.A N THR 99.A OG1 no hydrogen 2.827 N/A GLY 98.A N CYS 111.A O no hydrogen 2.661 N/A THR 99.A N LYS 96.A O no hydrogen 2.864 N/A THR 99.A OG1 LYS 96.A O no hydrogen 2.939 N/A LEU 101.A N ALA 109.A O no hydrogen 2.889 N/A VAL 102.A N ARG 68.A O no hydrogen 3.161 N/A ILE 103.A N LEU 107.A O no hydrogen 2.711 N/A ASP 104.A N LEU 107.A O no hydrogen 3.227 N/A LEU 107.A N ASP 104.A O no hydrogen 3.168 N/A SER 108.A N GLN 125.A O no hydrogen 2.994 N/A SER 108.A OG LEU 101.A O no hydrogen 3.347 N/A ALA 109.A N LEU 101.A O no hydrogen 2.774 N/A VAL 110.A N LYS 123.A O no hydrogen 2.889 N/A CYS 111.A N THR 99.A O no hydrogen 2.939 N/A CYS 111.A SG GLY 113.A O no hydrogen 3.571 N/A CYS 111.A SG ILE 121.A O no hydrogen 3.828 N/A LEU 112.A N ILE 121.A O no hydrogen 2.711 N/A ARG 114.A NE GLY 118.A O no hydrogen 2.979 N/A ARG 114.A NH2 GLY 118.A O no hydrogen 3.364 N/A GLY 115.A N THR 119.A O no hydrogen 3.053 N/A ASP 117.A N GLU 211.A OE2 no hydrogen 3.256 N/A GLY 118.A N GLY 115.A O no hydrogen 3.028 N/A THR 119.A N ASP 117.A OD1 no hydrogen 3.105 N/A THR 119.A OG1 ASP 117.A OD1 no hydrogen 2.677 N/A ARG 120.A N CYS 87.A O no hydrogen 3.050 N/A ARG 120.A NE VAL 95.A O no hydrogen 3.411 N/A ILE 121.A N GLY 113.A O no hydrogen 2.879 N/A LEU 122.A N TRP 85.A O no hydrogen 2.881 N/A LYS 123.A N VAL 110.A O no hydrogen 2.883 N/A PHE 124.A N GLY 83.A O no hydrogen 2.774 N/A GLN 125.A N SER 108.A O no hydrogen 2.814 N/A GLN 127.A NE2 GLU 82.A O no hydrogen 3.117 N/A ASP 129.A N GLU 82.A OE2 no hydrogen 2.793 N/A LEU 131.A N ASP 128.A OD1 no hydrogen 3.092 N/A ILE 132.A N ASP 128.A O no hydrogen 3.197 N/A PHE 133.A N ASP 129.A O no hydrogen 2.846 N/A GLU 134.A N ARG 130.A O no hydrogen 2.916 N/A LYS 135.A N LEU 131.A O no hydrogen 2.970 N/A GLY 136.A N PHE 133.A O no hydrogen 3.152 N/A THR 137.A OG1 SER 272.A O no hydrogen 3.475 N/A LEU 140.A N THR 137.A O no hydrogen 2.986 N/A HIS 141.A N ALA 138.A O no hydrogen 3.370 N/A HIS 141.A ND1 SER 23.A OG no hydrogen 2.891 N/A HIS 141.A NE2 ASN 235.A OD1 no hydrogen 3.095 N/A PHE 142.A N GLY 139.A O no hydrogen 3.193 N/A THR 143.A OG1 ASP 21.A OD2 no hydrogen 2.844 N/A LEU 146.A N THR 143.A OG1 no hydrogen 3.207 N/A ILE 147.A N THR 143.A O no hydrogen 2.999 N/A GLU 148.A N PRO 144.A O no hydrogen 2.982 N/A LYS 149.A N GLU 145.A O no hydrogen 3.055 N/A LYS 149.A NZ GLU 145.A OE1 no hydrogen 2.889 N/A LEU 150.A N LEU 146.A O no hydrogen 2.888 N/A LYS 151.A N ILE 147.A O no hydrogen 2.924 N/A LYS 152.A N GLU 148.A O no hydrogen 2.878 N/A LYS 153.A N LYS 149.A O no hydrogen 2.942 N/A LYS 153.A NZ ILE 44.A O no hydrogen 2.723 N/A LYS 153.A NZ LEU 47.A O no hydrogen 2.783 N/A GLY 154.A N LYS 151.A O no hydrogen 3.008 N/A VAL 155.A N LEU 150.A O no hydrogen 3.014 N/A GLN 156.A N ASP 51.A O no hydrogen 2.941 N/A ALA 158.A N LEU 53.A O no hydrogen 2.933 N/A VAL 160.A N LEU 55.A O no hydrogen 2.896 N/A VAL 161.A N GLN 170.A O no hydrogen 2.890 N/A LEU 162.A N VAL 57.A O no hydrogen 2.912 N/A HIS 163.A N PHE 168.A O no hydrogen 2.731 N/A HIS 163.A NE2 GLN 170.A OE1 no hydrogen 2.859 N/A VAL 164.A N LYS 59.A O no hydrogen 2.883 N/A PHE 168.A N HIS 163.A O no hydrogen 2.877 N/A TYR 169.A N GLY 214.A O no hydrogen 2.802 N/A GLN 170.A N VAL 161.A O no hydrogen 2.864 N/A GLN 170.A NE2 GLU 78.A OE1 no hydrogen 2.662 N/A VAL 171.A N TYR 212.A O no hydrogen 2.885 N/A LYS 173.A NZ GLU 116.A OE2 no hydrogen 2.836 N/A THR 175.A OG1 GLU 159.A O no hydrogen 2.683 N/A VAL 176.A N PRO 172.A O no hydrogen 3.031 N/A ARG 177.A N LYS 173.A O no hydrogen 3.053 N/A ARG 177.A NH1 GLU 181.A OE2 no hydrogen 3.041 N/A LYS 178.A N GLU 174.A O no hydrogen 3.114 N/A LYS 178.A NZ PHE 157.A O no hydrogen 2.846 N/A LYS 178.A NZ GLU 174.A OE2 no hydrogen 3.204 N/A LEU 179.A N THR 175.A O no hydrogen 2.864 N/A ARG 180.A N VAL 176.A O no hydrogen 3.183 N/A ARG 180.A NH1 GLU 210.A OE1 no hydrogen 3.052 N/A GLU 181.A N ARG 177.A O no hydrogen 2.883 N/A THR 182.A N LYS 178.A O no hydrogen 2.846 N/A THR 182.A OG1 LYS 178.A O no hydrogen 2.708 N/A ARG 183.A N LEU 179.A O no hydrogen 3.039 N/A ARG 183.A NH1 ASP 230.A OD1 no hydrogen 3.314 N/A ARG 183.A NH1 ASP 230.A OD2 no hydrogen 2.592 N/A ARG 183.A NH2 LYS 227.A O no hydrogen 3.133 N/A ARG 183.A NH2 LEU 228.A O no hydrogen 2.887 N/A ARG 183.A NH2 ASP 230.A OD1 no hydrogen 3.272 N/A GLU 184.A N ARG 180.A O no hydrogen 2.829 N/A ARG 185.A N GLU 181.A O no hydrogen 2.878 N/A ARG 185.A NE ASN 187.A OD1 no hydrogen 2.949 N/A ARG 185.A NH2 GLY 50.A O no hydrogen 2.850 N/A GLY 186.A N ARG 183.A O no hydrogen 2.999 N/A ASN 187.A N THR 182.A O no hydrogen 3.116 N/A ASN 187.A ND2 PRO 49.A O no hydrogen 3.236 N/A ARG 188.A N ASP 51.A OD1 no hydrogen 3.081 N/A ARG 188.A NE ASP 51.A OD2 no hydrogen 3.423 N/A ARG 188.A NH2 TYR 46.A O no hydrogen 2.800 N/A ARG 188.A NH2 ASP 51.A OD2 no hydrogen 2.775 N/A ILE 189.A N ASP 230.A OD2 no hydrogen 2.800 N/A VAL 190.A N LEU 52.A O no hydrogen 2.754 N/A ALA 191.A N ALA 231.A O no hydrogen 2.899 N/A VAL 192.A N VAL 54.A O no hydrogen 2.859 N/A GLY 193.A N VAL 233.A O no hydrogen 2.802 N/A THR 196.A OG1 VAL 192.A O no hydrogen 2.885 N/A VAL 197.A N GLY 193.A O no hydrogen 3.360 N/A ARG 198.A N THR 194.A O no hydrogen 3.060 N/A THR 199.A N THR 195.A O no hydrogen 3.106 N/A THR 199.A OG1 THR 195.A O no hydrogen 3.393 N/A LEU 200.A N THR 196.A O no hydrogen 2.958 N/A GLU 201.A N VAL 197.A O no hydrogen 2.890 N/A THR 202.A N ARG 198.A O no hydrogen 2.931 N/A THR 202.A OG1 ARG 198.A O no hydrogen 2.568 N/A THR 202.A OG1 THR 216.A OG1 no hydrogen 2.565 N/A ILE 203.A N THR 199.A O no hydrogen 3.089 N/A ALA 204.A N LEU 200.A O no hydrogen 2.976 N/A ARG 205.A N THR 202.A O no hydrogen 3.109 N/A ARG 205.A NH1 GLU 201.A O no hydrogen 2.909 N/A ARG 205.A NH1 GLU 201.A OE1 no hydrogen 2.822 N/A ARG 205.A NH2 GLU 225.A O no hydrogen 2.862 N/A LEU 206.A N ILE 203.A O no hydrogen 3.092 N/A GLN 209.A N TYR 212.A OH no hydrogen 2.867 N/A TYR 212.A N VAL 171.A O no hydrogen 2.988 N/A TYR 212.A OH GLN 209.A O no hydrogen 3.407 N/A GLY 214.A N TYR 169.A O no hydrogen 3.105 N/A LYS 215.A NZ GLU 166.A OE2 no hydrogen 2.347 N/A THR 216.A OG1 THR 202.A OG1 no hydrogen 2.565 N/A LEU 218.A N THR 216.A OG1 no hydrogen 3.219 N/A LYS 227.A N GLU 201.A OE1 no hydrogen 2.782 N/A LYS 227.A NZ GLU 225.A OE1 no hydrogen 2.927 N/A LEU 228.A N GLU 201.A OE2 no hydrogen 2.789 N/A VAL 229.A N GLU 201.A OE2 no hydrogen 3.126 N/A ASP 230.A N ILE 189.A O no hydrogen 2.901 N/A ALA 231.A N ILE 189.A O no hydrogen 3.232 N/A LEU 232.A N ILE 279.A O no hydrogen 2.998 N/A VAL 233.A N ALA 191.A O no hydrogen 2.906 N/A THR 234.A N MET 277.A O no hydrogen 2.954 N/A THR 234.A OG1 HIS 237.A NE2 no hydrogen 2.894 N/A ASN 235.A ND2 THR 137.A OG1 no hydrogen 3.233 N/A HIS 237.A N TYR 260.A OH no hydrogen 2.900 N/A HIS 237.A NE2 THR 234.A OG1 no hydrogen 2.894 N/A ARG 240.A N PHE 3.A O no hydrogen 2.796 N/A ARG 240.A NE ASP 4.A OD1 no hydrogen 3.189 N/A SER 241.A N LEU 238.A O no hydrogen 3.139 N/A SER 241.A OG LEU 238.A O no hydrogen 2.656 N/A LEU 244.A N SER 241.A OG no hydrogen 3.251 N/A MET 245.A N SER 241.A O no hydrogen 3.217 N/A LEU 246.A N THR 242.A O no hydrogen 3.090 N/A VAL 247.A N LEU 243.A O no hydrogen 3.084 N/A ALA 248.A N LEU 244.A O no hydrogen 2.860 N/A ALA 249.A N MET 245.A O no hydrogen 2.983 N/A PHE 250.A N LEU 246.A O no hydrogen 3.075 N/A ALA 251.A N VAL 247.A O no hydrogen 2.801 N/A GLY 252.A N ALA 248.A O no hydrogen 2.829 N/A VAL 256.A N GLY 252.A O no hydrogen 2.889 N/A MET 257.A N LYS 253.A O no hydrogen 2.988 N/A GLU 258.A N ASP 254.A O no hydrogen 2.951 N/A ALA 259.A N PHE 255.A O no hydrogen 2.931 N/A TYR 260.A N VAL 256.A O no hydrogen 2.903 N/A ARG 261.A N MET 257.A O no hydrogen 3.000 N/A ARG 261.A NH2 GLU 258.A OE1 no hydrogen 3.424 N/A GLU 262.A N GLU 258.A O no hydrogen 2.983 N/A ALA 263.A N ALA 259.A O no hydrogen 2.886 N/A VAL 264.A N TYR 260.A O no hydrogen 3.036 N/A LYS 265.A N ARG 261.A O no hydrogen 3.060 N/A ARG 266.A N GLU 262.A O no hydrogen 2.860 N/A ARG 266.A NE GLU 262.A OE2 no hydrogen 2.622 N/A ARG 267.A N VAL 264.A O no hydrogen 2.892 N/A ARG 267.A NH1 GLU 10.A OE2 no hydrogen 3.346 N/A ARG 267.A NH2 GLU 10.A OE2 no hydrogen 2.945 N/A TYR 268.A N ALA 263.A O no hydrogen 2.919 N/A TYR 268.A OH HIS 37.A ND1 no hydrogen 2.747 N/A ARG 269.A N ASP 275.A OD2 no hydrogen 2.904 N/A ARG 269.A NH1 PHE 273.A O no hydrogen 3.096 N/A ARG 269.A NH2 ASP 275.A OD1 no hydrogen 2.895 N/A PHE 270.A N LEU 11.A O no hydrogen 2.852 N/A PHE 271.A N PHE 236.A O no hydrogen 2.879 N/A GLY 274.A N PHE 271.A O no hydrogen 2.991 N/A ASP 275.A N ARG 269.A O no hydrogen 2.759 N/A ALA 276.A N ARG 24.A O no hydrogen 2.965 N/A MET 277.A N THR 234.A O no hydrogen 2.833 N/A LEU 278.A N MET 26.A O no hydrogen 2.824 N/A ILE 279.A N LEU 232.A O no hydrogen 2.865 N/A LEU 280.A N LEU 28.A O no hydrogen 2.773 N/A