Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qik_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N ALA 60.A O no hydrogen 2.842 N/A LEU 4.A N TYR 58.A O no hydrogen 2.849 N/A PHE 5.A N LEU 92.A O no hydrogen 2.808 N/A VAL 6.A N GLU 56.A O no hydrogen 2.862 N/A TYR 7.A OH TYR 94.A O no hydrogen 2.655 N/A ARG 11.A N GLY 8.A O no hydrogen 3.056 N/A ARG 11.A NE GLU 56.A OE1 no hydrogen 2.802 N/A ARG 11.A NH1 ASP 104.A OD2 no hydrogen 2.928 N/A ARG 11.A NH2 GLU 56.A OE1 no hydrogen 3.502 N/A LYS 12.A N GLU 56.A OE2 no hydrogen 2.980 N/A LYS 12.A NZ ASP 205.A OD2 no hydrogen 3.098 N/A GLU 14.A N ARG 11.A O no hydrogen 3.022 N/A ASN 16.A N THR 9.A O no hydrogen 2.884 N/A ASN 16.A ND2 THR 9.A OG1 no hydrogen 2.906 N/A HIS 17.A N GLU 14.A O no hydrogen 3.041 N/A HIS 17.A ND1 LEU 10.A O no hydrogen 2.726 N/A LEU 19.A N ASN 16.A O no hydrogen 3.017 N/A LEU 20.A N HIS 17.A O no hydrogen 2.939 N/A ALA 21.A N HIS 18.A O no hydrogen 2.892 N/A SER 23.A N LEU 20.A O no hydrogen 2.982 N/A SER 23.A OG LEU 20.A O no hydrogen 2.684 N/A CYS 25.A SG VAL 57.A O no hydrogen 3.872 N/A ILE 26.A N VAL 57.A O no hydrogen 2.775 N/A ASN 27.A N VAL 57.A O no hydrogen 3.146 N/A GLU 28.A N GLU 168.A OE2 no hydrogen 2.781 N/A GLN 29.A N GLU 168.A OE1 no hydrogen 2.948 N/A GLN 29.A NE2 TYR 151.A OH no hydrogen 2.878 N/A GLN 29.A NE2 PHE 203.A O no hydrogen 3.187 N/A ARG 31.A N GLU 83.A O no hydrogen 3.028 N/A ARG 31.A NE GLU 83.A OE1 no hydrogen 2.850 N/A ARG 31.A NH1 TYR 54.A OH no hydrogen 3.017 N/A ARG 31.A NH2 GLU 83.A OE1 no hydrogen 2.951 N/A THR 32.A N ILE 53.A O no hydrogen 2.920 N/A THR 32.A OG1 PHE 81.A O no hydrogen 2.733 N/A GLY 34.A N GLY 51.A O no hydrogen 3.006 N/A SER 35.A N VAL 44.A O no hydrogen 3.026 N/A SER 35.A OG ASP 49.A OD2 no hydrogen 3.405 N/A PHE 37.A N THR 42.A O no hydrogen 2.862 N/A ALA 38.A N THR 98.A O no hydrogen 2.793 N/A ALA 39.A N GLY 40.A O no hydrogen 2.977 N/A THR 42.A N PHE 37.A O no hydrogen 2.900 N/A THR 42.A OG1 VAL 43.A O no hydrogen 3.442 N/A VAL 44.A N SER 35.A O no hydrogen 2.962 N/A ASN 46.A N ASP 49.A OD1 no hydrogen 2.879 N/A GLU 48.A N ASN 46.A OD1 no hydrogen 3.078 N/A ASP 49.A N ASN 46.A O no hydrogen 3.152 N/A ILE 53.A N THR 32.A O no hydrogen 2.846 N/A TYR 54.A N GLY 103.A O no hydrogen 2.828 N/A GLY 55.A N ALA 30.A O no hydrogen 2.927 N/A GLU 56.A N VAL 6.A O no hydrogen 2.934 N/A VAL 57.A N ASN 27.A O no hydrogen 2.839 N/A TYR 58.A N LEU 4.A O no hydrogen 2.843 N/A TYR 58.A OH GLU 56.A OE2 no hydrogen 2.764 N/A GLU 59.A N ALA 24.A O no hydrogen 2.879 N/A ALA 60.A N SER 2.A O no hydrogen 2.882 N/A CYS 64.A N ASP 61.A OD2 no hydrogen 2.937 N/A CYS 64.A SG LEU 19.A O no hydrogen 4.000 N/A ILE 65.A N ASP 61.A O no hydrogen 3.076 N/A HIS 66.A N GLU 62.A O no hydrogen 2.894 N/A LYS 67.A N LEU 63.A O no hydrogen 2.937 N/A LEU 68.A N CYS 64.A O no hydrogen 2.893 N/A ASP 69.A N ILE 65.A O no hydrogen 2.863 N/A GLN 70.A N HIS 66.A O no hydrogen 2.973 N/A PHE 71.A N LYS 67.A O no hydrogen 2.941 N/A PHE 72.A N LEU 68.A O no hydrogen 2.972 N/A TYR 75.A N PHE 72.A O no hydrogen 3.107 N/A HIS 76.A N PHE 95.A O no hydrogen 2.863 N/A LYS 77.A NZ ASP 69.A OD1 no hydrogen 2.922 N/A LYS 77.A NZ ASP 69.A OD2 no hydrogen 3.198 N/A GLN 78.A N ILE 93.A O no hydrogen 3.066 N/A GLN 78.A NE2 THR 79.A O no hydrogen 2.891 N/A VAL 80.A N ALA 91.A O no hydrogen 2.898 N/A VAL 82.A N LYS 89.A O no hydrogen 2.721 N/A GLU 83.A N ARG 31.A O no hydrogen 2.805 N/A THR 84.A N GLY 87.A O no hydrogen 3.118 N/A THR 84.A OG1 GLY 87.A O no hydrogen 2.733 N/A VAL 86.A N THR 84.A OG1 no hydrogen 3.072 N/A LYS 89.A N VAL 82.A O no hydrogen 2.844 N/A ALA 91.A N VAL 80.A O no hydrogen 2.980 N/A LEU 92.A N LEU 3.A O no hydrogen 2.886 N/A ILE 93.A N GLN 78.A O no hydrogen 2.828 N/A TYR 94.A OH ILE 65.A O no hydrogen 3.410 N/A TYR 94.A OH ASP 69.A OD1 no hydrogen 2.856 N/A PHE 95.A N HIS 76.A O no hydrogen 2.837 N/A THR 98.A N ALA 38.A O no hydrogen 2.945 N/A ILE 100.A N LEU 36.A O no hydrogen 2.835 N/A SER 102.A OG ASP 104.A O no hydrogen 3.347 N/A SER 102.A OG GLU 107.A OE2 no hydrogen 2.734 N/A GLY 103.A N ILE 100.A O no hydrogen 3.016 N/A ASP 104.A N SER 102.A OG no hydrogen 3.081 N/A LYS 106.A NZ LYS 12.A O no hydrogen 2.718 N/A LYS 106.A NZ ASP 215.A OD2 no hydrogen 2.832 N/A GLU 107.A N ASP 104.A OD2 no hydrogen 3.190 N/A HIS 108.A N ASP 104.A O no hydrogen 2.903 N/A GLN 109.A N TRP 105.A O no hydrogen 2.888 N/A GLN 109.A NE2 GLU 14.A OE1 no hydrogen 3.333 N/A GLN 109.A NE2 GLU 14.A OE2 no hydrogen 2.578 N/A GLN 109.A NE2 TRP 105.A O no hydrogen 3.688 N/A SER 111.A N HIS 108.A O no hydrogen 2.825 N/A SER 111.A OG HIS 108.A O no hydrogen 2.705 N/A LYS 112.A N GLN 109.A O no hydrogen 3.123 N/A SER 113.A N ILE 110.A O no hydrogen 3.057 N/A ILE 117.A N ILE 180.A O no hydrogen 2.813 N/A TYR 119.A N TYR 178.A O no hydrogen 2.892 N/A PHE 120.A N LEU 217.A O no hydrogen 2.765 N/A ALA 121.A N VAL 176.A O no hydrogen 2.860 N/A TYR 122.A OH PHE 219.A O no hydrogen 2.663 N/A CYS 125.A SG TYR 119.A OH no hydrogen 3.395 N/A CYS 125.A SG GLU 192.A OE2 no hydrogen 3.881 N/A ALA 128.A N ASP 126.A OD1 no hydrogen 3.179 N/A GLN 131.A N ASN 127.A O no hydrogen 2.935 N/A LYS 132.A N ALA 128.A O no hydrogen 2.991 N/A ALA 133.A N ARG 129.A O no hydrogen 3.057 N/A GLY 134.A N GLN 131.A O no hydrogen 3.083 N/A VAL 135.A N PHE 130.A O no hydrogen 2.996 N/A TYR 138.A N VAL 135.A O no hydrogen 2.920 N/A TYR 138.A OH SER 183.A OG no hydrogen 2.826 N/A PHE 139.A N ASP 136.A O no hydrogen 2.842 N/A VAL 143.A N LEU 177.A O no hydrogen 2.744 N/A GLY 144.A N LEU 177.A O no hydrogen 3.235 N/A ARG 145.A NE.A TYR 245.A O no hydrogen 2.832 N/A ARG 145.A NE.B GLU 174.A OE1 no hydrogen 2.952 N/A ARG 145.A NH1.A TYR 245.A O no hydrogen 3.450 N/A ARG 145.A NH1.B GLU 174.A OE2 no hydrogen 2.837 N/A ALA 146.A N GLY 175.A O no hydrogen 2.835 N/A VAL 147.A N GLU 207.A O no hydrogen 2.995 N/A LEU 148.A N THR 173.A O no hydrogen 2.943 N/A GLY 150.A N GLY 171.A O no hydrogen 2.762 N/A TYR 151.A OH GLU 28.A OE2 no hydrogen 2.645 N/A THR 152.A N LEU 167.A O no hydrogen 2.989 N/A THR 152.A OG1 ASP 169.A OD1 no hydrogen 3.361 N/A THR 152.A OG1 ASP 169.A OD2 no hydrogen 2.669 N/A THR 153.A OG1 THR 173.A OG1 no hydrogen 2.710 N/A ARG 154.A N ASP 166.A O no hydrogen 2.915 N/A ARG 154.A NE ASP 169.A OD1 no hydrogen 2.851 N/A ARG 154.A NH1 GLU 227.A OE2 no hydrogen 2.914 N/A ARG 154.A NH2 ASP 169.A OD1 no hydrogen 2.977 N/A PHE 155.A N GLU 227.A OE1 no hydrogen 2.813 N/A THR 156.A OG1 ASP 166.A OD2 no hydrogen 2.737 N/A LEU 157.A N ARG 164.A O no hydrogen 3.325 N/A LYS 158.A NZ GLU 225.A OE1 no hydrogen 2.703 N/A ARG 159.A N GLY 162.A O no hydrogen 3.091 N/A GLY 162.A N ARG 159.A O no hydrogen 3.269 N/A SER 163.A N ALA 229.A O no hydrogen 3.036 N/A SER 163.A OG.A ILE 228.A O no hydrogen 2.627 N/A SER 163.A OG.B LEU 157.A O no hydrogen 3.105 N/A ARG 164.A N LEU 157.A O no hydrogen 2.965 N/A ARG 164.A NH1 ASP 161.A OD2 no hydrogen 2.914 N/A ARG 164.A NH1 SER 163.A O no hydrogen 3.118 N/A ARG 164.A NH2 ASP 161.A OD1 no hydrogen 3.079 N/A ARG 164.A NH2 ASP 161.A OD2 no hydrogen 3.107 N/A ALA 165.A N TYR 234.A OH no hydrogen 2.879 N/A GLU 168.A N ASP 85.A OD2 no hydrogen 2.771 N/A GLY 170.A N GLY 150.A O no hydrogen 2.967 N/A GLY 171.A N ASP 169.A OD2 no hydrogen 3.087 N/A THR 173.A N LEU 148.A O no hydrogen 3.066 N/A THR 173.A OG1 THR 153.A OG1 no hydrogen 2.710 N/A GLY 175.A N ALA 146.A O no hydrogen 2.941 N/A VAL 176.A N ALA 121.A O no hydrogen 2.805 N/A LEU 177.A N GLY 144.A O no hydrogen 2.968 N/A TYR 178.A N TYR 119.A O no hydrogen 2.797 N/A TYR 178.A OH CYS 125.A O no hydrogen 2.735 N/A ARG 179.A N ASP 141.A O no hydrogen 3.055 N/A ARG 179.A NE TYR 118.A OH no hydrogen 2.834 N/A ARG 179.A NH1 ASP 141.A OD2 no hydrogen 2.985 N/A ARG 179.A NH2 TYR 118.A OH no hydrogen 3.323 N/A ILE 180.A N ILE 117.A O no hydrogen 2.877 N/A SER 183.A OG TYR 138.A OH no hydrogen 2.826 N/A ALA 184.A N PRO 181.A O no hydrogen 2.921 N/A LEU 185.A N TYR 182.A O no hydrogen 2.972 N/A TYR 189.A N LEU 185.A O no hydrogen 2.915 N/A TYR 189.A OH GLU 107.A OE1 no hydrogen 2.652 N/A LYS 190.A N SER 186.A O no hydrogen 2.979 N/A ARG 191.A N TYR 187.A O no hydrogen 2.894 N/A ARG 191.A NH1 TYR 187.A OH no hydrogen 2.982 N/A ARG 191.A NH2 SER 124.A OG no hydrogen 3.055 N/A GLU 192.A N LEU 188.A O no hydrogen 2.903 N/A GLY 193.A N LYS 190.A O no hydrogen 3.065 N/A VAL 194.A N TYR 189.A O no hydrogen 3.051 N/A SER 196.A OG GLY 193.A O no hydrogen 3.123 N/A SER 196.A OG THR 198.A OG1 no hydrogen 2.869 N/A LEU 197.A N VAL 194.A O no hydrogen 3.096 N/A THR 198.A N GLY 193.A O no hydrogen 2.965 N/A THR 198.A OG1 GLY 193.A O no hydrogen 3.409 N/A THR 198.A OG1 SER 196.A OG no hydrogen 2.869 N/A TYR 199.A N GLU 192.A O no hydrogen 3.263 N/A TYR 199.A OH ALA 165.A O no hydrogen 2.706 N/A ARG 200.A N LEU 220.A O no hydrogen 2.852 N/A ARG 200.A NH2 GLN 29.A OE1 no hydrogen 2.827 N/A ALA 202.A N THR 218.A O no hydrogen 2.880 N/A VAL 204.A N CYS 216.A O no hydrogen 2.959 N/A VAL 206.A N TYR 213.A O no hydrogen 2.996 N/A GLU 207.A N VAL 147.A O no hydrogen 3.176 N/A ALA 208.A N ARG 211.A O no hydrogen 2.868 N/A ARG 211.A N ALA 208.A O no hydrogen 3.301 N/A TYR 213.A N VAL 206.A O no hydrogen 2.862 N/A ASP 215.A N ASP 205.A OD1 no hydrogen 2.885 N/A CYS 216.A N VAL 204.A O no hydrogen 2.806 N/A CYS 216.A SG TYR 213.A O no hydrogen 3.596 N/A LEU 217.A N TYR 118.A O no hydrogen 2.823 N/A THR 218.A N ALA 202.A O no hydrogen 2.856 N/A THR 218.A OG1 PHE 120.A O no hydrogen 2.877 N/A LEU 220.A N ARG 200.A O no hydrogen 2.947 N/A VAL 221.A N ASP 166.A OD1 no hydrogen 2.861 N/A LEU 222.A N THR 198.A O no hydrogen 3.128 N/A LYS 224.A NZ ASP 166.A OD1 no hydrogen 3.218 N/A LYS 224.A NZ ASP 166.A OD2 no hydrogen 2.693 N/A LYS 224.A NZ VAL 221.A O no hydrogen 2.858 N/A GLU 225.A N THR 156.A O no hydrogen 2.814 N/A ALA 229.A N PRO 261.A O no hydrogen 2.818 N/A GLN 235.A N PRO 231.A O no hydrogen 2.907 N/A ILE 236.A N GLN 232.A O no hydrogen 2.924 N/A GLU 237.A N HIS 233.A O no hydrogen 3.211 N/A ILE 238.A N TYR 234.A O no hydrogen 3.209 N/A GLU 239.A N GLN 235.A O no hydrogen 2.910 N/A ARG 240.A N ILE 236.A O no hydrogen 2.979 N/A ARG 240.A NE ASP 126.A OD2 no hydrogen 2.951 N/A ARG 240.A NH2 ASP 126.A OD1 no hydrogen 2.880 N/A GLY 241.A N GLU 237.A O no hydrogen 3.034 N/A ALA 242.A N ILE 238.A O no hydrogen 2.821 N/A GLU 243.A N GLU 239.A O no hydrogen 2.936 N/A LEU 244.A N ARG 240.A O no hydrogen 3.017 N/A TYR 245.A N GLY 241.A O no hydrogen 3.058 N/A LEU 246.A N ALA 242.A O no hydrogen 2.833 N/A SER 247.A N GLU 174.A OE1 no hydrogen 2.956 N/A SER 247.A OG GLU 174.A OE1 no hydrogen 3.488 N/A SER 247.A OG GLU 174.A OE2 no hydrogen 2.815 N/A PHE 250.A N SER 247.A OG no hydrogen 3.206 N/A THR 251.A N SER 247.A O no hydrogen 2.916 N/A THR 251.A OG1 ALA 242.A O no hydrogen 3.269 N/A THR 251.A OG1 SER 247.A O no hydrogen 3.138 N/A GLU 252.A N PRO 248.A O no hydrogen 2.947 N/A LYS 253.A N GLU 249.A O no hydrogen 3.101 N/A LEU 254.A N PHE 250.A O no hydrogen 2.873 N/A LYS 255.A N THR 251.A O no hydrogen 2.946 N/A LYS 255.A NZ GLU 243.A OE2 no hydrogen 2.728 N/A ARG 256.A N GLU 252.A O no hydrogen 2.931 N/A HIS 257.A N LYS 253.A O no hydrogen 2.908 N/A HIS 257.A NE2 GLU 227.A OE1 no hydrogen 2.661 N/A ASN 258.A ND2 GLN 235.A OE1 no hydrogen 2.900 N/A SER 259.A N HIS 257.A O no hydrogen 3.174 N/A