Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4hql_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ALA 209.A O no hydrogen 2.819 N/A TYR 5.A N ARG 207.A O no hydrogen 2.979 N/A SER 6.A OG GLU 204.A OE2 no hydrogen 3.425 N/A GLU 7.A N VAL 205.A O no hydrogen 3.214 N/A VAL 9.A N THR 203.A O no hydrogen 2.915 N/A GLU 12.A N GLU 12.A OE1 no hydrogen 2.689 N/A VAL 14.A N THR 52.A O no hydrogen 3.168 N/A ASP 15.A N ILE 121.A O no hydrogen 2.818 N/A LEU 16.A N ASN 54.A O no hydrogen 2.966 N/A TYR 17.A N LEU 123.A O no hydrogen 2.690 N/A TYR 17.A OH GLN 122.A OE1 no hydrogen 2.616 N/A LEU 18.A N TYR 56.A O no hydrogen 2.840 N/A LEU 19.A N ILE 125.A O no hydrogen 2.904 N/A VAL 20.A N ASN 58.A O no hydrogen 2.787 N/A ASP 21.A N MET 127.A O no hydrogen 2.923 N/A GLY 22.A N PHE 60.A O no hydrogen 2.803 N/A SER 23.A N ASP 21.A OD1 no hydrogen 2.923 N/A SER 23.A OG ASP 21.A OD1 no hydrogen 2.600 N/A SER 23.A OG SER 25.A OG no hydrogen 3.093 N/A SER 23.A OG THR 98.A OG1 no hydrogen 3.080 N/A GLY 24.A N GLY 96.A O no hydrogen 3.012 N/A SER 25.A OG SER 23.A OG no hydrogen 3.093 N/A SER 25.A OG ASP 129.A OD2 no hydrogen 2.629 N/A ILE 26.A N SER 23.A O no hydrogen 3.064 N/A TRP 31.A N GLY 27.A O no hydrogen 2.861 N/A ILE 32.A N TYR 28.A O no hydrogen 3.010 N/A THR 33.A N PRO 29.A O no hydrogen 2.824 N/A THR 33.A OG1 PRO 29.A O no hydrogen 2.799 N/A LYS 34.A N ASN 30.A O no hydrogen 2.866 N/A VAL 35.A N ASN 30.A O no hydrogen 2.952 N/A ILE 36.A N TRP 31.A O no hydrogen 2.940 N/A MET 38.A N LYS 34.A O no hydrogen 2.962 N/A LEU 39.A N VAL 35.A O no hydrogen 2.893 N/A ASN 40.A N ILE 36.A O no hydrogen 2.943 N/A GLY 41.A N PRO 37.A O no hydrogen 2.927 N/A LEU 42.A N MET 38.A O no hydrogen 2.883 N/A ILE 43.A N LEU 39.A O no hydrogen 2.920 N/A ASN 44.A N ASN 40.A O no hydrogen 2.913 N/A SER 45.A N LEU 42.A O no hydrogen 2.975 N/A SER 45.A OG LEU 42.A O no hydrogen 2.565 N/A LEU 46.A N ILE 43.A O no hydrogen 2.984 N/A LEU 48.A N LEU 46.A O no hydrogen 2.933 N/A SER 49.A N ILE 53.A O no hydrogen 3.113 N/A SER 49.A OG THR 52.A OG1 no hydrogen 2.698 N/A ARG 50.A NH1 GLY 71.A O no hydrogen 2.840 N/A THR 52.A N SER 49.A O no hydrogen 3.308 N/A THR 52.A N SER 49.A OG no hydrogen 3.285 N/A THR 52.A OG1 SER 47.A O no hydrogen 3.408 N/A THR 52.A OG1 SER 49.A OG no hydrogen 2.698 N/A ASN 54.A N VAL 14.A O no hydrogen 2.871 N/A LEU 55.A N SER 75.A O no hydrogen 2.923 N/A TYR 56.A N LEU 16.A O no hydrogen 2.771 N/A MET 57.A N ILE 68.A O no hydrogen 3.042 N/A ASN 58.A N LEU 18.A O no hydrogen 2.863 N/A ASN 58.A ND2 TYR 56.A OH no hydrogen 2.938 N/A LEU 59.A N THR 65.A O no hydrogen 2.831 N/A PHE 60.A N VAL 20.A O no hydrogen 2.842 N/A GLY 61.A N TYR 63.A O no hydrogen 2.763 N/A THR 65.A N LEU 59.A O no hydrogen 2.776 N/A LEU 67.A N MET 57.A O no hydrogen 2.795 N/A ILE 68.A N MET 57.A O no hydrogen 3.155 N/A ARG 69.A NH1 GLU 66.A OE2 no hydrogen 2.959 N/A GLY 71.A N SER 75.A OG no hydrogen 2.988 N/A SER 72.A N ARG 69.A O no hydrogen 3.268 N/A SER 72.A OG ARG 69.A O no hydrogen 3.044 N/A GLN 74.A NE2 GLN 80.A O.A no hydrogen 3.131 N/A GLN 74.A NE2 GLN 80.A O.B no hydrogen 3.137 N/A SER 75.A N SER 72.A O no hydrogen 2.891 N/A SER 75.A OG LEU 55.A O no hydrogen 2.602 N/A ILE 76.A N SER 72.A O no hydrogen 3.147 N/A ILE 76.A N GLY 73.A O no hydrogen 3.332 N/A LYS 78.A NZ ASN 44.A O no hydrogen 2.882 N/A ARG 79.A N ASP 77.A OD1 no hydrogen 2.952 N/A GLN 80.A N.B ASP 77.A O no hydrogen 3.007 N/A GLN 80.A NE2.A ASP 77.A OD2 no hydrogen 3.192 N/A ALA 81.A N ASP 77.A O no hydrogen 3.047 N/A LEU 82.A N LYS 78.A O no hydrogen 2.912 N/A SER 83.A N ARG 79.A O no hydrogen 3.199 N/A SER 83.A OG ARG 79.A O no hydrogen 3.356 N/A LYS 84.A N ALA 81.A O no hydrogen 3.081 N/A LYS 84.A NZ GLU 87.A OE1 no hydrogen 2.955 N/A VAL 85.A N ALA 81.A O no hydrogen 3.438 N/A THR 86.A N LEU 82.A O no hydrogen 3.141 N/A THR 86.A OG1 LEU 82.A O no hydrogen 3.387 N/A GLU 87.A N SER 83.A O no hydrogen 2.938 N/A LEU 88.A N LYS 84.A O no hydrogen 2.963 N/A ARG 89.A N VAL 85.A O no hydrogen 2.884 N/A LYS 90.A N THR 86.A O no hydrogen 3.056 N/A LYS 90.A N GLU 87.A O no hydrogen 3.233 N/A THR 91.A N GLU 87.A O no hydrogen 2.973 N/A THR 91.A OG1 GLU 87.A O no hydrogen 2.669 N/A TYR 92.A N LEU 88.A O no hydrogen 2.950 N/A TYR 92.A OH GLY 22.A O no hydrogen 2.582 N/A TYR 95.A N GLY 22.A O no hydrogen 3.232 N/A THR 97.A N SER 62.A OG no hydrogen 3.059 N/A THR 98.A N ASN 133.A OD1 no hydrogen 2.709 N/A THR 98.A OG1 SER 23.A OG no hydrogen 3.080 N/A THR 98.A OG1 VAL 131.A O no hydrogen 3.524 N/A SER 99.A N GLY 61.A O no hydrogen 2.811 N/A SER 99.A OG GLY 61.A O no hydrogen 2.915 N/A SER 99.A OG SER 62.A O no hydrogen 2.931 N/A MET 100.A N THR 98.A O no hydrogen 2.794 N/A ALA 103.A N SER 99.A O no hydrogen 3.137 N/A LEU 104.A N MET 100.A O no hydrogen 3.038 N/A ASP 105.A N THR 101.A O no hydrogen 2.866 N/A GLU 106.A N ALA 102.A O no hydrogen 3.097 N/A GLU 106.A N ALA 103.A O no hydrogen 3.143 N/A GLN 108.A N LEU 104.A O no hydrogen 3.238 N/A LYS 109.A N ASP 105.A O no hydrogen 2.907 N/A LYS 109.A NZ ASP 113.A OD2 no hydrogen 2.871 N/A HIS 110.A N GLU 106.A O no hydrogen 3.160 N/A HIS 110.A ND1 GLU 106.A O no hydrogen 2.657 N/A LEU 111.A N VAL 107.A O no hydrogen 3.185 N/A ASN 112.A N GLN 108.A O no hydrogen 2.849 N/A ASP 113.A N LYS 109.A O no hydrogen 2.818 N/A ARG 114.A N LEU 111.A O no hydrogen 3.155 N/A VAL 115.A N HIS 110.A O no hydrogen 2.963 N/A ASN 116.A ND2 ARG 117.A O no hydrogen 3.506 N/A ARG 117.A N ASP 15.A OD2 no hydrogen 2.805 N/A ARG 117.A NE ASP 15.A OD1 no hydrogen 2.939 N/A ARG 117.A NH1 ASP 15.A OD1 no hydrogen 2.877 N/A ARG 117.A NH1 THR 52.A O no hydrogen 2.821 N/A ARG 117.A NH2 THR 52.A O no hydrogen 3.058 N/A ALA 120.A N ARG 117.A O no hydrogen 2.984 N/A ILE 121.A N GLN 13.A O no hydrogen 2.983 N/A GLN 122.A NE2 ASP 15.A OD2 no hydrogen 2.850 N/A GLN 122.A NE2 ALA 120.A O no hydrogen 3.062 N/A LEU 123.A N ASP 15.A O no hydrogen 2.932 N/A VAL 124.A N ARG 151.A O no hydrogen 2.773 N/A ILE 125.A N TYR 17.A O no hydrogen 2.815 N/A LEU 126.A N ALA 153.A O no hydrogen 2.822 N/A MET 127.A N LEU 19.A O no hydrogen 2.892 N/A THR 128.A N ILE 155.A O no hydrogen 2.922 N/A THR 128.A OG1 ASP 21.A OD2 no hydrogen 2.850 N/A GLY 130.A N THR 128.A OG1 no hydrogen 2.976 N/A VAL 131.A N ASP 129.A OD1 no hydrogen 3.100 N/A ASN 133.A N THR 98.A O no hydrogen 3.037 N/A ALA 138.A N SER 134.A O no hydrogen 3.116 N/A LEU 139.A N LYS 135.A O no hydrogen 3.054 N/A GLU 140.A N TYR 136.A O no hydrogen 2.925 N/A VAL 141.A N ARG 137.A O no hydrogen 3.224 N/A ALA 142.A N ALA 138.A O no hydrogen 3.073 N/A ASN 143.A N LEU 139.A O no hydrogen 2.880 N/A LYS 144.A N GLU 140.A O no hydrogen 3.032 N/A LEU 145.A N VAL 141.A O no hydrogen 2.978 N/A LYS 146.A N ALA 142.A O no hydrogen 3.008 N/A LYS 146.A NZ ILE 169.A O no hydrogen 2.814 N/A GLN 147.A N ASN 143.A O no hydrogen 3.096 N/A ARG 148.A N LEU 145.A O no hydrogen 2.961 N/A ARG 148.A NH1 GLN 108.A OE1 no hydrogen 2.793 N/A ARG 148.A NH1 ASN 112.A OD1 no hydrogen 2.868 N/A ARG 148.A NH2 ASN 112.A OD1 no hydrogen 2.941 N/A ASN 149.A N LYS 146.A O no hydrogen 2.935 N/A VAL 150.A N LEU 145.A O no hydrogen 3.149 N/A ARG 151.A N GLN 122.A O no hydrogen 2.880 N/A ALA 153.A N VAL 124.A O no hydrogen 2.855 N/A VAL 154.A N PHE 181.A O no hydrogen 2.734 N/A ILE 155.A N LEU 126.A O no hydrogen 2.845 N/A GLY 156.A N SER 183.A O no hydrogen 2.807 N/A ILE 157.A N THR 128.A O no hydrogen 3.065 N/A GLY 158.A N ASN 30.A OD1 no hydrogen 2.955 N/A GLN 159.A N ILE 26.A O no hydrogen 2.959 N/A GLN 159.A NE2 SER 25.A O no hydrogen 3.237 N/A ASN 162.A N ASP 129.A O no hydrogen 2.718 N/A HIS 163.A ND1 TYR 182.A OH no hydrogen 2.667 N/A PHE 165.A N ASN 162.A OD1 no hydrogen 2.986 N/A ASN 166.A N ASN 162.A O no hydrogen 3.052 N/A ASN 166.A ND2 THR 128.A O no hydrogen 3.312 N/A ASN 166.A ND2 TYR 182.A OH no hydrogen 3.157 N/A ARG 167.A N HIS 163.A O no hydrogen 2.802 N/A ARG 167.A NH2 ARG 173.A O no hydrogen 3.517 N/A LEU 168.A N GLN 164.A O no hydrogen 3.034 N/A ILE 169.A N PHE 165.A O no hydrogen 2.874 N/A ALA 170.A N ASN 166.A O no hydrogen 2.975 N/A GLY 171.A N LEU 168.A O no hydrogen 3.067 N/A CYS 172.A N ARG 167.A O no hydrogen 2.840 N/A TYR 182.A OH HIS 163.A ND1 no hydrogen 2.667 N/A SER 183.A N VAL 154.A O no hydrogen 3.021 N/A ASP 186.A N GLU 189.A OE1 no hydrogen 3.146 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.836 N/A ALA 190.A N ASP 186.A O no hydrogen 3.185 N/A VAL 191.A N TRP 187.A O no hydrogen 2.777 N/A ALA 192.A N ASN 188.A O no hydrogen 3.021 N/A LEU 193.A N GLU 189.A O no hydrogen 2.944 N/A ILE 194.A N ALA 190.A O no hydrogen 3.025 N/A LYS 195.A N VAL 191.A O no hydrogen 3.102 N/A PHE 197.A N ILE 194.A O no hydrogen 2.866 N/A ILE 198.A N LYS 195.A O no hydrogen 3.056 N/A VAL 201.A N CYS 10.A O no hydrogen 3.180 N/A THR 203.A N VAL 9.A O no hydrogen 2.942 N/A VAL 205.A N GLU 7.A O no hydrogen 3.115 N/A ARG 207.A N TYR 5.A O no hydrogen 2.795 N/A ALA 209.A N VAL 3.A O no hydrogen 2.928 N/A ASP 215.A N SER 232.A O no hydrogen 2.861 N/A THR 218.A N SER 230.A O no hydrogen 2.893 N/A THR 218.A OG1 ALA 219.A O no hydrogen 3.476 N/A THR 218.A OG1 SER 230.A O no hydrogen 3.047 N/A SER 221.A N THR 228.A O no hydrogen 2.708 N/A SER 221.A OG THR 228.A O no hydrogen 3.099 N/A GLY 227.A N CYS 248.A O no hydrogen 2.777 N/A THR 228.A N SER 221.A OG no hydrogen 2.887 N/A HIS 229.A N SER 246.A O no hydrogen 2.980 N/A HIS 229.A ND1 THR 218.A O no hydrogen 3.130 N/A SER 230.A N THR 218.A OG1 no hydrogen 3.065 N/A ARG 231.A N MET 244.A O no hydrogen 3.026 N/A SER 232.A OG HIS 243.A ND1 no hydrogen 2.942 N/A ARG 233.A N THR 242.A O no hydrogen 3.060 N/A ARG 233.A NE THR 241.A O no hydrogen 2.591 N/A ARG 233.A NH1 ASP 1.A OD1 no hydrogen 3.143 N/A ARG 233.A NH1 GLY 212.A O no hydrogen 3.090 N/A ARG 233.A NH2 THR 241.A O no hydrogen 2.997 N/A SER 235.A OG HIS 237.A O no hydrogen 2.662 N/A LYS 239.A N HIS 237.A ND1 no hydrogen 3.036 N/A CYS 240.A N HIS 237.A O no hydrogen 3.276 N/A HIS 243.A ND1 SER 232.A OG no hydrogen 2.942 N/A SER 246.A N HIS 229.A O no hydrogen 3.077 N/A CYS 248.A N GLY 227.A O no hydrogen 2.950 N/A GLU 250.A N GLY 225.A O no hydrogen 3.254 N/A