Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5u4q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 72.A O no hydrogen 2.852 N/A LYS 2.A NZ GLU 72.A OE1 no hydrogen 2.766 N/A PHE 3.A N ASN 26.A O no hydrogen 2.907 N/A LEU 4.A N ARG 76.A O no hydrogen 3.075 N/A VAL 5.A N VAL 28.A O no hydrogen 2.856 N/A THR 6.A N ILE 78.A O no hydrogen 3.091 N/A THR 6.A OG1 HIS 79.A ND1 no hydrogen 2.679 N/A GLY 7.A N ILE 30.A O no hydrogen 2.841 N/A ALA 8.A N ILE 30.A O no hydrogen 3.117 N/A ALA 9.A N ASP 31.A OD2 no hydrogen 3.057 N/A GLY 10.A N GLY 7.A O no hydrogen 2.908 N/A PHE 14.A N GLY 10.A O no hydrogen 2.964 N/A HIS 15.A N PHE 11.A O no hydrogen 3.435 N/A HIS 15.A NE2 PRO 172.A O no hydrogen 2.812 N/A ILE 16.A N ILE 12.A O no hydrogen 2.983 N/A ALA 17.A N GLY 13.A O no hydrogen 2.842 N/A GLN 18.A N PHE 14.A O no hydrogen 2.854 N/A ARG 19.A N.A HIS 15.A O no hydrogen 3.056 N/A ARG 19.A N.B HIS 15.A O no hydrogen 3.056 N/A ARG 19.A NE.A GLU 23.A OE1.A no hydrogen 2.744 N/A ARG 19.A NE.A GLU 23.A OE2.B no hydrogen 2.402 N/A ARG 19.A NH1.A GLU 210.A OE1 no hydrogen 2.809 N/A ARG 19.A NH2.A GLU 23.A OE1.A no hydrogen 3.278 N/A ARG 19.A NH2.A GLU 23.A OE2.B no hydrogen 2.641 N/A ARG 19.A NH2.A GLU 210.A OE1 no hydrogen 2.954 N/A LEU 20.A N ILE 16.A O no hydrogen 2.987 N/A LEU 21.A N ALA 17.A O no hydrogen 2.918 N/A ASN 22.A N GLN 18.A O no hydrogen 2.942 N/A GLU 23.A N.A ARG 19.A O.A no hydrogen 3.020 N/A GLU 23.A N.A ARG 19.A O.B no hydrogen 2.991 N/A GLU 23.A N.A LEU 20.A O no hydrogen 3.182 N/A GLU 23.A N.B ARG 19.A O.A no hydrogen 3.012 N/A GLU 23.A N.B ARG 19.A O.B no hydrogen 2.982 N/A GLU 23.A N.B LEU 20.A O no hydrogen 3.163 N/A GLY 24.A N LEU 21.A O no hydrogen 3.053 N/A HIS 25.A N LEU 20.A O no hydrogen 3.129 N/A VAL 27.A N ALA 52.A O no hydrogen 2.924 N/A VAL 28.A N PHE 3.A O no hydrogen 2.907 N/A GLY 29.A N HIS 54.A O no hydrogen 2.900 N/A ILE 30.A N VAL 5.A O no hydrogen 3.112 N/A ASN 32.A ND2 ASP 59.A OD2 no hydrogen 3.012 N/A ASN 33.A ND2 ASN 32.A OD1 no hydrogen 3.266 N/A TYR 35.A N.A ASN 33.A OD1 no hydrogen 2.926 N/A TYR 35.A N.B ASN 33.A OD1 no hydrogen 2.911 N/A TYR 35.A OH.A ASP 177.A OD2 no hydrogen 2.654 N/A SER 39.A N ASP 37.A OD1 no hydrogen 2.938 N/A SER 39.A OG ASP 37.A OD1 no hydrogen 2.529 N/A LEU 40.A N ASP 37.A O no hydrogen 3.082 N/A LYS 41.A N ASP 37.A O no hydrogen 3.476 N/A LYS 41.A NZ ASN 33.A O no hydrogen 2.792 N/A GLN 42.A N.A VAL 38.A O no hydrogen 2.874 N/A GLN 42.A N.B VAL 38.A O no hydrogen 2.859 N/A ALA 43.A N SER 39.A O no hydrogen 2.968 N/A ARG 44.A N LEU 40.A O no hydrogen 3.006 N/A ARG 44.A NE TRP 173.A O no hydrogen 2.824 N/A ARG 44.A NH1 ALA 9.A O no hydrogen 2.758 N/A ARG 44.A NH1 TYR 36.A OH no hydrogen 2.819 N/A ARG 44.A NH2 TRP 173.A O no hydrogen 2.902 N/A ARG 44.A NH2 GLY 174.A O no hydrogen 2.893 N/A LEU 45.A N.A LYS 41.A O no hydrogen 3.007 N/A LEU 45.A N.B LYS 41.A O no hydrogen 3.040 N/A ASP 46.A N GLN 42.A O.A no hydrogen 2.882 N/A ASP 46.A N GLN 42.A O.B no hydrogen 2.902 N/A ARG 47.A N.A ARG 44.A O no hydrogen 2.980 N/A ARG 47.A N.B ARG 44.A O no hydrogen 2.996 N/A LEU 48.A N LEU 45.A O.A no hydrogen 3.154 N/A LEU 48.A N LEU 45.A O.B no hydrogen 2.816 N/A TYR 50.A OH ASN 22.A OD1 no hydrogen 3.270 N/A PHE 53.A N TYR 50.A O no hydrogen 3.013 N/A HIS 54.A N VAL 27.A O no hydrogen 3.090 N/A GLN 56.A N.A GLY 29.A O no hydrogen 2.975 N/A GLN 56.A N.B GLY 29.A O no hydrogen 2.982 N/A GLN 57.A NE2 ASN 32.A O no hydrogen 3.437 N/A LEU 58.A N ASP 31.A O no hydrogen 3.177 N/A ALA 61.A N ASP 59.A OD1 no hydrogen 3.058 N/A ASP 62.A N ASP 59.A O no hydrogen 3.018 N/A GLU 64.A N.B GLU 64.A OE1.B no hydrogen 2.576 N/A GLY 65.A N ASP 62.A OD1 no hydrogen 2.900 N/A LYS 67.A N GLU 64.A O.A no hydrogen 2.913 N/A LYS 67.A N GLU 64.A O.B no hydrogen 3.013 N/A LEU 68.A N GLY 65.A O no hydrogen 3.041 N/A ALA 70.A N ALA 66.A O no hydrogen 2.834 N/A THR 71.A N LYS 67.A O no hydrogen 2.899 N/A THR 71.A OG1 LYS 67.A O no hydrogen 2.806 N/A THR 71.A OG1 LEU 68.A O no hydrogen 3.346 N/A GLU 72.A N LEU 68.A O no hydrogen 3.050 N/A GLN 73.A N.A PHE 69.A O no hydrogen 3.075 N/A GLN 73.A N.B PHE 69.A O no hydrogen 3.084 N/A GLN 73.A NE2.A ALA 70.A O no hydrogen 2.725 N/A ASP 75.A N LYS 2.A O no hydrogen 2.906 N/A ARG 76.A N LYS 2.A O no hydrogen 3.355 N/A VAL 77.A N HIS 110.A O no hydrogen 2.984 N/A ILE 78.A N LEU 4.A O no hydrogen 2.870 N/A HIS 79.A N VAL 112.A O no hydrogen 2.813 N/A HIS 79.A ND1 THR 6.A OG1 no hydrogen 2.679 N/A LEU 80.A N THR 6.A OG1 no hydrogen 2.882 N/A ALA 81.A N THR 6.A OG1 no hydrogen 2.963 N/A GLN 83.A N ASN 93.A OD1 no hydrogen 2.997 N/A TYR 87.A N ASN 85.A OD1 no hydrogen 3.140 N/A ALA 88.A N ASN 85.A O no hydrogen 3.040 N/A TYR 89.A N PRO 86.A O no hydrogen 3.206 N/A ALA 90.A N PRO 86.A O no hydrogen 3.378 N/A ASP 91.A N TYR 87.A O no hydrogen 2.903 N/A ALA 92.A N ALA 88.A O no hydrogen 2.861 N/A ASN 93.A N TYR 89.A O no hydrogen 2.737 N/A ASN 93.A ND2 GLN 83.A O no hydrogen 3.088 N/A ASN 93.A ND2 THR 143.A OG1 no hydrogen 3.119 N/A LEU 94.A N ALA 90.A O no hydrogen 2.991 N/A LEU 97.A N LEU 94.A O no hydrogen 3.088 N/A ASN 98.A ND2 LEU 60.A O no hydrogen 2.722 N/A ILE 99.A N GLY 95.A O no hydrogen 3.107 N/A LEU 100.A N TYR 96.A O no hydrogen 2.944 N/A GLU 101.A N LEU 97.A O no hydrogen 2.818 N/A GLY 102.A N ASN 98.A O no hydrogen 2.978 N/A CYS 103.A N ILE 99.A O no hydrogen 2.928 N/A CYS 103.A SG ILE 99.A O no hydrogen 3.361 N/A ARG 104.A N LEU 100.A O no hydrogen 2.837 N/A ARG 104.A NH1 GLU 101.A OE2 no hydrogen 2.907 N/A HIS 105.A N GLU 101.A O no hydrogen 2.903 N/A HIS 105.A NE2 GLU 101.A OE1 no hydrogen 2.797 N/A THR 106.A N GLY 102.A O no hydrogen 3.120 N/A THR 106.A OG1 GLY 102.A O no hydrogen 2.734 N/A LYS 107.A N ARG 104.A O no hydrogen 3.380 N/A VAL 108.A N CYS 103.A O no hydrogen 3.015 N/A LYS 109.A N ASP 75.A O no hydrogen 2.972 N/A HIS 110.A ND1 LEU 216.A O no hydrogen 2.932 N/A HIS 110.A NE2 THR 162.A OG1 no hydrogen 2.807 N/A LEU 111.A N PRO 160.A O no hydrogen 2.989 N/A VAL 112.A N VAL 77.A O no hydrogen 2.899 N/A TYR 113.A N THR 162.A O no hydrogen 2.916 N/A ALA 114.A N HIS 79.A O no hydrogen 2.976 N/A SER 115.A N LEU 164.A O no hydrogen 2.729 N/A SER 115.A OG GLU 148.A OE2 no hydrogen 2.623 N/A SER 116.A OG SER 118.A OG no hydrogen 2.821 N/A SER 117.A N PHE 166.A O no hydrogen 2.779 N/A SER 117.A OG PHE 166.A O no hydrogen 3.378 N/A SER 118.A N SER 116.A OG no hydrogen 2.890 N/A SER 118.A OG SER 116.A OG no hydrogen 2.821 N/A VAL 119.A N SER 116.A O no hydrogen 3.172 N/A TYR 120.A N SER 117.A O no hydrogen 3.108 N/A TYR 120.A OH ASN 244.A OD1 no hydrogen 2.639 N/A GLY 121.A N SER 118.A O no hydrogen 3.011 N/A LEU 122.A N HIS 135.A O no hydrogen 3.220 N/A ASN 123.A N TYR 120.A O no hydrogen 2.913 N/A ASN 123.A ND2 SER 132.A O no hydrogen 2.753 N/A LYS 125.A NZ PRO 126.A O no hydrogen 3.150 N/A LYS 125.A NZ ASP 131.A OD1 no hydrogen 2.763 N/A LYS 125.A NZ ASP 131.A OD2 no hydrogen 3.135 N/A PHE 127.A N SER 273.A O no hydrogen 2.746 N/A SER 128.A N ASP 131.A OD2 no hydrogen 2.885 N/A GLU 130.A N SER 128.A OG no hydrogen 2.979 N/A ASP 131.A N SER 128.A O no hydrogen 2.904 N/A ALA 141.A N SER 138.A OG no hydrogen 3.002 N/A ALA 142.A N SER 138.A O no hydrogen 3.040 N/A THR 143.A N LEU 139.A O no hydrogen 2.855 N/A THR 143.A OG1 TYR 140.A O no hydrogen 2.833 N/A LYS 144.A N TYR 140.A O no hydrogen 3.050 N/A LYS 144.A NZ ALA 114.A O no hydrogen 3.011 N/A LYS 145.A N ALA 141.A O no hydrogen 2.987 N/A ALA 146.A N ALA 142.A O no hydrogen 2.879 N/A ASN 147.A N THR 143.A O no hydrogen 2.899 N/A ASN 147.A ND2 ASN 93.A O no hydrogen 2.754 N/A GLU 148.A N LYS 144.A O no hydrogen 3.104 N/A LEU 149.A N LYS 145.A O no hydrogen 2.958 N/A HIS 151.A N GLU 148.A O no hydrogen 2.939 N/A HIS 151.A NE2 SER 236.A OG no hydrogen 2.737 N/A THR 152.A N.A LEU 149.A O no hydrogen 3.123 N/A THR 152.A N.B LEU 149.A O no hydrogen 3.095 N/A THR 152.A OG1.B LEU 149.A O no hydrogen 2.949 N/A TYR 153.A OH GLU 101.A OE2 no hydrogen 2.654 N/A SER 154.A N ALA 150.A O no hydrogen 2.851 N/A SER 154.A OG ALA 150.A O no hydrogen 3.257 N/A SER 154.A OG ILE 159.A O no hydrogen 2.690 N/A SER 154.A OG THR 161.A OG1 no hydrogen 2.806 N/A SER 154.A OG PRO 239.A O no hydrogen 3.201 N/A HIS 155.A N HIS 151.A O no hydrogen 2.877 N/A LEU 156.A N THR 152.A O.A no hydrogen 2.929 N/A LEU 156.A N THR 152.A O.B no hydrogen 2.876 N/A TYR 157.A N TYR 153.A O no hydrogen 2.927 N/A GLY 158.A N SER 154.A O no hydrogen 2.992 N/A THR 161.A N PRO 239.A O no hydrogen 2.949 N/A THR 161.A OG1 SER 154.A OG no hydrogen 2.806 N/A THR 162.A N LEU 111.A O no hydrogen 2.889 N/A THR 162.A OG1 HIS 110.A NE2 no hydrogen 2.807 N/A GLY 163.A N ARG 241.A O.A no hydrogen 2.846 N/A GLY 163.A N ARG 241.A O.B no hydrogen 2.900 N/A LEU 164.A N TYR 113.A O no hydrogen 2.946 N/A ARG 165.A N TYR 243.A O no hydrogen 2.817 N/A ARG 165.A NE GLU 148.A OE2 no hydrogen 2.914 N/A ARG 165.A NH1 TYR 120.A OH no hydrogen 2.953 N/A ARG 165.A NH2 GLU 148.A OE1 no hydrogen 2.785 N/A THR 168.A N ASP 201.A O no hydrogen 3.033 N/A TYR 170.A N THR 203.A O no hydrogen 3.075 N/A ARG 175.A NE ASP 177.A OD1 no hydrogen 3.117 N/A ARG 175.A NH2 ALA 84.A O no hydrogen 2.659 N/A ARG 175.A NH2 ASP 177.A OD2 no hydrogen 3.126 N/A PHE 182.A N ALA 178.A O no hydrogen 3.229 N/A THR 183.A N LEU 179.A O no hydrogen 2.795 N/A THR 183.A OG1 LEU 179.A O no hydrogen 2.849 N/A LYS 184.A N.A PHE 180.A O no hydrogen 2.914 N/A LYS 184.A N.B PHE 180.A O no hydrogen 2.923 N/A ALA 185.A N LYS 181.A O no hydrogen 3.094 N/A GLU 187.A N LYS 184.A O.A no hydrogen 2.949 N/A GLU 187.A N LYS 184.A O.B no hydrogen 3.037 N/A LYS 189.A N ALA 185.A O no hydrogen 2.770 N/A ILE 191.A N GLN 267.A O no hydrogen 2.846 N/A VAL 193.A N ASN 269.A O no hydrogen 2.875 N/A GLY 197.A N TYR 194.A O no hydrogen 2.964 N/A LYS 198.A N ASN 195.A O no hydrogen 2.932 N/A LYS 199.A NZ PRO 250.A O no hydrogen 2.732 N/A LYS 199.A NZ GLU 252.A OE2 no hydrogen 3.195 N/A ARG 200.A NH1 THR 168.A OG1 no hydrogen 2.952 N/A THR 203.A N THR 168.A O no hydrogen 2.884 N/A ILE 205.A N TYR 170.A O no hydrogen 2.835 N/A ASP 207.A N TYR 204.A O no hydrogen 2.968 N/A ILE 208.A N TYR 204.A O no hydrogen 3.213 N/A VAL 209.A N ILE 205.A O no hydrogen 2.904 N/A GLU 210.A N ASP 206.A O no hydrogen 3.023 N/A ALA 211.A N ASP 207.A O no hydrogen 3.185 N/A VAL 212.A N ILE 208.A O no hydrogen 2.899 N/A VAL 213.A N VAL 209.A O no hydrogen 2.937 N/A ARG 214.A N GLU 210.A O no hydrogen 3.109 N/A ARG 214.A NE GLU 210.A OE2 no hydrogen 2.739 N/A ARG 214.A NH1 VAL 283.A O.A no hydrogen 2.998 N/A ARG 214.A NH1 VAL 283.A O.B no hydrogen 3.225 N/A ARG 214.A NH2 GLU 210.A OE2 no hydrogen 3.165 N/A VAL 215.A N ALA 211.A O no hydrogen 2.854 N/A LEU 216.A N VAL 212.A O no hydrogen 2.950 N/A ASP 217.A N ARG 214.A O no hydrogen 3.063 N/A VAL 218.A N VAL 215.A O no hydrogen 2.928 N/A GLN 221.A NE2 ILE 219.A O no hydrogen 3.006 N/A ASN 223.A N SER 237.A O no hydrogen 2.865 N/A ASP 225.A N ASN 223.A OD1 no hydrogen 2.912 N/A TRP 226.A N ASN 223.A O no hydrogen 3.225 N/A TRP 226.A NE1 THR 235.A OG1 no hydrogen 2.794 N/A THR 227.A OG1 SER 230.A OG no hydrogen 2.706 N/A SER 230.A N THR 227.A OG1 no hydrogen 3.022 N/A SER 230.A OG THR 227.A OG1 no hydrogen 2.706 N/A GLY 231.A N VAL 228.A O no hydrogen 3.169 N/A SER 232.A N THR 235.A OG1 no hydrogen 3.131 N/A SER 232.A OG THR 235.A OG1 no hydrogen 3.152 N/A ALA 234.A N SER 232.A OG no hydrogen 3.056 N/A THR 235.A N SER 232.A O no hydrogen 3.374 N/A THR 235.A OG1 SER 232.A O no hydrogen 3.389 N/A THR 235.A OG1 SER 232.A OG no hydrogen 3.152 N/A SER 236.A OG HIS 151.A NE2 no hydrogen 2.737 N/A ALA 238.A N SER 236.A OG no hydrogen 2.898 N/A TYR 240.A N ALA 238.A O no hydrogen 2.792 N/A TYR 240.A OH PRO 233.A O no hydrogen 2.792 N/A ARG 241.A N.A THR 161.A O no hydrogen 2.926 N/A ARG 241.A N.B THR 161.A O no hydrogen 2.919 N/A ARG 241.A NH1.B GLN 221.A O no hydrogen 3.246 N/A ARG 241.A NH2.A TYR 240.A O no hydrogen 2.993 N/A ARG 241.A NH2.B TYR 240.A O no hydrogen 3.021 N/A VAL 242.A N ALA 234.A O no hydrogen 3.042 N/A TYR 243.A N GLY 163.A O no hydrogen 2.915 N/A ASN 244.A ND2 PHE 127.A O no hydrogen 3.099 N/A ASN 244.A ND2 ASP 275.A O no hydrogen 2.926 N/A ILE 245.A N ARG 165.A O no hydrogen 3.090 N/A ASN 247.A N ASP 201.A OD1 no hydrogen 2.775 N/A ASN 247.A ND2 PHE 202.A O no hydrogen 2.995 N/A SER 249.A N ASN 247.A OD1 no hydrogen 2.982 N/A VAL 251.A N SER 249.A OG no hydrogen 3.278 N/A GLU 252.A N ASP 254.A OD2 no hydrogen 3.202 N/A TYR 255.A N LEU 253.A O no hydrogen 3.025 N/A ILE 256.A N LEU 253.A O no hydrogen 3.181 N/A ALA 258.A N ASP 254.A O no hydrogen 3.126 N/A LEU 259.A N TYR 255.A O no hydrogen 2.928 N/A GLU 260.A N ILE 256.A O no hydrogen 2.872 N/A GLU 261.A N THR 257.A O no hydrogen 3.079 N/A ALA 262.A N ALA 258.A O no hydrogen 3.044 N/A LEU 263.A N LEU 259.A O no hydrogen 2.872 N/A ALA 266.A N GLU 260.A OE2 no hydrogen 2.776 N/A LYS 268.A NZ GLU 260.A OE2 no hydrogen 2.730 N/A LYS 268.A NZ ALA 266.A O no hydrogen 2.937 N/A ASN 269.A N ILE 191.A O no hydrogen 2.893 N/A ASP 275.A N PHE 127.A O no hydrogen 2.879 N/A GLN 277.A N ASP 275.A OD1 no hydrogen 2.807 N/A GLN 277.A NE2 ASP 281.A OD2 no hydrogen 2.295 N/A TYR 280.A N THR 276.A O no hydrogen 3.154 N/A ASP 281.A N GLN 277.A O no hydrogen 2.848 N/A LEU 282.A N PRO 278.A O no hydrogen 2.976 N/A VAL 283.A N.A LEU 279.A O no hydrogen 2.982 N/A VAL 283.A N.B LEU 279.A O no hydrogen 2.963 N/A GLY 284.A N.A TYR 280.A O no hydrogen 3.272 N/A GLY 284.A N.B TYR 280.A O no hydrogen 2.850 N/A GLN 288.A N ASP 207.A OD1 no hydrogen 3.154 N/A THR 289.A N ASP 207.A OD2 no hydrogen 3.018 N/A THR 289.A OG1 ASP 207.A OD2 no hydrogen 3.059 N/A ASP 293.A N SER 290.A OG no hydrogen 3.118 N/A GLY 294.A N SER 290.A O no hydrogen 2.813 N/A VAL 295.A N VAL 291.A O no hydrogen 2.855 N/A LYS 296.A N LYS 292.A O no hydrogen 3.263 N/A ASN 297.A N ASP 293.A O no hydrogen 2.835 N/A PHE 298.A N GLY 294.A O no hydrogen 2.967 N/A VAL 299.A N VAL 295.A O no hydrogen 2.973 N/A ASP 300.A N LYS 296.A O no hydrogen 2.948 N/A TRP 301.A N ASN 297.A O no hydrogen 3.099 N/A TYR 302.A N PHE 298.A O no hydrogen 2.854 N/A LYS 303.A N VAL 299.A O no hydrogen 2.908 N/A ASP 304.A N ASP 300.A O no hydrogen 3.372 N/A TYR 305.A N TRP 301.A O no hydrogen 2.859 N/A TYR 306.A N TYR 302.A O no hydrogen 2.920 N/A GLN 307.A N ASP 304.A O no hydrogen 3.334 N/A ILE 308.A N LYS 303.A O no hydrogen 2.909 N/A