Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s5o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ PRO 159.A O no hydrogen 3.223 N/A ILE 4.A N GLN 186.A OE1 no hydrogen 2.896 N/A ALA 5.A N ASP 3.A OD1 no hydrogen 2.949 N/A GLY 6.A N VAL 204.A O no hydrogen 2.919 N/A TYR 8.A N GLY 206.A O no hydrogen 2.895 N/A TYR 8.A OH ILE 4.A O no hydrogen 2.677 N/A VAL 11.A N VAL 42.A O no hydrogen 2.850 N/A THR 13.A OG1 GLY 48.A O no hydrogen 2.653 N/A THR 16.A N GLU 20.A O no hydrogen 2.684 N/A THR 16.A OG1 THR 18.A OG1 no hydrogen 3.113 N/A THR 18.A N THR 16.A OG1 no hydrogen 3.183 N/A THR 18.A OG1 THR 16.A OG1 no hydrogen 3.113 N/A ALA 19.A N THR 16.A O no hydrogen 2.866 N/A GLU 20.A N THR 16.A OG1 no hydrogen 3.201 N/A ASP 22.A N PRO 14.A O no hydrogen 2.876 N/A LYS 25.A N ASP 22.A OD1 no hydrogen 3.015 N/A LEU 26.A N ASP 22.A O no hydrogen 2.964 N/A GLU 27.A N TYR 23.A O no hydrogen 2.944 N/A GLU 28.A N GLY 24.A O no hydrogen 2.999 N/A ASN 29.A N LYS 25.A O no hydrogen 2.861 N/A ASN 29.A ND2 TYR 266.A O no hydrogen 2.848 N/A LEU 30.A N LEU 26.A O no hydrogen 2.963 N/A HIS 31.A N GLU 27.A O no hydrogen 2.959 N/A HIS 31.A NE2.A GLU 27.A OE1 no hydrogen 3.196 N/A LYS 32.A N GLU 28.A O no hydrogen 3.107 N/A LYS 32.A NZ GLY 264.A O no hydrogen 2.819 N/A LEU 33.A N ASN 29.A O no hydrogen 2.872 N/A GLY 34.A N LEU 30.A O no hydrogen 2.843 N/A THR 35.A N LYS 32.A O no hydrogen 3.234 N/A THR 35.A OG1 LYS 32.A O no hydrogen 2.848 N/A PHE 36.A N LEU 33.A O no hydrogen 3.173 N/A PHE 38.A N PHE 36.A O no hydrogen 2.786 N/A ARG 39.A N ILE 7.A O no hydrogen 2.816 N/A ARG 39.A NE ASP 3.A O no hydrogen 3.108 N/A ARG 39.A NH1 ARG 39.A O no hydrogen 3.556 N/A ARG 39.A NH1 ASN 72.A O no hydrogen 3.358 N/A ARG 39.A NH2 ASP 3.A O no hydrogen 2.996 N/A PHE 41.A N LEU 74.A O no hydrogen 3.020 N/A VAL 42.A N PRO 9.A O no hydrogen 3.102 N/A VAL 43.A N LEU 76.A O no hydrogen 2.943 N/A GLN 44.A NE2 THR 13.A OG1 no hydrogen 3.158 N/A SER 46.A OG TYR 137.A OH no hydrogen 2.712 N/A GLY 48.A N GLY 45.A O no hydrogen 2.911 N/A GLU 49.A N SER 46.A O no hydrogen 3.186 N/A PHE 52.A N GLU 49.A O no hydrogen 2.846 N/A LEU 53.A N PHE 50.A O no hydrogen 3.193 N/A THR 54.A N GLU 57.A OE1 no hydrogen 2.922 N/A GLU 57.A N THR 54.A OG1 no hydrogen 2.942 N/A ARG 58.A N THR 54.A O no hydrogen 2.909 N/A ARG 58.A NE GLY 78.A O no hydrogen 3.219 N/A ARG 58.A NH2 GLY 78.A O no hydrogen 2.955 N/A ARG 58.A NH2 GLY 80.A O no hydrogen 2.876 N/A LEU 59.A N SER 55.A O no hydrogen 3.076 N/A GLU 60.A N SER 56.A O no hydrogen 3.003 N/A VAL 61.A N GLU 57.A O no hydrogen 2.789 N/A VAL 62.A N ARG 58.A O no hydrogen 3.338 N/A SER 63.A N LEU 59.A O no hydrogen 2.992 N/A ARG 64.A N GLU 60.A O no hydrogen 2.877 N/A VAL 65.A N VAL 61.A O no hydrogen 2.932 N/A ARG 66.A N VAL 62.A O no hydrogen 2.967 N/A ARG 66.A NE ARG 66.A O no hydrogen 3.385 N/A ARG 66.A NH1 GLY 98.A O no hydrogen 3.057 N/A ARG 66.A NH1 ASP 100.A OD2 no hydrogen 2.681 N/A ARG 66.A NH2 PRO 70.A O no hydrogen 3.092 N/A ARG 66.A NH2 ARG 73.A O no hydrogen 3.040 N/A GLN 67.A N SER 63.A O no hydrogen 3.225 N/A ALA 68.A N ARG 64.A O no hydrogen 3.065 N/A ALA 68.A N VAL 65.A O no hydrogen 3.040 N/A MET 69.A N ARG 66.A O no hydrogen 3.389 N/A ARG 73.A N PRO 70.A O no hydrogen 3.163 N/A ARG 73.A NH1 PHE 36.A O no hydrogen 3.016 N/A ARG 73.A NH2 GLY 34.A O no hydrogen 3.349 N/A ARG 73.A NH2 PHE 36.A O no hydrogen 2.940 N/A LEU 74.A N ARG 39.A O no hydrogen 2.900 N/A LEU 75.A N ASP 100.A OD2 no hydrogen 2.726 N/A LEU 76.A N PHE 41.A O no hydrogen 2.972 N/A ALA 77.A N ALA 101.A O no hydrogen 2.832 N/A GLY 78.A N VAL 43.A O no hydrogen 2.753 N/A SER 79.A N MET 103.A O no hydrogen 3.216 N/A SER 79.A OG THR 91.A OG1 no hydrogen 2.687 N/A CYS 81.A N THR 87.A OG1 no hydrogen 2.850 N/A CYS 81.A SG SER 79.A O no hydrogen 3.789 N/A THR 84.A OG1 HIS 122.A ND1 no hydrogen 2.752 N/A GLN 85.A NE2 GLU 89.A OE2 no hydrogen 2.768 N/A ALA 86.A N SER 83.A OG no hydrogen 2.998 N/A THR 87.A N SER 83.A O no hydrogen 3.019 N/A THR 87.A OG1 SER 83.A O no hydrogen 2.794 N/A VAL 88.A N THR 84.A O no hydrogen 2.936 N/A GLU 89.A N GLN 85.A O no hydrogen 3.032 N/A MET 90.A N ALA 86.A O no hydrogen 2.951 N/A THR 91.A N THR 87.A O no hydrogen 2.855 N/A THR 91.A OG1 SER 79.A OG no hydrogen 2.687 N/A THR 91.A OG1 THR 87.A O no hydrogen 2.794 N/A VAL 92.A N VAL 88.A O no hydrogen 2.930 N/A SER 93.A N GLU 89.A O no hydrogen 2.985 N/A SER 93.A OG GLU 89.A O no hydrogen 2.838 N/A MET 94.A N MET 90.A O no hydrogen 2.884 N/A ALA 95.A N THR 91.A O no hydrogen 2.935 N/A GLN 96.A N VAL 92.A O no hydrogen 2.976 N/A VAL 97.A N SER 93.A O no hydrogen 3.262 N/A VAL 97.A N MET 94.A O no hydrogen 3.230 N/A GLY 98.A N ALA 95.A O no hydrogen 2.902 N/A ALA 99.A N MET 94.A O no hydrogen 3.025 N/A ASP 100.A N LEU 75.A O no hydrogen 2.840 N/A ALA 101.A N LEU 75.A O no hydrogen 3.273 N/A ALA 102.A N PRO 133.A O no hydrogen 2.915 N/A MET 103.A N ALA 77.A O no hydrogen 2.824 N/A VAL 104.A N VAL 135.A O no hydrogen 2.887 N/A THR 106.A N TYR 137.A O no hydrogen 3.270 N/A CYS 108.A N GLU 82.A OE1 no hydrogen 3.340 N/A CYS 108.A N GLU 82.A OE2 no hydrogen 2.942 N/A CYS 108.A SG GLU 82.A OE2 no hydrogen 3.741 N/A TYR 109.A N GLU 82.A OE1 no hydrogen 3.164 N/A TYR 109.A N GLU 82.A OE2 no hydrogen 3.364 N/A ARG 113.A N TYR 110.A O no hydrogen 2.856 N/A MET 114.A N ARG 111.A O no hydrogen 3.042 N/A SER 116.A OG ASP 150.A OD1 no hydrogen 2.707 N/A ALA 118.A N SER 115.A OG no hydrogen 3.010 N/A LEU 119.A N SER 115.A O no hydrogen 3.029 N/A ILE 120.A N SER 116.A O no hydrogen 2.797 N/A HIS 121.A N ALA 117.A O no hydrogen 2.901 N/A HIS 122.A N ALA 118.A O no hydrogen 2.899 N/A HIS 122.A ND1 THR 84.A OG1 no hydrogen 2.752 N/A TYR 123.A N LEU 119.A O no hydrogen 2.944 N/A TYR 123.A OH VAL 104.A O no hydrogen 2.681 N/A THR 124.A N ILE 120.A O no hydrogen 2.861 N/A THR 124.A OG1 ILE 120.A O no hydrogen 2.728 N/A LYS 125.A N HIS 121.A O no hydrogen 3.032 N/A VAL 126.A N HIS 122.A O no hydrogen 3.111 N/A ALA 127.A N TYR 123.A O no hydrogen 2.847 N/A ASP 128.A N THR 124.A O no hydrogen 2.811 N/A LEU 129.A N LYS 125.A O no hydrogen 3.013 N/A LEU 129.A N VAL 126.A O no hydrogen 3.168 N/A SER 130.A OG ILE 132.A O no hydrogen 2.617 N/A ILE 132.A N SER 130.A OG no hydrogen 3.122 N/A VAL 134.A N ASN 160.A O no hydrogen 2.820 N/A VAL 135.A N ALA 102.A O no hydrogen 2.705 N/A LEU 136.A N GLY 163.A O no hydrogen 2.913 N/A TYR 137.A OH SER 46.A OG no hydrogen 2.712 N/A ASN 142.A N VAL 139.A O no hydrogen 3.028 N/A THR 143.A N VAL 139.A O no hydrogen 3.011 N/A THR 143.A OG1 VAL 139.A O no hydrogen 3.100 N/A THR 143.A OG1 LEU 145.A O no hydrogen 3.000 N/A GLY 144.A N PRO 140.A O no hydrogen 2.778 N/A LEU 145.A N THR 143.A OG1 no hydrogen 3.089 N/A LEU 147.A N SER 138.A OG no hydrogen 3.003 N/A VAL 152.A N PRO 148.A O no hydrogen 2.989 N/A VAL 153.A N VAL 149.A O no hydrogen 2.930 N/A THR 154.A N ASP 150.A O no hydrogen 3.057 N/A THR 154.A OG1 ASP 150.A O no hydrogen 3.172 N/A LEU 155.A N ALA 151.A O no hydrogen 2.871 N/A SER 156.A N VAL 152.A O no hydrogen 2.879 N/A SER 156.A N VAL 153.A O no hydrogen 3.251 N/A SER 156.A OG VAL 153.A O no hydrogen 2.647 N/A GLN 157.A N THR 154.A O no hydrogen 3.227 N/A HIS 158.A N LEU 155.A O no hydrogen 2.950 N/A HIS 158.A NE2 ASP 128.A OD1 no hydrogen 2.733 N/A ASN 160.A N HIS 158.A ND1 no hydrogen 2.891 N/A ASN 160.A ND2 ALA 127.A O no hydrogen 2.891 N/A ASN 160.A ND2 SER 130.A O no hydrogen 3.168 N/A ASN 160.A ND2 ILE 132.A O no hydrogen 3.150 N/A ILE 161.A N HIS 158.A O no hydrogen 3.218 N/A VAL 162.A N VAL 134.A O no hydrogen 2.986 N/A MET 164.A N GLN 186.A O no hydrogen 2.957 N/A SER 166.A N SER 138.A O no hydrogen 2.893 N/A GLY 167.A N ASP 165.A OD1 no hydrogen 2.901 N/A ARG 172.A N ASP 169.A OD1 no hydrogen 3.122 N/A ARG 172.A NE ASP 165.A OD2 no hydrogen 2.631 N/A ARG 172.A NH1 LEU 147.A O no hydrogen 2.889 N/A ARG 172.A NH2 LEU 147.A O no hydrogen 2.845 N/A ARG 172.A NH2 ASP 165.A OD2 no hydrogen 2.910 N/A ILE 173.A N ASP 169.A O no hydrogen 2.954 N/A GLY 174.A N VAL 170.A O no hydrogen 2.934 N/A LEU 175.A N THR 171.A O no hydrogen 2.957 N/A ILE 176.A N ARG 172.A O no hydrogen 2.932 N/A VAL 177.A N ILE 173.A O no hydrogen 2.937 N/A HIS 178.A N GLY 174.A O no hydrogen 2.959 N/A LYS 179.A N LEU 175.A O no hydrogen 2.794 N/A THR 180.A N ILE 176.A O no hydrogen 3.001 N/A THR 180.A OG1 ILE 176.A O no hydrogen 2.775 N/A THR 180.A OG1 VAL 177.A O no hydrogen 3.412 N/A ARG 181.A N HIS 178.A O no hydrogen 3.343 N/A ARG 181.A NH1 HIS 178.A O no hydrogen 2.751 N/A GLN 183.A N THR 180.A O no hydrogen 2.890 N/A GLN 186.A N VAL 162.A O no hydrogen 2.946 N/A GLN 186.A NE2 ASP 3.A OD1 no hydrogen 2.917 N/A LEU 188.A N MET 164.A O no hydrogen 2.714 N/A ALA 189.A N GLY 205.A O no hydrogen 2.885 N/A SER 191.A OG.B ASN 244.A OD1 no hydrogen 3.310 N/A ALA 192.A N ASN 244.A OD1 no hydrogen 3.216 N/A GLY 193.A N SER 191.A OG.A no hydrogen 2.963 N/A MET 196.A N GLN 237.A OE1 no hydrogen 2.864 N/A SER 198.A N PHE 194.A O no hydrogen 3.016 N/A SER 198.A OG PHE 194.A O no hydrogen 2.766 N/A TYR 199.A N LEU 195.A O no hydrogen 2.993 N/A TYR 199.A OH GLU 222.A OE2 no hydrogen 2.952 N/A ALA 200.A N MET 196.A O no hydrogen 2.913 N/A LEU 201.A N ALA 197.A O no hydrogen 2.998 N/A GLY 202.A N TYR 199.A O no hydrogen 2.993 N/A ALA 203.A N SER 198.A O no hydrogen 2.837 N/A VAL 204.A N VAL 187.A O no hydrogen 2.834 N/A GLY 206.A N GLY 6.A O no hydrogen 2.976 N/A VAL 207.A N ALA 189.A O no hydrogen 2.794 N/A CYS 208.A N TYR 8.A O no hydrogen 2.952 N/A ALA 211.A N CYS 208.A O no hydrogen 2.849 N/A ASN 212.A N ALA 209.A O no hydrogen 3.046 N/A ASN 212.A ND2 PRO 10.A O no hydrogen 2.965 N/A ASN 212.A ND2 ALA 209.A O no hydrogen 3.060 N/A VAL 213.A N LEU 210.A O no hydrogen 3.045 N/A LEU 214.A N LEU 210.A O no hydrogen 2.834 N/A GLN 217.A N GLN 217.A OE1 no hydrogen 2.733 N/A VAL 218.A N LEU 214.A O no hydrogen 3.046 N/A CYS 219.A N GLY 215.A O no hydrogen 3.022 N/A CYS 219.A SG GLY 215.A O no hydrogen 3.378 N/A GLN 220.A N ALA 216.A O no hydrogen 2.798 N/A LEU 221.A N GLN 217.A O no hydrogen 2.852 N/A GLU 222.A N VAL 218.A O no hydrogen 2.993 N/A ARG 223.A N CYS 219.A O no hydrogen 2.964 N/A ARG 223.A NE GLN 220.A OE1 no hydrogen 3.223 N/A ARG 223.A NH1 GLN 220.A OE1 no hydrogen 3.002 N/A LEU 224.A N GLN 220.A O no hydrogen 2.876 N/A CYS 225.A N LEU 221.A O no hydrogen 3.046 N/A CYS 225.A SG LEU 221.A O no hydrogen 3.406 N/A CYS 226.A N GLU 222.A O no hydrogen 2.850 N/A CYS 226.A SG GLU 222.A O no hydrogen 3.336 N/A THR 227.A N ARG 223.A O no hydrogen 3.038 N/A THR 227.A OG1 ARG 223.A O no hydrogen 2.827 N/A THR 227.A OG1 LEU 224.A O no hydrogen 3.473 N/A THR 227.A OG1 GLN 229.A OE1 no hydrogen 2.915 N/A GLY 228.A N CYS 225.A O no hydrogen 3.393 N/A GLN 229.A N LEU 224.A O no hydrogen 2.835 N/A ALA 233.A N GLN 229.A O no hydrogen 2.852 N/A GLN 234.A N TRP 230.A O no hydrogen 2.795 N/A LYS 235.A N GLU 231.A O no hydrogen 3.348 N/A LEU 236.A N ASP 232.A O no hydrogen 3.127 N/A GLN 237.A N ALA 233.A O no hydrogen 2.747 N/A GLN 237.A NE2 ALA 192.A O no hydrogen 2.831 N/A GLN 237.A NE2 GLN 237.A O no hydrogen 2.998 N/A HIS 238.A N GLN 234.A O no hydrogen 2.813 N/A ARG 239.A N LYS 235.A O no hydrogen 3.291 N/A ARG 239.A NE ASN 292.A O no hydrogen 3.022 N/A ARG 239.A NH2 ASN 292.A O no hydrogen 2.813 N/A LEU 240.A N LEU 236.A O no hydrogen 3.127 N/A LEU 240.A N GLN 237.A O no hydrogen 3.011 N/A ILE 241.A N HIS 238.A O no hydrogen 3.395 N/A ASN 244.A N LEU 240.A O no hydrogen 2.838 N/A ASN 244.A ND2 SER 191.A OG.A no hydrogen 3.057 N/A ASN 244.A ND2 SER 191.A OG.B no hydrogen 3.105 N/A ALA 245.A N ILE 241.A O no hydrogen 2.859 N/A ALA 246.A N GLU 242.A O no hydrogen 2.883 N/A VAL 247.A N PRO 243.A O no hydrogen 3.307 N/A THR 248.A N ALA 245.A O no hydrogen 3.184 N/A THR 248.A OG1 ASN 244.A O no hydrogen 2.684 N/A ARG 249.A N THR 248.A OG1 no hydrogen 2.676 N/A ARG 250.A N ALA 245.A O no hydrogen 2.836 N/A ARG 250.A NH1 ASP 288.A OD2 no hydrogen 2.787 N/A PHE 251.A N ALA 246.A O no hydrogen 3.007 N/A GLY 252.A N THR 248.A O no hydrogen 2.902 N/A GLY 255.A N PHE 251.A O no hydrogen 2.987 N/A LEU 256.A N GLY 252.A O no hydrogen 2.874 N/A LYS 257.A N ILE 253.A O no hydrogen 2.756 N/A LYS 257.A NZ THR 13.A O no hydrogen 2.802 N/A LYS 257.A NZ GLU 49.A OE2 no hydrogen 2.701 N/A LYS 257.A NZ PRO 269.A O no hydrogen 2.891 N/A LYS 258.A N PRO 254.A O no hydrogen 3.108 N/A LYS 258.A NZ GLU 282.A OE1 no hydrogen 3.155 N/A ILE 259.A N GLY 255.A O no hydrogen 3.014 N/A MET 260.A N LEU 256.A O no hydrogen 2.899 N/A ASP 261.A N LYS 257.A O no hydrogen 2.951 N/A TRP 262.A N LYS 258.A O no hydrogen 3.048 N/A PHE 263.A N ILE 259.A O no hydrogen 2.895 N/A PHE 263.A N MET 260.A O no hydrogen 3.152 N/A GLY 264.A N ASP 261.A O no hydrogen 3.076 N/A TYR 265.A N MET 260.A O no hydrogen 2.891 N/A TYR 266.A N ASN 29.A OD1 no hydrogen 2.973 N/A TYR 266.A OH PHE 15.A O no hydrogen 2.818 N/A GLY 267.A N ASP 261.A OD1 no hydrogen 2.850 N/A GLY 268.A N ASP 261.A OD1 no hydrogen 2.948 N/A ARG 271.A N GLU 49.A OE1 no hydrogen 2.795 N/A ARG 271.A NE ALA 19.A O no hydrogen 2.893 N/A ARG 271.A NH1 PHE 52.A O no hydrogen 2.845 N/A ARG 271.A NH1 GLU 57.A OE1 no hydrogen 2.880 N/A ARG 271.A NH2 ALA 19.A O no hydrogen 2.834 N/A ARG 271.A NH2 GLU 57.A OE2 no hydrogen 2.763 N/A LEU 274.A N ARG 271.A O no hydrogen 3.079 N/A SER 278.A N GLU 281.A OE1 no hydrogen 2.837 N/A GLU 281.A N SER 278.A OG no hydrogen 3.190 N/A GLU 282.A N SER 278.A O no hydrogen 2.872 N/A GLU 283.A N PRO 279.A O no hydrogen 2.993 N/A ALA 284.A N ALA 280.A O no hydrogen 2.995 N/A LEU 285.A N GLU 281.A O no hydrogen 2.880 N/A ARG 286.A N GLU 282.A O no hydrogen 2.898 N/A MET 287.A N GLU 283.A O no hydrogen 2.907 N/A ASP 288.A N ALA 284.A O no hydrogen 3.054 N/A PHE 289.A N LEU 285.A O no hydrogen 3.342 N/A PHE 289.A N ARG 286.A O no hydrogen 3.083 N/A THR 290.A N ARG 286.A O no hydrogen 2.862 N/A THR 290.A OG1 ARG 286.A O no hydrogen 3.245 N/A THR 290.A OG1 MET 287.A O no hydrogen 3.359 N/A SER 291.A N MET 287.A O no hydrogen 2.842 N/A SER 291.A OG MET 287.A O no hydrogen 2.663 N/A ASN 292.A N PHE 289.A O no hydrogen 3.287 N/A ASN 292.A ND2 GLU 242.A OE1 no hydrogen 2.876 N/A ASN 292.A ND2 ASP 288.A O no hydrogen 2.829 N/A GLY 293.A N THR 290.A O no hydrogen 3.002 N/A TRP 294.A N PHE 289.A O no hydrogen 2.940 N/A TRP 294.A NE1 ARG 239.A O no hydrogen 2.901 N/A