Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jih_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N SER 46.A O no hydrogen 2.865 N/A TYR 4.A N LEU 204.A O no hydrogen 2.853 N/A VAL 5.A N SER 48.A O no hydrogen 2.742 N/A GLU 6.A N ASP 96.A OD2 no hydrogen 3.036 N/A THR 7.A N VAL 50.A O no hydrogen 2.773 N/A THR 7.A OG1 VAL 5.A O no hydrogen 3.062 N/A THR 7.A OG1 VAL 50.A O no hydrogen 3.399 N/A MET 8.A N THR 97.A O no hydrogen 2.907 N/A LEU 9.A N LYS 53.A O no hydrogen 2.887 N/A VAL 10.A N ILE 99.A O no hydrogen 2.975 N/A ALA 11.A N LEU 55.A O no hydrogen 2.977 N/A ASP 12.A N PHE 101.A O no hydrogen 3.324 N/A SER 14.A OG ASP 12.A OD1 no hydrogen 2.437 N/A SER 14.A OG ASP 12.A OD2 no hydrogen 3.291 N/A MET 15.A N ASP 12.A OD1 no hydrogen 3.080 N/A ALA 16.A N ASP 12.A O no hydrogen 3.012 N/A GLU 17.A N GLN 13.A O no hydrogen 2.883 N/A PHE 18.A N SER 14.A O no hydrogen 2.955 N/A HIS 19.A N MET 15.A O no hydrogen 2.929 N/A HIS 19.A NE2 ASP 135.A OD1 no hydrogen 2.957 N/A GLY 20.A N ALA 16.A O no hydrogen 2.940 N/A GLY 22.A N HIS 19.A O no hydrogen 3.261 N/A LEU 23.A N GLY 20.A O no hydrogen 3.330 N/A HIS 25.A NE2 SER 222.A OG no hydrogen 2.823 N/A TYR 26.A N GLY 22.A O no hydrogen 3.025 N/A TYR 26.A OH ASP 135.A OD1 no hydrogen 3.337 N/A TYR 26.A OH ASP 135.A OD2 no hydrogen 2.402 N/A LEU 27.A N LEU 23.A O no hydrogen 2.948 N/A LEU 28.A N LYS 24.A O no hydrogen 3.076 N/A THR 29.A N HIS 25.A O no hydrogen 2.889 N/A THR 29.A OG1 HIS 25.A O no hydrogen 2.789 N/A LEU 30.A N TYR 26.A O no hydrogen 3.013 N/A PHE 31.A N LEU 27.A O no hydrogen 2.956 N/A SER 32.A N LEU 28.A O no hydrogen 2.955 N/A SER 32.A OG THR 29.A O no hydrogen 2.793 N/A VAL 33.A N THR 29.A O no hydrogen 3.325 N/A ALA 34.A N LEU 30.A O no hydrogen 3.262 N/A ALA 35.A N PHE 31.A O no hydrogen 2.773 N/A ARG 36.A N SER 32.A O no hydrogen 2.991 N/A ARG 36.A NH2 ASP 217.A O no hydrogen 3.019 N/A LEU 37.A N VAL 33.A O no hydrogen 3.128 N/A TYR 38.A N ALA 34.A O no hydrogen 3.101 N/A TYR 38.A OH ALA 145.A O no hydrogen 2.733 N/A LYS 39.A N ARG 36.A O no hydrogen 3.102 N/A HIS 40.A N LEU 37.A O no hydrogen 3.156 N/A HIS 40.A ND1 SER 42.A OG no hydrogen 3.044 N/A SER 42.A N HIS 40.A ND1 no hydrogen 3.261 N/A SER 42.A OG HIS 40.A ND1 no hydrogen 3.044 N/A ILE 43.A N HIS 40.A O no hydrogen 3.132 N/A ARG 44.A N PRO 41.A O no hydrogen 2.987 N/A ASN 45.A ND2 ILE 43.A O no hydrogen 3.258 N/A ASN 45.A ND2 THR 193.A OG1 no hydrogen 3.101 N/A SER 48.A N ARG 3.A O no hydrogen 2.627 N/A VAL 50.A N VAL 5.A O no hydrogen 3.137 N/A VAL 52.A N THR 7.A O no hydrogen 2.906 N/A LEU 55.A N LEU 9.A O no hydrogen 2.850 N/A ILE 57.A N ALA 11.A O no hydrogen 2.909 N/A LYS 62.A N ASP 59.A O no hydrogen 2.845 N/A GLY 63.A N GLU 60.A O no hydrogen 2.976 N/A THR 67.A N THR 73.A OG1 no hydrogen 2.968 N/A SER 68.A N THR 67.A OG1 no hydrogen 2.780 N/A ALA 70.A N CYS 107.A O no hydrogen 3.023 N/A THR 73.A N ASN 69.A O no hydrogen 2.909 N/A THR 73.A OG1 THR 67.A O no hydrogen 2.572 N/A THR 73.A OG1 ASN 69.A O no hydrogen 2.861 N/A LEU 74.A N ALA 70.A O no hydrogen 2.936 N/A ARG 75.A N ALA 71.A O no hydrogen 2.957 N/A ASN 76.A N LEU 72.A O no hydrogen 2.604 N/A ASN 76.A ND2 GLU 65.A O no hydrogen 2.726 N/A PHE 77.A N THR 73.A O no hydrogen 2.860 N/A CYS 78.A N LEU 74.A O no hydrogen 2.856 N/A CYS 78.A SG SER 127.A O no hydrogen 3.113 N/A ASN 79.A N ARG 75.A O no hydrogen 3.168 N/A TRP 80.A N ASN 76.A O no hydrogen 3.170 N/A TRP 80.A NE1 LYS 62.A O no hydrogen 3.154 N/A GLN 81.A N PHE 77.A O no hydrogen 3.007 N/A GLN 81.A NE2 CYS 78.A O no hydrogen 2.787 N/A GLN 81.A NE2 PRO 126.A O no hydrogen 2.889 N/A LYS 82.A N ASN 79.A O no hydrogen 3.298 N/A GLN 83.A NE2 TRP 80.A O no hydrogen 3.421 N/A HIS 84.A N GLN 81.A O no hydrogen 2.815 N/A ASN 85.A N LYS 82.A O no hydrogen 3.130 N/A ASN 85.A ND2 TYR 95.A O no hydrogen 2.865 N/A ARG 90.A N SER 88.A OG no hydrogen 2.904 N/A GLU 93.A N ASP 91.A OD1 no hydrogen 2.726 N/A HIS 94.A N ASP 91.A O no hydrogen 2.800 N/A HIS 94.A ND1 PRO 86.A O no hydrogen 2.495 N/A TYR 95.A N ASN 85.A OD1 no hydrogen 3.111 N/A TYR 95.A OH GLN 81.A O no hydrogen 2.701 N/A ASP 96.A N GLU 6.A O no hydrogen 2.696 N/A THR 97.A N GLU 6.A O no hydrogen 3.130 N/A THR 97.A OG1 SER 129.A OG no hydrogen 2.639 N/A ALA 98.A N SER 129.A O no hydrogen 3.138 N/A ILE 99.A N MET 8.A O no hydrogen 3.066 N/A LEU 100.A N SER 131.A O no hydrogen 2.975 N/A PHE 101.A N VAL 10.A O no hydrogen 2.971 N/A THR 102.A N ILE 133.A O no hydrogen 2.941 N/A THR 102.A OG1 ASP 12.A OD2 no hydrogen 2.710 N/A ARG 103.A N SER 14.A OG no hydrogen 2.995 N/A ARG 103.A NH1 PHE 231.A O no hydrogen 3.199 N/A ARG 103.A NH2 ASP 135.A OD1 no hydrogen 3.011 N/A ARG 103.A NH2 PHE 231.A O no hydrogen 2.889 N/A GLN 104.A N THR 102.A OG1 no hydrogen 2.801 N/A LEU 106.A N GLU 134.A OE2 no hydrogen 2.885 N/A CYS 107.A N SER 68.A O no hydrogen 2.503 N/A CYS 107.A SG ASP 105.A O no hydrogen 4.039 N/A GLY 108.A N THR 111.A O no hydrogen 2.859 N/A THR 111.A N GLN 110.A OE1 no hydrogen 2.759 N/A ASP 113.A N THR 111.A OG1 no hydrogen 2.994 N/A THR 114.A OG1 THR 111.A O no hydrogen 3.569 N/A MET 117.A N VAL 132.A O no hydrogen 3.011 N/A GLY 121.A N HIS 150.A O no hydrogen 2.635 N/A THR 122.A OG1 ARG 128.A O no hydrogen 2.984 N/A ASP 125.A N THR 122.A O no hydrogen 2.981 N/A SER 127.A N ASP 125.A OD1 no hydrogen 3.058 N/A SER 127.A OG ASP 125.A OD1 no hydrogen 2.624 N/A SER 127.A OG ASP 125.A OD2 no hydrogen 3.290 N/A ARG 128.A N ASP 125.A O no hydrogen 2.962 N/A SER 129.A N ASP 125.A O no hydrogen 2.691 N/A SER 129.A OG ASP 96.A O no hydrogen 2.615 N/A SER 129.A OG THR 97.A OG1 no hydrogen 2.639 N/A SER 129.A OG VAL 123.A O no hydrogen 3.126 N/A SER 131.A N ALA 98.A O no hydrogen 3.177 N/A VAL 132.A N MET 117.A O no hydrogen 2.899 N/A ILE 133.A N LEU 100.A O no hydrogen 2.608 N/A GLU 134.A N LEU 115.A O no hydrogen 2.918 N/A ASP 135.A N THR 102.A O no hydrogen 2.711 N/A GLY 137.A N ASP 135.A OD2 no hydrogen 3.003 N/A GLN 139.A N GLN 139.A OE1 no hydrogen 2.567 N/A GLN 139.A NE2 THR 232.A OG1 no hydrogen 3.344 N/A ALA 140.A N GLY 137.A O no hydrogen 2.950 N/A ALA 141.A N LEU 138.A O no hydrogen 3.281 N/A PHE 142.A N GLN 139.A O no hydrogen 2.802 N/A THR 143.A N GLN 139.A O no hydrogen 3.242 N/A THR 144.A N ALA 140.A O no hydrogen 2.744 N/A THR 144.A OG1 ALA 140.A O no hydrogen 2.647 N/A ALA 145.A N ALA 141.A O no hydrogen 3.137 N/A HIS 146.A N PHE 142.A O no hydrogen 2.834 N/A HIS 146.A ND1 MET 170.A O no hydrogen 2.886 N/A GLU 147.A N THR 143.A O no hydrogen 2.949 N/A LEU 148.A N THR 144.A O no hydrogen 2.934 N/A GLY 149.A N ALA 145.A O no hydrogen 3.119 N/A GLY 149.A N HIS 146.A O no hydrogen 2.935 N/A HIS 150.A N HIS 146.A O no hydrogen 3.452 N/A HIS 150.A ND1 MET 154.A O no hydrogen 3.066 N/A VAL 151.A N GLU 147.A O no hydrogen 3.351 N/A PHE 152.A N LEU 148.A O no hydrogen 3.085 N/A ASN 153.A N HIS 150.A O no hydrogen 2.698 N/A MET 154.A N GLY 149.A O no hydrogen 3.060 N/A ASP 157.A N MET 171.A O no hydrogen 2.978 N/A ALA 159.A N HIS 156.A O no hydrogen 3.244 N/A GLN 161.A N GLN 161.A OE1 no hydrogen 3.012 N/A CYS 162.A N ALA 159.A O no hydrogen 2.838 N/A CYS 162.A SG HIS 156.A O no hydrogen 3.441 N/A ALA 163.A N LYS 160.A O no hydrogen 3.128 N/A ASN 166.A N CYS 162.A O no hydrogen 2.941 N/A ASN 166.A ND2 ASP 157.A O no hydrogen 3.187 N/A ASN 166.A ND2 ASP 157.A OD1 no hydrogen 3.305 N/A MET 170.A N PRO 183.A O no hydrogen 2.759 N/A ALA 172.A N HIS 169.A O no hydrogen 3.323 N/A SER 173.A OG ASP 158.A OD1 no hydrogen 2.908 N/A SER 176.A OG ASP 167.A OD2 no hydrogen 2.864 N/A ASP 179.A N SER 168.A O no hydrogen 2.819 N/A SER 181.A N ASP 179.A OD1 no hydrogen 3.148 N/A SER 181.A OG ASP 179.A OD1 no hydrogen 2.834 N/A GLN 182.A N ASP 179.A O no hydrogen 2.975 N/A GLN 182.A N ASP 179.A OD1 no hydrogen 3.311 N/A TRP 184.A N SER 42.A OG no hydrogen 3.303 N/A TRP 184.A NE1 LEU 37.A O no hydrogen 2.938 N/A SER 185.A OG ASP 157.A OD1 no hydrogen 2.424 N/A SER 185.A OG ASP 157.A OD2 no hydrogen 3.402 N/A SER 185.A OG SER 188.A OG no hydrogen 3.194 N/A CYS 187.A N ASN 166.A OD1 no hydrogen 2.980 N/A SER 188.A N SER 185.A OG no hydrogen 2.964 N/A SER 188.A OG SER 185.A OG no hydrogen 3.194 N/A ALA 189.A N SER 185.A O no hydrogen 3.007 N/A TYR 190.A N PRO 186.A O no hydrogen 3.215 N/A MET 191.A N CYS 187.A O no hydrogen 2.916 N/A ILE 192.A N SER 188.A O no hydrogen 3.201 N/A THR 193.A N ALA 189.A O no hydrogen 3.143 N/A THR 193.A OG1 ALA 189.A O no hydrogen 2.455 N/A SER 194.A N TYR 190.A O no hydrogen 2.822 N/A SER 194.A OG TYR 190.A O no hydrogen 2.865 N/A PHE 195.A N MET 191.A O no hydrogen 3.265 N/A LEU 196.A N ILE 192.A O no hydrogen 3.144 N/A ASP 197.A N THR 193.A O no hydrogen 2.891 N/A ASN 198.A N SER 194.A O no hydrogen 2.783 N/A GLY 199.A N LEU 196.A O no hydrogen 2.876 N/A HIS 200.A N PHE 195.A O no hydrogen 3.080 N/A CYS 203.A SG ASP 96.A OD1 no hydrogen 3.497 N/A CYS 203.A SG VAL 123.A O no hydrogen 4.019 N/A LEU 204.A N GLY 201.A O no hydrogen 3.085 N/A MET 205.A N GLU 202.A O no hydrogen 3.431 N/A GLN 209.A NE2 ARG 90.A O no hydrogen 2.882 N/A ILE 212.A N VAL 51.A O no hydrogen 2.737 N/A GLY 220.A N ASP 263.A O no hydrogen 3.042 N/A THR 221.A N LEU 218.A O no hydrogen 3.008 N/A SER 222.A OG HIS 25.A NE2 no hydrogen 2.823 N/A TYR 223.A N PRO 219.A O no hydrogen 2.942 N/A ARG 227.A N ASP 224.A OD2 no hydrogen 2.904 N/A ARG 227.A NH1 GLN 230.A OE1 no hydrogen 3.143 N/A GLN 228.A N ASP 224.A O no hydrogen 2.957 N/A GLN 228.A NE2 TYR 223.A O no hydrogen 2.579 N/A GLN 228.A NE2 THR 265.A OG1 no hydrogen 2.943 N/A CYS 229.A N ALA 225.A O no hydrogen 3.027 N/A CYS 229.A SG ALA 225.A O no hydrogen 3.612 N/A CYS 229.A SG TRP 247.A O no hydrogen 3.593 N/A GLN 230.A N ASN 226.A O no hydrogen 2.959 N/A GLN 230.A NE2 GLU 235.A O no hydrogen 2.946 N/A PHE 231.A N ARG 227.A O no hydrogen 2.926 N/A THR 232.A N GLN 228.A O no hydrogen 3.146 N/A THR 232.A OG1 ASP 136.A O no hydrogen 3.082 N/A THR 232.A OG1 GLN 228.A O no hydrogen 3.354 N/A PHE 233.A N CYS 229.A O no hydrogen 2.780 N/A GLY 234.A N GLN 230.A O no hydrogen 2.854 N/A SER 237.A N GLY 234.A O no hydrogen 3.092 N/A SER 237.A OG THR 249.A O no hydrogen 2.862 N/A LYS 238.A N THR 249.A OG1 no hydrogen 2.807 N/A HIS 239.A N ASN 226.A OD1 no hydrogen 2.929 N/A CYS 240.A N TRP 247.A O no hydrogen 3.051 N/A LEU 246.A N PHE 259.A O no hydrogen 2.877 N/A CYS 248.A N GLN 255.A O no hydrogen 2.835 N/A THR 249.A N LYS 238.A O no hydrogen 2.826 N/A THR 249.A OG1 LYS 238.A O no hydrogen 2.908 N/A GLY 250.A N VAL 253.A O no hydrogen 2.822 N/A GLN 255.A N CYS 248.A O no hydrogen 2.688 N/A GLN 255.A NE2 THR 249.A O no hydrogen 3.326 N/A THR 256.A OG1 LEU 246.A O no hydrogen 2.557 N/A LYS 257.A NZ ASP 136.A OD2 no hydrogen 2.639 N/A HIS 258.A N THR 256.A OG1 no hydrogen 3.010 N/A TRP 261.A N CYS 243.A O no hydrogen 3.177 N/A TRP 261.A NE1 THR 245.A O no hydrogen 3.022 N/A ALA 262.A N GLN 228.A OE1 no hydrogen 2.949 N/A GLY 264.A N CYS 273.A O no hydrogen 2.720 N/A THR 265.A N ALA 262.A O no hydrogen 3.165 N/A THR 265.A OG1 ALA 262.A O no hydrogen 2.429 N/A CYS 267.A N LYS 271.A O no hydrogen 3.304 N/A LYS 271.A N GLY 268.A O no hydrogen 3.138 N/A LYS 271.A NZ ASN 280.A OD1 no hydrogen 2.652 N/A TRP 272.A N VAL 279.A O no hydrogen 3.001 N/A CYS 273.A N THR 265.A O no hydrogen 2.714 N/A CYS 273.A SG THR 265.A O no hydrogen 3.313 N/A ILE 274.A N LYS 277.A O no hydrogen 2.960 N/A ASN 275.A N ASP 263.A OD1 no hydrogen 2.834 N/A LYS 277.A N ILE 274.A O no hydrogen 3.087 N/A LYS 277.A NZ ASN 275.A O no hydrogen 2.964 N/A CYS 278.A SG CYS 267.A O no hydrogen 3.173 N/A VAL 279.A N TRP 272.A O no hydrogen 3.044 N/A LYS 281.A N GLY 270.A O no hydrogen 2.920 N/A