Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3o1i_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N GLY 31.A O no hydrogen 2.823 N/A LYS 3.A NZ TRP 58.A O no hydrogen 2.649 N/A ILE 4.A N ASN 33.A O no hydrogen 2.887 N/A CYS 5.A N ALA 62.A O no hydrogen 3.396 N/A ALA 6.A N ARG 35.A O no hydrogen 2.965 N/A ILE 7.A N ILE 64.A O no hydrogen 2.765 N/A TYR 8.A N LEU 37.A O no hydrogen 3.207 N/A HIS 10.A NE2 ASP 13.A OD2 no hydrogen 3.004 N/A TYR 15.A OH ASP 243.A OD2 no hydrogen 3.167 N/A LEU 17.A N ASP 13.A O no hydrogen 3.168 N/A SER 18.A N SER 14.A O no hydrogen 2.814 N/A SER 18.A OG SER 14.A O no hydrogen 3.196 N/A SER 18.A OG HIS 226.A NE2 no hydrogen 3.335 N/A SER 18.A OG SER 289.A O no hydrogen 3.400 N/A SER 18.A OG SER 291.A OG no hydrogen 2.919 N/A VAL 19.A N TYR 15.A O no hydrogen 2.935 N/A ASN 20.A N TRP 16.A O no hydrogen 2.884 N/A ASN 20.A ND2 TYR 8.A OH no hydrogen 2.852 N/A ASN 20.A ND2 THR 298.A O no hydrogen 3.589 N/A GLY 22.A N SER 18.A O no hydrogen 3.078 N/A MET 23.A N VAL 19.A O no hydrogen 3.348 N/A MET 23.A N ASN 20.A O no hydrogen 2.868 N/A VAL 24.A N ASN 20.A O no hydrogen 2.829 N/A SER 25.A N TYR 21.A O no hydrogen 2.883 N/A SER 25.A OG TYR 21.A O no hydrogen 2.774 N/A GLU 26.A N GLY 22.A O no hydrogen 3.319 N/A ALA 27.A N VAL 24.A O no hydrogen 2.882 N/A ASN 33.A N GLU 2.A O no hydrogen 2.848 N/A ARG 35.A N ILE 4.A O no hydrogen 3.111 N/A LEU 37.A N ALA 6.A O no hydrogen 2.990 N/A ALA 39.A N TYR 8.A O no hydrogen 3.343 N/A GLY 40.A N GLU 38.A OE2 no hydrogen 2.600 N/A ASN 44.A N GLY 41.A O no hydrogen 3.153 N/A ASN 44.A ND2 ALA 39.A O no hydrogen 2.888 N/A GLN 48.A N ASN 44.A O no hydrogen 3.245 N/A GLN 48.A N LYS 45.A O no hydrogen 2.836 N/A GLN 48.A NE2 ILE 7.A O no hydrogen 3.616 N/A GLN 48.A NE2 TYR 8.A O no hydrogen 3.231 N/A GLN 48.A NE2 GLY 66.A O no hydrogen 3.178 N/A GLU 49.A N LYS 45.A O no hydrogen 2.971 N/A GLN 50.A N SER 46.A O no hydrogen 3.285 N/A GLN 51.A N ARG 47.A O no hydrogen 3.005 N/A GLN 51.A NE2 GLU 38.A O no hydrogen 3.398 N/A LEU 52.A N GLN 48.A O no hydrogen 2.577 N/A ALA 53.A N GLU 49.A O no hydrogen 2.919 N/A LEU 54.A N GLN 50.A O no hydrogen 2.521 N/A CYS 55.A N GLN 51.A O no hydrogen 2.823 N/A CYS 55.A SG GLN 51.A O no hydrogen 3.496 N/A THR 56.A N LEU 52.A O no hydrogen 3.476 N/A THR 56.A OG1 ALA 53.A O no hydrogen 2.553 N/A GLN 57.A N ALA 53.A O no hydrogen 3.206 N/A TRP 58.A N LEU 54.A O no hydrogen 2.995 N/A GLY 59.A N THR 56.A O no hydrogen 2.427 N/A ALA 60.A N CYS 55.A O no hydrogen 3.363 N/A ASN 61.A ND2 LYS 3.A O no hydrogen 3.483 N/A ALA 62.A N LYS 3.A O no hydrogen 3.214 N/A ILE 63.A N PRO 85.A O no hydrogen 3.107 N/A ILE 64.A N CYS 5.A O no hydrogen 3.034 N/A LEU 65.A N PHE 87.A O no hydrogen 2.992 N/A GLY 66.A N ILE 7.A O no hydrogen 2.628 N/A THR 67.A OG1 ASP 69.A O no hydrogen 2.892 N/A VAL 68.A N GLN 48.A OE1 no hydrogen 3.350 N/A HIS 71.A N ASP 69.A OD1 no hydrogen 3.034 N/A TYR 73.A OH GLN 48.A OE1 no hydrogen 2.533 N/A ASN 76.A N TYR 73.A O no hydrogen 3.461 N/A LEU 77.A N TYR 73.A O no hydrogen 3.211 N/A LYS 78.A N GLN 99.A OE1 no hydrogen 2.910 N/A TRP 80.A N LEU 77.A O no hydrogen 2.824 N/A VAL 81.A N LEU 77.A O no hydrogen 3.015 N/A VAL 81.A N LYS 78.A O no hydrogen 3.045 N/A GLY 82.A N LYS 78.A O no hydrogen 2.463 N/A THR 84.A OG1 VAL 81.A O no hydrogen 2.906 N/A VAL 86.A N LEU 102.A O no hydrogen 3.161 N/A PHE 87.A N ILE 63.A O no hydrogen 2.922 N/A THR 89.A N LEU 65.A O no hydrogen 3.139 N/A GLN 92.A NE2 ASP 94.A OD1 no hydrogen 3.096 N/A GLU 98.A N ASP 96.A OD2 no hydrogen 3.351 N/A SER 100.A N ASP 96.A O no hydrogen 2.627 N/A THR 101.A N GLU 98.A O no hydrogen 3.096 N/A THR 101.A OG1 GLU 97.A O no hydrogen 3.291 N/A THR 101.A OG1 GLU 98.A O no hydrogen 2.534 N/A LEU 102.A N GLN 99.A O no hydrogen 2.819 N/A LEU 103.A N SER 100.A O no hydrogen 2.914 N/A LYS 104.A N VAL 86.A O no hydrogen 3.222 N/A LYS 104.A NZ THR 101.A O no hydrogen 2.560 N/A GLU 106.A N LYS 267.A O no hydrogen 2.829 N/A VAL 107.A N ALA 88.A O no hydrogen 3.044 N/A GLY 108.A N ALA 269.A O no hydrogen 3.118 N/A TYR 112.A N ASP 110.A OD1 no hydrogen 2.978 N/A TRP 113.A N ASP 110.A O no hydrogen 3.391 N/A MET 114.A N TRP 111.A O no hydrogen 2.620 N/A GLY 115.A N TRP 111.A O no hydrogen 3.128 N/A TYR 116.A N TYR 112.A O no hydrogen 2.947 N/A GLU 117.A N TRP 113.A O no hydrogen 3.384 N/A ALA 118.A N MET 114.A O no hydrogen 3.130 N/A GLY 119.A N GLY 115.A O no hydrogen 2.860 N/A LYS 120.A N TYR 116.A O no hydrogen 2.748 N/A LYS 120.A NZ GLU 117.A OE2 no hydrogen 2.867 N/A ALA 123.A N GLY 119.A O no hydrogen 2.794 N/A GLU 124.A N LYS 120.A O no hydrogen 3.128 N/A ARG 125.A N LEU 122.A O no hydrogen 3.127 N/A HIS 126.A NE2 TYR 193.A OH no hydrogen 2.605 N/A LYS 128.A NZ ASP 162.A OD1 no hydrogen 2.611 N/A SER 130.A N PRO 127.A O no hydrogen 2.623 N/A THR 133.A N ASP 162.A O no hydrogen 2.941 N/A THR 133.A OG1 HIS 126.A ND1 no hydrogen 2.884 N/A THR 133.A OG1 GLY 131.A O no hydrogen 2.909 N/A ASN 134.A N ASP 192.A OD2 no hydrogen 2.773 N/A ILE 135.A N HIS 164.A O no hydrogen 2.724 N/A ALA 136.A N TYR 193.A O no hydrogen 2.805 N/A LEU 137.A N ASP 167.A O no hydrogen 3.148 N/A LEU 138.A N VAL 195.A O no hydrogen 2.942 N/A THR 143.A OG1 ARG 142.A O no hydrogen 2.663 N/A GLY 146.A N THR 143.A O no hydrogen 3.449 N/A THR 151.A N THR 147.A O no hydrogen 2.633 N/A THR 152.A N LYS 148.A O no hydrogen 3.174 N/A THR 152.A OG1 LYS 148.A O no hydrogen 3.331 N/A GLY 153.A N PRO 149.A O no hydrogen 3.419 N/A PHE 154.A N VAL 150.A O no hydrogen 2.618 N/A TYR 155.A N THR 151.A O no hydrogen 2.490 N/A GLU 156.A N THR 152.A O no hydrogen 2.959 N/A ALA 157.A N GLY 153.A O no hydrogen 3.474 N/A ILE 158.A N TYR 155.A O no hydrogen 3.117 N/A LYS 159.A N GLU 156.A O no hydrogen 3.107 N/A SER 161.A N LYS 159.A O no hydrogen 3.065 N/A SER 161.A OG ILE 158.A O no hydrogen 2.638 N/A ASP 162.A N HIS 126.A O no hydrogen 3.386 N/A HIS 164.A N THR 133.A O no hydrogen 2.709 N/A VAL 166.A N ILE 135.A O no hydrogen 2.836 N/A SER 168.A OG LEU 137.A O no hydrogen 3.209 N/A PHE 169.A N LEU 137.A O no hydrogen 2.930 N/A ALA 171.A N GLY 140.A O no hydrogen 3.072 N/A ASP 174.A N ASP 172.A O no hydrogen 2.862 N/A GLU 176.A N ASP 174.A OD1 no hydrogen 3.055 N/A GLN 178.A N ASP 174.A O no hydrogen 3.049 N/A GLN 178.A NE2 ASP 172.A O no hydrogen 2.956 N/A ARG 179.A N LYS 175.A O no hydrogen 2.676 N/A ARG 179.A NE GLU 207.A OE2 no hydrogen 3.143 N/A ASN 180.A N GLU 176.A O no hydrogen 3.099 N/A LEU 181.A N LEU 177.A O no hydrogen 3.230 N/A VAL 182.A N GLN 178.A O no hydrogen 2.671 N/A GLN 183.A N ARG 179.A O no hydrogen 2.821 N/A GLN 183.A NE2 GLU 207.A OE1 no hydrogen 3.163 N/A ARG 184.A N ASN 180.A O no hydrogen 3.129 N/A VAL 185.A N LEU 181.A O no hydrogen 3.245 N/A ILE 186.A N VAL 182.A O no hydrogen 2.824 N/A ASP 187.A N GLN 183.A O no hydrogen 3.033 N/A MET 188.A N ARG 184.A O no hydrogen 3.214 N/A MET 188.A N VAL 185.A O no hydrogen 2.960 N/A ASP 192.A N ASN 134.A O no hydrogen 2.831 N/A TYR 193.A OH HIS 126.A NE2 no hydrogen 2.605 N/A ILE 194.A N GLY 218.A O no hydrogen 2.850 N/A VAL 195.A N ALA 136.A O no hydrogen 2.953 N/A GLY 196.A N VAL 220.A O no hydrogen 3.115 N/A SER 197.A N LEU 138.A O no hydrogen 2.995 N/A SER 197.A OG ASN 173.A OD1 no hydrogen 3.447 N/A ALA 200.A N SER 197.A OG no hydrogen 2.892 N/A ILE 201.A N SER 197.A O no hydrogen 2.895 N/A GLU 202.A N ALA 198.A O no hydrogen 2.887 N/A ALA 203.A N VAL 199.A O no hydrogen 3.150 N/A ALA 204.A N ALA 200.A O no hydrogen 2.835 N/A ILE 205.A N ILE 201.A O no hydrogen 2.890 N/A GLU 207.A N ALA 203.A O no hydrogen 2.817 N/A LEU 208.A N ALA 204.A O no hydrogen 2.716 N/A SER 210.A N SER 206.A O no hydrogen 2.952 N/A ASP 212.A N ARG 209.A O no hydrogen 2.761 N/A LYS 213.A N LEU 208.A O no hydrogen 2.721 N/A ASP 216.A N LYS 213.A O no hydrogen 2.885 N/A ILE 217.A N LYS 213.A O no hydrogen 3.314 N/A GLY 218.A N ASP 192.A O no hydrogen 2.786 N/A VAL 220.A N ILE 194.A O no hydrogen 2.883 N/A SER 221.A N PHE 239.A O no hydrogen 3.519 N/A SER 221.A OG TYR 223.A O no hydrogen 2.925 N/A VAL 222.A N GLY 196.A O no hydrogen 3.006 N/A HIS 226.A N SER 14.A OG no hydrogen 3.279 N/A HIS 226.A NE2 SER 18.A OG no hydrogen 3.335 N/A VAL 228.A N SER 225.A OG no hydrogen 3.286 N/A TYR 229.A N SER 225.A O no hydrogen 2.822 N/A ARG 230.A N HIS 226.A O no hydrogen 3.443 N/A GLY 231.A N GLY 227.A O no hydrogen 3.115 N/A LEU 232.A N VAL 228.A O no hydrogen 3.110 N/A LEU 233.A N TYR 229.A O no hydrogen 2.908 N/A ARG 234.A N GLY 231.A O no hydrogen 3.131 N/A ASN 235.A N LEU 232.A O no hydrogen 3.164 N/A VAL 237.A N GLY 231.A O no hydrogen 3.022 N/A LEU 238.A N LEU 219.A O no hydrogen 2.892 N/A THR 242.A N LYS 274.A O no hydrogen 3.035 N/A THR 242.A OG1 SER 289.A OG no hydrogen 2.315 N/A LYS 244.A N THR 242.A OG1 no hydrogen 3.280 N/A LYS 244.A NZ ILE 272.A O no hydrogen 2.559 N/A VAL 246.A N SER 289.A O no hydrogen 3.294 N/A GLN 247.A N GLU 288.A O no hydrogen 3.129 N/A GLN 248.A N LYS 244.A O no hydrogen 3.286 N/A GLY 249.A N MET 245.A O no hydrogen 2.932 N/A GLY 249.A N VAL 246.A O no hydrogen 3.321 N/A ARG 250.A N VAL 246.A O no hydrogen 3.312 N/A LEU 251.A N GLN 247.A O no hydrogen 2.916 N/A VAL 253.A N GLY 249.A O no hydrogen 3.178 N/A MET 254.A N ARG 250.A O no hydrogen 2.935 N/A GLN 255.A N LEU 251.A O no hydrogen 2.857 N/A GLN 255.A NE2 GLU 266.A O no hydrogen 2.573 N/A GLN 255.A NE2 LYS 267.A O no hydrogen 3.202 N/A ALA 256.A N SER 252.A O no hydrogen 3.226 N/A ALA 257.A N VAL 253.A O no hydrogen 2.838 N/A HIS 258.A N MET 254.A O no hydrogen 2.796 N/A TYR 259.A N GLN 255.A O no hydrogen 3.073 N/A LEU 260.A N ALA 256.A O no hydrogen 3.033 N/A ARG 261.A N HIS 258.A O no hydrogen 2.888 N/A GLN 263.A N HIS 258.A O no hydrogen 2.975 N/A TYR 265.A OH LYS 104.A O no hydrogen 2.419 N/A GLN 268.A N GLU 266.A OE2 no hydrogen 3.390 N/A LYS 274.A N THR 242.A O no hydrogen 3.027 N/A LYS 274.A NZ PRO 275.A O no hydrogen 2.694 N/A LYS 274.A NZ THR 280.A O no hydrogen 3.223 N/A THR 277.A OG1 THR 280.A OG1 no hydrogen 2.369 N/A LYS 279.A N THR 277.A OG1 no hydrogen 3.355 N/A THR 280.A N THR 277.A OG1 no hydrogen 2.920 N/A THR 280.A OG1 THR 277.A OG1 no hydrogen 2.369 N/A HIS 282.A N THR 280.A O no hydrogen 3.096 N/A THR 285.A N HIS 282.A O no hydrogen 3.057 N/A THR 285.A OG1 HIS 282.A O no hydrogen 2.600 N/A ILE 286.A N HIS 282.A O no hydrogen 3.285 N/A GLU 287.A N ASP 283.A O no hydrogen 3.109 N/A SER 289.A N ILE 286.A O no hydrogen 3.276 N/A SER 289.A OG THR 242.A OG1 no hydrogen 2.315 N/A SER 289.A OG THR 285.A O no hydrogen 3.353 N/A LEU 290.A N ILE 286.A O no hydrogen 2.988 N/A SER 291.A N SER 18.A OG no hydrogen 2.813 N/A SER 291.A OG SER 18.A OG no hydrogen 2.919 N/A SER 291.A OG HIS 226.A NE2 no hydrogen 3.011 N/A TYR 295.A OH ASN 20.A OD1 no hydrogen 2.954 N/A THR 298.A N ASN 20.A OD1 no hydrogen 3.472 N/A