Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xmi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 163.A OD1 no hydrogen 2.593 N/A THR 2.A OG1 ASP 163.A O no hydrogen 2.755 N/A THR 2.A OG1 THR 195.A OG1 no hydrogen 3.067 N/A THR 3.A N THR 2.A OG1 no hydrogen 2.890 N/A THR 3.A N ASP 163.A O no hydrogen 3.286 N/A THR 3.A OG1 GLU 4.A O no hydrogen 2.725 N/A THR 3.A OG1 SER 81.A OG no hydrogen 3.098 N/A VAL 5.A N ILE 44.A O no hydrogen 3.042 N/A VAL 6.A N LYS 79.A O no hydrogen 2.849 N/A MET 7.A N PHE 42.A O no hydrogen 2.770 N/A GLU 8.A N LYS 77.A O no hydrogen 2.854 N/A ASN 9.A N ASN 41.A OD1 no hydrogen 2.807 N/A ASN 9.A ND2 ASP 39.A OD1 no hydrogen 3.174 N/A VAL 10.A N ILE 40.A O no hydrogen 3.183 N/A THR 11.A N GLU 75.A O no hydrogen 3.015 N/A ALA 12.A N LEU 37.A O no hydrogen 2.868 N/A TRP 14.A NE1 SER 62.A OG no hydrogen 2.924 N/A GLU 15.A N GLU 15.A OE1 no hydrogen 2.772 N/A GLY 19.A N GLU 15.A O no hydrogen 3.408 N/A PHE 22.A N PHE 18.A O no hydrogen 3.081 N/A PHE 22.A N GLY 19.A O no hydrogen 3.133 N/A GLU 23.A N GLU 20.A O no hydrogen 3.120 N/A LEU 32.A N PHE 29.A O no hydrogen 3.262 N/A GLY 33.A N SER 30.A O no hydrogen 2.934 N/A VAL 36.A N ALA 12.A O no hydrogen 2.925 N/A LEU 37.A N ALA 12.A O no hydrogen 3.403 N/A LYS 38.A N GLY 218.A O no hydrogen 2.761 N/A ASP 39.A N THR 11.A OG1 no hydrogen 3.230 N/A ILE 40.A N VAL 10.A O no hydrogen 2.906 N/A ASN 41.A ND2 ASP 39.A OD1 no hydrogen 3.317 N/A PHE 42.A N MET 7.A O no hydrogen 2.983 N/A LYS 43.A N TYR 223.A OH no hydrogen 3.147 N/A ILE 44.A N VAL 5.A O no hydrogen 2.817 N/A GLU 45.A N GLN 48.A OE1 no hydrogen 3.104 N/A GLY 47.A N THR 195.A OG1 no hydrogen 2.807 N/A GLN 48.A N GLU 45.A O no hydrogen 3.150 N/A LEU 49.A N ASP 210.A OD2 no hydrogen 2.887 N/A LEU 50.A N ARG 196.A O no hydrogen 2.890 N/A ALA 51.A N LYS 211.A O no hydrogen 3.018 N/A VAL 52.A N LEU 198.A O no hydrogen 2.808 N/A ALA 53.A N LEU 213.A O no hydrogen 2.995 N/A ALA 58.A N SER 55.A O no hydrogen 3.088 N/A LYS 60.A NZ GLY 54.A O no hydrogen 2.754 N/A THR 61.A OG1 GLN 89.A OE1 no hydrogen 3.169 N/A THR 61.A OG1 ASP 168.A OD1 no hydrogen 3.441 N/A THR 61.A OG1 ASP 168.A OD2 no hydrogen 2.541 N/A LEU 63.A N GLY 59.A O no hydrogen 2.926 N/A LEU 64.A N LYS 60.A O no hydrogen 3.424 N/A MET 65.A N THR 61.A O no hydrogen 2.848 N/A MET 66.A N SER 62.A O no hydrogen 2.936 N/A ILE 67.A N LEU 63.A O no hydrogen 3.129 N/A MET 68.A N LEU 64.A O no hydrogen 2.988 N/A GLY 69.A N MET 66.A O no hydrogen 3.140 N/A GLU 70.A N MET 65.A O no hydrogen 2.873 N/A LEU 71.A N MET 65.A O no hydrogen 3.441 N/A SER 74.A N THR 11.A O no hydrogen 2.777 N/A GLU 75.A N THR 11.A O no hydrogen 3.350 N/A LYS 77.A N GLU 8.A O no hydrogen 2.848 N/A LYS 79.A N VAL 6.A O no hydrogen 2.816 N/A SER 81.A N THR 3.A OG1 no hydrogen 3.058 N/A SER 81.A OG THR 3.A OG1 no hydrogen 3.098 N/A ARG 83.A N ASP 163.A OD2 no hydrogen 2.859 N/A SER 85.A N LEU 164.A O no hydrogen 2.795 N/A SER 85.A OG ALA 157.A O no hydrogen 2.594 N/A CYS 87.A N LEU 166.A O no hydrogen 2.797 N/A PHE 90.A N SER 88.A OG no hydrogen 3.373 N/A TRP 92.A NE1 GLU 139.A OE1 no hydrogen 2.755 N/A MET 94.A N ASN 101.A OD1 no hydrogen 2.660 N/A GLY 96.A N LEU 137.A O no hydrogen 2.820 N/A LYS 99.A N ASP 133.A O no hydrogen 3.311 N/A GLU 100.A N THR 97.A OG1 no hydrogen 3.068 N/A ASN 101.A N THR 97.A O no hydrogen 2.867 N/A ASN 101.A ND2 MET 94.A O no hydrogen 2.871 N/A ASN 101.A ND2 THR 97.A O no hydrogen 3.026 N/A ILE 102.A N ILE 98.A O no hydrogen 3.085 N/A ILE 102.A N LYS 99.A O no hydrogen 3.213 N/A ILE 103.A N LYS 99.A O no hydrogen 2.855 N/A ALA 104.A N GLU 100.A O no hydrogen 2.829 N/A VAL 106.A N ILE 103.A O no hydrogen 3.215 N/A TYR 108.A OH GLU 110.A OE1 no hydrogen 2.729 N/A ASP 109.A N TYR 159.A OH no hydrogen 2.919 N/A ARG 112.A N ASP 109.A OD2 no hydrogen 3.086 N/A ARG 112.A NE TYR 159.A O no hydrogen 2.547 N/A ARG 112.A NH2 TYR 159.A O no hydrogen 2.976 N/A TYR 113.A N ASP 109.A O no hydrogen 2.967 N/A TYR 113.A OH ASP 133.A OD2 no hydrogen 3.078 N/A ARG 114.A N GLU 110.A O no hydrogen 3.057 N/A ARG 114.A NE GLU 110.A OE2 no hydrogen 2.860 N/A SER 115.A N TYR 111.A O no hydrogen 2.987 N/A SER 115.A OG TYR 111.A O no hydrogen 2.929 N/A VAL 116.A N ARG 112.A O no hydrogen 3.000 N/A ILE 117.A N TYR 113.A O no hydrogen 3.076 N/A LYS 118.A N ARG 114.A O no hydrogen 2.997 N/A LYS 118.A NZ GLU 123.A OE1 no hydrogen 2.833 N/A ALA 119.A N SER 115.A O no hydrogen 2.910 N/A CYS 120.A N VAL 116.A O no hydrogen 2.933 N/A CYS 120.A SG VAL 116.A O no hydrogen 3.460 N/A GLN 121.A N LYS 118.A O no hydrogen 3.174 N/A GLN 121.A NE2 GLU 181.A OE2 no hydrogen 2.901 N/A LEU 122.A N ILE 117.A O no hydrogen 2.699 N/A ILE 126.A N GLU 123.A O no hydrogen 3.255 N/A SER 127.A N GLU 123.A O no hydrogen 3.079 N/A SER 127.A OG GLU 123.A O no hydrogen 3.104 N/A ASN 134.A N GLU 131.A O no hydrogen 3.067 N/A LEU 137.A N GLY 96.A O no hydrogen 2.764 N/A GLY 140.A N ILE 93.A O no hydrogen 3.330 N/A GLY 141.A N GLY 138.A O no hydrogen 3.335 N/A SER 145.A N GLN 148.A OE1 no hydrogen 2.776 N/A SER 145.A OG GLN 148.A OE1 no hydrogen 3.013 N/A GLN 148.A N SER 145.A OG no hydrogen 3.218 N/A GLN 148.A NE2 ASP 125.A OD1 no hydrogen 2.983 N/A ARG 149.A N SER 145.A O no hydrogen 3.093 N/A ALA 150.A N GLY 146.A O no hydrogen 3.084 N/A ARG 151.A N GLY 147.A O no hydrogen 3.124 N/A ARG 151.A NE GLN 121.A O no hydrogen 3.217 N/A ARG 151.A NH1 GLU 260.A OE1 no hydrogen 2.820 N/A ILE 152.A N GLN 148.A O no hydrogen 2.931 N/A SER 153.A N ARG 149.A O no hydrogen 2.929 N/A LEU 154.A N ALA 150.A O no hydrogen 2.939 N/A ALA 155.A N ARG 151.A O no hydrogen 2.944 N/A ARG 156.A N ILE 152.A O no hydrogen 2.932 N/A ARG 156.A NE ASN 101.A O no hydrogen 2.738 N/A ARG 156.A NH1 TRP 92.A O no hydrogen 2.673 N/A ARG 156.A NH1 ASN 101.A OD1 no hydrogen 2.984 N/A ARG 156.A NH2 TRP 92.A O no hydrogen 3.103 N/A ALA 157.A N SER 153.A O no hydrogen 3.326 N/A VAL 158.A N LEU 154.A O no hydrogen 2.960 N/A TYR 159.A N ALA 155.A O no hydrogen 2.802 N/A TYR 159.A OH SER 107.A O no hydrogen 2.815 N/A LYS 160.A NZ ILE 84.A O no hydrogen 2.786 N/A ALA 162.A N TYR 165.A OH no hydrogen 2.965 N/A ASP 163.A N ARG 83.A O no hydrogen 2.921 N/A LEU 164.A N ARG 83.A O no hydrogen 3.059 N/A TYR 165.A N THR 195.A O no hydrogen 3.080 N/A TYR 165.A OH LYS 160.A O no hydrogen 2.624 N/A LEU 166.A N SER 85.A O no hydrogen 2.731 N/A LEU 167.A N ILE 197.A O no hydrogen 2.791 N/A ASP 168.A N CYS 87.A O no hydrogen 2.838 N/A SER 169.A N LEU 167.A O no hydrogen 3.198 N/A SER 169.A N VAL 199.A O no hydrogen 3.074 N/A TYR 173.A OH GLU 252.A OE2 no hydrogen 2.776 N/A LEU 174.A N PHE 171.A O no hydrogen 2.901 N/A THR 178.A N ASP 175.A OD1 no hydrogen 3.440 N/A THR 178.A OG1 ASP 175.A OD1 no hydrogen 3.529 N/A THR 178.A OG1 ASP 175.A OD2 no hydrogen 2.634 N/A GLU 179.A N ASP 175.A O no hydrogen 3.053 N/A LYS 180.A N VAL 176.A O no hydrogen 2.990 N/A GLU 181.A N LEU 177.A O no hydrogen 3.100 N/A ILE 182.A N THR 178.A O no hydrogen 2.902 N/A PHE 183.A N GLU 179.A O no hydrogen 2.877 N/A GLU 184.A N LYS 180.A O no hydrogen 3.203 N/A SER 185.A N GLU 181.A O no hydrogen 2.855 N/A SER 185.A OG ALA 119.A O no hydrogen 2.711 N/A SER 185.A OG GLU 181.A O no hydrogen 2.923 N/A CYS 186.A N ILE 182.A O no hydrogen 2.734 N/A CYS 188.A N PHE 183.A O no hydrogen 2.918 N/A CYS 188.A SG PHE 183.A O no hydrogen 3.573 N/A LEU 190.A N SER 185.A O no hydrogen 3.079 N/A MET 191.A N CYS 186.A O no hydrogen 2.992 N/A ALA 192.A N LYS 189.A O no hydrogen 3.235 N/A LYS 194.A N MET 191.A O no hydrogen 2.936 N/A LYS 194.A NZ SER 1.A O no hydrogen 2.994 N/A LYS 194.A NZ ASP 161.A OD2 no hydrogen 2.650 N/A LYS 194.A NZ ALA 162.A O no hydrogen 2.813 N/A THR 195.A N THR 2.A OG1 no hydrogen 2.893 N/A THR 195.A OG1 THR 2.A OG1 no hydrogen 3.067 N/A THR 195.A OG1 THR 3.A O no hydrogen 2.514 N/A ARG 196.A N GLN 48.A O no hydrogen 3.038 N/A ARG 196.A NE VAL 187.A O no hydrogen 2.785 N/A ARG 196.A NH1 GLY 47.A O no hydrogen 2.945 N/A ARG 196.A NH1 LYS 194.A O no hydrogen 2.934 N/A ARG 196.A NH2 VAL 187.A O no hydrogen 3.174 N/A ILE 197.A N TYR 165.A O no hydrogen 2.860 N/A LEU 198.A N LEU 50.A O no hydrogen 2.779 N/A VAL 199.A N LEU 167.A O no hydrogen 2.825 N/A THR 200.A N VAL 52.A O no hydrogen 3.032 N/A THR 200.A OG1 HIS 205.A ND1 no hydrogen 2.804 N/A LYS 202.A N THR 200.A OG1 no hydrogen 2.998 N/A HIS 205.A ND1 THR 200.A OG1 no hydrogen 2.804 N/A LEU 206.A N LYS 202.A O no hydrogen 3.175 N/A LYS 207.A N MET 203.A O no hydrogen 2.896 N/A LYS 208.A N GLU 204.A O no hydrogen 3.113 N/A ALA 209.A N HIS 205.A O no hydrogen 3.066 N/A ALA 209.A N LEU 206.A O no hydrogen 3.318 N/A ASP 210.A N LEU 49.A O no hydrogen 2.953 N/A LYS 211.A N LEU 49.A O no hydrogen 3.264 N/A ILE 212.A N GLY 224.A O no hydrogen 2.678 N/A LEU 213.A N ALA 51.A O no hydrogen 2.859 N/A ILE 214.A N PHE 222.A O no hydrogen 2.822 N/A LEU 215.A N ALA 53.A O no hydrogen 2.817 N/A HIS 216.A N SER 219.A O no hydrogen 2.824 N/A SER 219.A N HIS 216.A O no hydrogen 2.871 N/A TYR 221.A N ILE 214.A O no hydrogen 2.767 N/A PHE 222.A N ILE 214.A O no hydrogen 3.355 N/A GLY 224.A N ILE 212.A O no hydrogen 3.243 N/A THR 225.A N GLU 228.A OE1 no hydrogen 2.871 N/A GLU 228.A N THR 225.A OG1 no hydrogen 3.234 N/A LEU 229.A N THR 225.A O no hydrogen 3.138 N/A GLN 230.A N PHE 226.A O no hydrogen 2.833 N/A ASN 231.A N SER 227.A O no hydrogen 2.906 N/A ASN 231.A ND2 SER 227.A O no hydrogen 2.811 N/A LEU 232.A N GLU 228.A O no hydrogen 2.981 N/A GLN 233.A N LEU 229.A O no hydrogen 2.799 N/A PHE 236.A N GLN 233.A O no hydrogen 3.002 N/A SER 238.A N ASP 235.A O no hydrogen 2.724 N/A SER 238.A OG ASP 235.A O no hydrogen 2.697 N/A SER 238.A OG ASP 235.A OD1 no hydrogen 3.261 N/A SER 238.A OG ASP 235.A OD2 no hydrogen 3.243 N/A LEU 240.A N PHE 236.A O no hydrogen 3.036 N/A MET 241.A N SER 238.A O no hydrogen 3.049 N/A CYS 243.A SG GLY 242.A O no hydrogen 3.408 N/A ARG 253.A NE GLY 172.A O no hydrogen 2.785 N/A ARG 253.A NH1 ASP 244.A OD1 no hydrogen 3.338 N/A ARG 253.A NH2 GLY 172.A O no hydrogen 3.385 N/A ARG 253.A NH2 ASP 244.A OD2 no hydrogen 2.965 N/A ARG 254.A N SER 250.A O no hydrogen 3.360 N/A ARG 254.A NH1 PHE 249.A O no hydrogen 3.090 N/A ASN 255.A N ALA 251.A O no hydrogen 3.109 N/A ASN 255.A ND2 ALA 251.A O no hydrogen 2.737 N/A SER 256.A N GLU 252.A O no hydrogen 2.915 N/A SER 256.A OG TYR 173.A O no hydrogen 2.801 N/A ILE 257.A N ARG 253.A O no hydrogen 2.992 N/A LEU 258.A N ARG 254.A O no hydrogen 2.954 N/A THR 259.A N ASN 255.A O no hydrogen 2.969 N/A THR 259.A OG1 ASN 255.A O no hydrogen 2.559 N/A GLU 260.A N SER 256.A O no hydrogen 2.950 N/A THR 261.A N ILE 257.A O no hydrogen 3.084 N/A THR 261.A OG1 ILE 257.A O no hydrogen 3.023 N/A LEU 262.A N LEU 258.A O no hydrogen 2.916 N/A ARG 263.A N THR 259.A O no hydrogen 2.923 N/A ARG 263.A NH2 GLN 121.A OE1 no hydrogen 3.233 N/A ARG 264.A N GLU 260.A O no hydrogen 3.250 N/A ARG 264.A NH1 THR 178.A OG1 no hydrogen 3.294 N/A ARG 264.A NH1 GLU 181.A OE2 no hydrogen 2.667 N/A ARG 264.A NH2 GLU 181.A OE1 no hydrogen 2.757 N/A ARG 264.A NH2 GLU 181.A OE2 no hydrogen 3.461 N/A PHE 265.A N LEU 262.A O no hydrogen 3.272 N/A SER 266.A N LEU 262.A O no hydrogen 2.951 N/A SER 266.A OG LEU 262.A O no hydrogen 3.056 N/A SER 266.A OG ARG 263.A O no hydrogen 3.188 N/A LEU 267.A N ARG 263.A O no hydrogen 3.199 N/A