Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3iqg_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 7.A N ASP 5.A OD1 no hydrogen 2.880 N/A SER 7.A OG ASP 5.A OD1 no hydrogen 2.607 N/A TYR 8.A N ASP 5.A O no hydrogen 3.152 N/A SER 9.A N ASN 6.A O no hydrogen 3.142 N/A SER 9.A OG ASN 6.A O no hydrogen 2.748 N/A SER 9.A OG ASN 6.A OD1 no hydrogen 3.203 N/A GLY 11.A N ASN 35.A OD1 no hydrogen 2.690 N/A ASN 12.A N GLU 158.A OE2 no hydrogen 2.954 N/A THR 13.A N GLU 158.A OE1 no hydrogen 3.334 N/A THR 13.A OG1 GLU 32.A OE2 no hydrogen 2.704 N/A THR 13.A OG1 GLU 158.A OE1 no hydrogen 3.508 N/A VAL 16.A N VAL 29.A O no hydrogen 2.864 N/A ARG 17.A NH1 GLY 25.A O no hydrogen 2.761 N/A LEU 18.A N VAL 27.A O no hydrogen 2.873 N/A LYS 19.A N GLU 263.A OE1 no hydrogen 3.050 N/A HIS 20.A N GLU 263.A OE2 no hydrogen 2.657 N/A GLY 22.A N ASP 279.A OD1 no hydrogen 2.729 N/A HIS 23.A N ASN 26.A OD1 no hydrogen 2.823 N/A ASN 26.A N HIS 23.A O no hydrogen 3.343 N/A ASN 26.A ND2 ALA 282.A O no hydrogen 3.137 N/A ASN 26.A ND2 PHE 287.A O no hydrogen 2.948 N/A VAL 28.A N ILE 292.A O no hydrogen 2.792 N/A VAL 29.A N VAL 16.A O no hydrogen 2.757 N/A LYS 30.A N VAL 294.A O no hydrogen 2.821 N/A LYS 30.A NZ THR 13.A O no hydrogen 2.912 N/A LYS 30.A NZ THR 13.A OG1 no hydrogen 2.698 N/A LYS 30.A NZ GLU 158.A OE1 no hydrogen 2.637 N/A ILE 31.A N PRO 14.A O no hydrogen 3.046 N/A GLU 32.A N LEU 296.A O no hydrogen 3.004 N/A ARG 34.A N ILE 31.A O no hydrogen 3.228 N/A ASN 35.A N GLY 33.A O no hydrogen 3.182 N/A ASN 35.A ND2 GLU 32.A O no hydrogen 3.037 N/A ASN 35.A ND2 GLU 32.A OE1 no hydrogen 3.035 N/A TYR 38.A N ASN 35.A O no hydrogen 3.035 N/A VAL 40.A N PRO 297.A O no hydrogen 2.863 N/A CYS 41.A SG.A SER 37.A OG no hydrogen 2.848 N/A CYS 41.A SG.A SER 39.A O no hydrogen 3.211 N/A ARG 42.A N VAL 40.A O no hydrogen 3.147 N/A ARG 42.A NE GLU 32.A OE1 no hydrogen 2.758 N/A ARG 42.A NH1 THR 154.A OG1 no hydrogen 2.964 N/A ARG 42.A NH1 GLU 158.A OE2 no hydrogen 3.026 N/A ARG 42.A NH2 GLU 32.A OE1 no hydrogen 3.432 N/A ARG 42.A NH2 GLU 32.A OE2 no hydrogen 2.885 N/A ARG 42.A NH2 GLU 158.A OE1 no hydrogen 2.901 N/A ARG 42.A NH2 GLU 158.A OE2 no hydrogen 3.569 N/A ALA 45.A N CYS 41.A O no hydrogen 3.005 N/A ASN 46.A N ARG 42.A O no hydrogen 3.027 N/A ASN 46.A ND2 ALA 146.A O no hydrogen 2.731 N/A MET 47.A N ILE 43.A O no hydrogen 2.883 N/A VAL 48.A N GLY 44.A O no hydrogen 3.398 N/A TRP 49.A N ALA 45.A O no hydrogen 2.920 N/A TRP 49.A NE1 SER 7.A OG no hydrogen 3.176 N/A GLN 50.A N ASN 46.A O no hydrogen 2.824 N/A ALA 51.A N MET 47.A O no hydrogen 3.046 N/A GLU 52.A N VAL 48.A O no hydrogen 2.912 N/A LYS 53.A N TRP 49.A O no hydrogen 2.965 N/A ASP 54.A N GLN 50.A O no hydrogen 2.948 N/A GLY 55.A N GLU 52.A O no hydrogen 3.147 N/A THR 56.A N ASP 54.A OD1 no hydrogen 3.023 N/A THR 56.A OG1 ALA 51.A O no hydrogen 3.309 N/A THR 56.A OG1 ASP 54.A OD1 no hydrogen 2.756 N/A LEU 57.A N ALA 51.A O no hydrogen 2.959 N/A LYS 61.A N THR 58.A O no hydrogen 2.985 N/A LYS 61.A NZ SER 134.A O no hydrogen 2.732 N/A GLU 62.A N ARG 135.A O no hydrogen 2.798 N/A ILE 63.A N LYS 85.A O no hydrogen 2.975 N/A VAL 64.A N VAL 137.A O no hydrogen 2.793 N/A ASP 65.A N THR 87.A O no hydrogen 3.167 N/A ALA 66.A N ASP 65.A OD1 no hydrogen 2.734 N/A GLY 69.A N THR 67.A OG1 no hydrogen 3.306 N/A THR 71.A OG1 GLN 141.A OE1 no hydrogen 2.537 N/A GLY 72.A N THR 67.A OG1 no hydrogen 3.305 N/A ILE 73.A N GLY 69.A O no hydrogen 3.212 N/A ALA 74.A N ASN 70.A O no hydrogen 2.921 N/A LEU 75.A N THR 71.A O no hydrogen 2.820 N/A ALA 76.A N GLY 72.A O no hydrogen 2.939 N/A TYR 77.A N ILE 73.A O no hydrogen 3.002 N/A TYR 77.A OH CYS 41.A O no hydrogen 3.358 N/A VAL 78.A N ALA 74.A O no hydrogen 3.068 N/A ALA 79.A N LEU 75.A O no hydrogen 2.810 N/A ALA 80.A N ALA 76.A O no hydrogen 3.013 N/A ALA 81.A N TYR 77.A O no hydrogen 2.829 N/A ARG 82.A N VAL 78.A O no hydrogen 2.916 N/A ARG 82.A NE GLU 52.A OE2 no hydrogen 3.040 N/A ARG 82.A NH1 TYR 8.A OH no hydrogen 2.982 N/A ARG 82.A NH2 TYR 8.A OH no hydrogen 3.509 N/A ARG 82.A NH2 GLU 52.A OE1 no hydrogen 2.698 N/A ARG 82.A NH2 GLU 52.A OE2 no hydrogen 3.387 N/A GLY 83.A N ALA 80.A O no hydrogen 3.309 N/A TYR 84.A N ALA 79.A O no hydrogen 2.863 N/A TYR 84.A OH GLU 52.A OE2 no hydrogen 2.511 N/A THR 87.A N ILE 63.A O no hydrogen 2.893 N/A THR 87.A OG1 GLU 62.A OE2 no hydrogen 2.522 N/A LEU 88.A N ASN 108.A O no hydrogen 3.094 N/A THR 89.A N ASP 65.A O no hydrogen 2.962 N/A THR 89.A OG1 ASP 65.A O no hydrogen 3.425 N/A THR 89.A OG1 ALA 121.A O no hydrogen 2.607 N/A MET 90.A N VAL 110.A O no hydrogen 2.957 N/A GLU 92.A N THR 112.A O no hydrogen 2.868 N/A MET 94.A N PRO 91.A O no hydrogen 3.090 N/A ARG 98.A N SER 95.A OG no hydrogen 3.093 N/A ARG 98.A NH1 SER 68.A O no hydrogen 2.673 N/A LYS 99.A N SER 95.A O no hydrogen 3.035 N/A LYS 99.A NZ GLU 92.A O no hydrogen 2.903 N/A LYS 99.A NZ MET 94.A O no hydrogen 3.221 N/A ARG 100.A N LEU 96.A O no hydrogen 2.861 N/A LEU 101.A N GLU 97.A O no hydrogen 3.020 N/A LEU 102.A N ARG 98.A O no hydrogen 3.023 N/A CYS 103.A N LYS 99.A O no hydrogen 2.836 N/A CYS 103.A SG LYS 99.A O no hydrogen 3.412 N/A GLY 104.A N ARG 100.A O no hydrogen 2.757 N/A LEU 105.A N LEU 101.A O no hydrogen 3.063 N/A GLY 106.A N CYS 103.A O no hydrogen 2.963 N/A VAL 107.A N LEU 102.A O no hydrogen 3.166 N/A ASN 108.A N ILE 86.A O no hydrogen 2.873 N/A ASN 108.A ND2 THR 87.A OG1 no hydrogen 2.723 N/A VAL 110.A N LEU 88.A O no hydrogen 2.831 N/A THR 112.A N MET 90.A O no hydrogen 2.716 N/A GLY 114.A N GLU 92.A OE2 no hydrogen 2.558 N/A LYS 116.A N GLU 113.A O no hydrogen 2.971 N/A GLY 117.A N GLY 114.A O no hydrogen 3.291 N/A GLY 120.A N LYS 116.A O no hydrogen 3.175 N/A ILE 122.A N MET 118.A O no hydrogen 2.868 N/A ALA 123.A N LYS 119.A O no hydrogen 2.944 N/A LYS 124.A N GLY 120.A O no hydrogen 2.925 N/A LYS 124.A NZ GLU 127.A OE1 no hydrogen 3.463 N/A LYS 124.A NZ GLU 127.A OE2 no hydrogen 2.642 N/A ALA 125.A N ALA 121.A O no hydrogen 3.047 N/A GLU 126.A N ILE 122.A O no hydrogen 2.986 N/A GLU 127.A N ALA 123.A O no hydrogen 2.796 N/A ILE 128.A N LYS 124.A O no hydrogen 2.911 N/A VAL 129.A N ALA 125.A O no hydrogen 3.091 N/A ALA 130.A N GLU 126.A O no hydrogen 3.013 N/A SER 131.A N GLU 127.A O no hydrogen 3.020 N/A SER 131.A OG ILE 128.A O no hydrogen 2.680 N/A ASP 132.A N VAL 129.A O no hydrogen 3.243 N/A SER 134.A OG ASP 132.A OD1 no hydrogen 3.147 N/A ARG 135.A N ASP 132.A O no hydrogen 2.861 N/A VAL 137.A N GLU 62.A O no hydrogen 2.918 N/A GLU 143.A N LYS 140.A O no hydrogen 3.064 N/A ASN 144.A N LYS 140.A O no hydrogen 2.922 N/A ASN 144.A ND2 LEU 139.A O no hydrogen 2.762 N/A ALA 146.A N ASN 144.A OD1 no hydrogen 2.986 N/A ASN 147.A N ASN 144.A O no hydrogen 3.050 N/A ASN 147.A ND2 GLN 141.A O no hydrogen 2.917 N/A ASN 147.A ND2 THR 176.A OG1 no hydrogen 2.853 N/A GLN 149.A N PRO 145.A O no hydrogen 3.028 N/A GLN 149.A NE2 GLU 153.A OE2 no hydrogen 3.234 N/A ILE 150.A N ALA 146.A O no hydrogen 3.298 N/A HIS 151.A ND1 THR 155.A OG1 no hydrogen 2.803 N/A ARG 152.A N PRO 148.A O no hydrogen 2.915 N/A ARG 152.A NE ASP 190.A OD2 no hydrogen 2.867 N/A ARG 152.A NH2 ASP 190.A OD1 no hydrogen 2.856 N/A GLU 153.A N GLN 149.A O no hydrogen 2.874 N/A THR 154.A N ILE 150.A O no hydrogen 2.909 N/A THR 154.A OG1 ILE 150.A O no hydrogen 2.668 N/A THR 155.A OG1 HIS 151.A ND1 no hydrogen 2.803 N/A GLY 156.A N HIS 151.A O no hydrogen 2.762 N/A GLU 158.A N THR 154.A O no hydrogen 2.806 N/A ILE 159.A N THR 155.A O no hydrogen 3.138 N/A TRP 160.A N GLY 156.A O no hydrogen 2.952 N/A LYS 161.A N PRO 157.A O no hydrogen 2.846 N/A ASP 162.A N GLU 158.A O no hydrogen 2.949 N/A THR 163.A N ILE 159.A O no hydrogen 3.149 N/A THR 163.A OG1 ILE 159.A O no hydrogen 2.795 N/A THR 163.A OG1 TRP 160.A O no hydrogen 3.381 N/A ASP 164.A N LYS 161.A O no hydrogen 3.103 N/A GLY 165.A N TRP 160.A O no hydrogen 2.837 N/A LYS 166.A N THR 163.A O no hydrogen 2.907 N/A VAL 167.A N THR 163.A OG1 no hydrogen 3.290 N/A ASP 168.A N LEU 291.A O no hydrogen 2.920 N/A VAL 169.A N LEU 291.A O no hydrogen 3.140 N/A VAL 170.A N THR 196.A O no hydrogen 2.938 N/A VAL 171.A N VAL 293.A O no hydrogen 2.865 N/A ALA 172.A N VAL 198.A O no hydrogen 3.047 N/A VAL 174.A N VAL 200.A O no hydrogen 3.082 N/A GLY 178.A N THR 176.A OG1 no hydrogen 3.149 N/A THR 181.A N GLY 177.A O no hydrogen 3.018 N/A THR 181.A OG1 GLY 177.A O no hydrogen 2.882 N/A THR 181.A OG1 ASN 235.A O no hydrogen 2.814 N/A GLY 182.A N GLY 178.A O no hydrogen 2.943 N/A ILE 183.A N SER 179.A O no hydrogen 2.944 N/A SER 184.A N ILE 180.A O no hydrogen 2.942 N/A SER 184.A OG ILE 180.A O no hydrogen 2.727 N/A SER 184.A OG SER 197.A OG no hydrogen 2.640 N/A ARG 185.A N THR 181.A O no hydrogen 2.922 N/A ARG 185.A NE ASP 237.A OD2 no hydrogen 3.191 N/A ARG 185.A NH2 ASP 237.A OD2 no hydrogen 3.034 N/A ALA 186.A N GLY 182.A O no hydrogen 2.936 N/A ILE 187.A N ILE 183.A O no hydrogen 3.017 N/A LYS 188.A N SER 184.A O no hydrogen 2.872 N/A LYS 188.A NZ ILE 240.A O no hydrogen 2.815 N/A LYS 188.A NZ ASP 242.A OD1 no hydrogen 3.566 N/A LYS 188.A NZ ASP 242.A OD2 no hydrogen 2.614 N/A LEU 189.A N ARG 185.A O no hydrogen 2.842 N/A ASP 190.A N ARG 185.A O no hydrogen 3.290 N/A PHE 191.A N ALA 186.A O no hydrogen 2.929 N/A LYS 193.A N ILE 187.A O no hydrogen 2.924 N/A LYS 193.A NZ GLY 165.A O no hydrogen 2.917 N/A LYS 193.A NZ VAL 167.A O no hydrogen 2.849 N/A LYS 193.A NZ ASP 168.A OD1 no hydrogen 3.249 N/A ILE 195.A N LYS 193.A O no hydrogen 2.910 N/A THR 196.A N ASP 168.A O no hydrogen 2.916 N/A SER 197.A N ASP 242.A OD2 no hydrogen 2.792 N/A SER 197.A OG SER 184.A OG no hydrogen 2.640 N/A VAL 198.A N VAL 170.A O no hydrogen 2.817 N/A ALA 199.A N ARG 243.A O no hydrogen 2.935 N/A VAL 200.A N ALA 172.A O no hydrogen 2.965 N/A GLU 201.A N GLU 245.A O no hydrogen 3.096 N/A VAL 203.A N VAL 247.A O no hydrogen 2.934 N/A GLU 204.A N GLU 204.A OE1 no hydrogen 2.666 N/A SER 205.A N PRO 202.A O no hydrogen 3.000 N/A VAL 207.A N SER 205.A O no hydrogen 2.907 N/A ILE 208.A N GLU 201.A OE1 no hydrogen 2.749 N/A SER 209.A N GLU 201.A OE2 no hydrogen 2.746 N/A SER 209.A OG GLU 201.A OE2 no hydrogen 2.569 N/A GLN 210.A N PRO 206.A O no hydrogen 2.960 N/A GLN 210.A NE2 LYS 218.A O no hydrogen 3.695 N/A THR 211.A N VAL 207.A O no hydrogen 2.885 N/A THR 211.A OG1 VAL 207.A O no hydrogen 2.795 N/A LEU 212.A N ILE 208.A O no hydrogen 2.979 N/A ALA 213.A N SER 209.A O no hydrogen 3.097 N/A ALA 213.A N GLN 210.A O no hydrogen 3.189 N/A GLY 214.A N THR 211.A O no hydrogen 2.950 N/A GLU 215.A N GLN 210.A O no hydrogen 2.832 N/A LYS 218.A N GLN 210.A OE1 no hydrogen 2.833 N/A GLY 220.A N SER 205.A OG no hydrogen 3.059 N/A HIS 222.A NE2 ILE 227.A O no hydrogen 3.017 N/A LYS 223.A N SER 249.A OG no hydrogen 2.855 N/A ILE 227.A N ILE 224.A O no hydrogen 3.284 N/A GLY 228.A N VAL 174.A O no hydrogen 3.280 N/A ASN 235.A N PHE 142.A O no hydrogen 3.037 N/A ASN 235.A ND2 GLN 141.A O no hydrogen 2.935 N/A ASN 235.A ND2 ASN 144.A O no hydrogen 2.990 N/A LEU 236.A N PRO 233.A O no hydrogen 3.010 N/A ASP 237.A N THR 181.A OG1 no hydrogen 2.926 N/A SER 239.A N ASP 237.A OD1 no hydrogen 3.105 N/A ILE 240.A N ASP 237.A O no hydrogen 3.112 N/A ILE 241.A N LEU 238.A O no hydrogen 3.101 N/A ASP 242.A N SER 197.A O no hydrogen 2.902 N/A ARG 243.A N SER 197.A O no hydrogen 3.175 N/A ARG 243.A NE GLU 245.A OE2 no hydrogen 2.801 N/A GLU 245.A N ALA 199.A O no hydrogen 2.882 N/A VAL 247.A N GLU 201.A O no hydrogen 2.990 N/A SER 249.A N GLU 204.A OE2 no hydrogen 2.839 N/A SER 249.A OG GLU 204.A OE2 no hydrogen 2.782 N/A THR 251.A N ASP 248.A OD2 no hydrogen 2.833 N/A THR 251.A OG1 ASP 248.A OD1 no hydrogen 2.656 N/A THR 251.A OG1 ASP 248.A OD2 no hydrogen 3.233 N/A ALA 252.A N ASP 248.A O no hydrogen 2.928 N/A LEU 253.A N SER 249.A O no hydrogen 2.872 N/A ALA 254.A N ASP 250.A O no hydrogen 2.840 N/A THR 255.A N THR 251.A O no hydrogen 2.839 N/A THR 255.A OG1 THR 251.A O no hydrogen 2.688 N/A ALA 256.A N ALA 252.A O no hydrogen 2.986 N/A ARG 257.A N LEU 253.A O no hydrogen 2.968 N/A ARG 257.A NE LEU 308.A O no hydrogen 2.949 N/A ARG 257.A NH2 ALA 307.A O no hydrogen 2.856 N/A ARG 258.A N ALA 254.A O no hydrogen 2.987 N/A ARG 258.A NE GLU 262.A OE1 no hydrogen 3.381 N/A ARG 258.A NE GLU 262.A OE2 no hydrogen 2.834 N/A ARG 258.A NH2 HIS 20.A O no hydrogen 3.173 N/A ARG 258.A NH2 GLU 262.A OE1 no hydrogen 2.877 N/A LEU 259.A N THR 255.A O no hydrogen 2.903 N/A MET 260.A N ALA 256.A O no hydrogen 3.191 N/A ALA 261.A N ARG 257.A O no hydrogen 2.931 N/A GLU 262.A N ARG 258.A O no hydrogen 2.756 N/A GLU 263.A N LEU 259.A O no hydrogen 3.063 N/A GLY 264.A N MET 260.A O no hydrogen 3.073 N/A ILE 265.A N LEU 259.A O no hydrogen 3.038 N/A ALA 267.A N ILE 265.A O no hydrogen 3.000 N/A GLY 268.A N SER 298.A O no hydrogen 3.042 N/A GLY 272.A N GLY 268.A O no hydrogen 3.285 N/A ALA 273.A N ILE 269.A O no hydrogen 3.103 N/A ALA 274.A N SER 270.A O no hydrogen 2.980 N/A VAL 275.A N SER 271.A O no hydrogen 3.012 N/A ALA 276.A N GLY 272.A O no hydrogen 2.900 N/A ALA 277.A N ALA 273.A O no hydrogen 3.078 N/A ALA 278.A N ALA 274.A O no hydrogen 2.911 N/A ASP 279.A N VAL 275.A O no hydrogen 2.743 N/A ARG 280.A N ALA 276.A O no hydrogen 3.175 N/A ARG 280.A NH1 GLU 245.A OE1 no hydrogen 2.934 N/A ARG 280.A NH1 THR 246.A O no hydrogen 3.003 N/A ARG 280.A NH2 THR 246.A O no hydrogen 3.483 N/A LEU 281.A N ALA 277.A O no hydrogen 3.230 N/A ALA 282.A N ALA 278.A O no hydrogen 2.778 N/A LYS 283.A N ARG 280.A O no hydrogen 3.433 N/A LYS 283.A NZ ASP 279.A OD1 no hydrogen 3.150 N/A LYS 283.A NZ ASP 279.A OD2 no hydrogen 3.031 N/A LEU 284.A N LEU 281.A O no hydrogen 3.059 N/A PHE 287.A N LEU 284.A O no hydrogen 2.813 N/A ALA 288.A N PRO 285.A O no hydrogen 3.132 N/A LYS 290.A N PHE 287.A O no hydrogen 3.218 N/A LEU 291.A N ASP 168.A OD2 no hydrogen 2.840 N/A ILE 292.A N ASN 26.A O no hydrogen 2.795 N/A VAL 293.A N VAL 169.A O no hydrogen 2.891 N/A VAL 294.A N VAL 28.A O no hydrogen 2.865 N/A ILE 295.A N VAL 171.A O no hydrogen 2.991 N/A LEU 296.A N LYS 30.A O no hydrogen 3.018 N/A SER 298.A OG TYR 303.A OH no hydrogen 2.570 N/A SER 300.A N LEU 266.A O no hydrogen 3.021 N/A SER 300.A OG ALA 267.A O no hydrogen 2.980 N/A ARG 302.A N ALA 299.A O no hydrogen 3.339 N/A ARG 302.A NH1 SER 37.A O no hydrogen 3.350 N/A ARG 302.A NH1 ASN 70.A OD1 no hydrogen 2.991 N/A ARG 302.A NH2 SER 37.A O no hydrogen 2.878 N/A TYR 303.A N SER 300.A O no hydrogen 2.820 N/A TYR 303.A OH SER 298.A OG no hydrogen 2.570 N/A SER 305.A OG GLU 97.A OE1 no hydrogen 3.229 N/A THR 306.A N TYR 303.A O no hydrogen 3.017 N/A THR 306.A OG1 TYR 303.A O no hydrogen 2.566 N/A LEU 308.A N THR 306.A OG1 no hydrogen 3.149 N/A PHE 309.A N THR 306.A O no hydrogen 3.083 N/A