Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2gu2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 1.A SG GLU 204.A OE2 no hydrogen 3.168 N/A VAL 2.A N SER 296.A O no hydrogen 2.679 N/A GLU 4.A N ARG 298.A O no hydrogen 3.035 N/A ILE 7.A N ASN 200.A OD1 no hydrogen 2.956 N/A LYS 8.A N ASP 105.A OD2 no hydrogen 2.859 N/A LYS 9.A N ASP 105.A OD2 no hydrogen 2.971 N/A LYS 9.A NZ ASP 102.A O no hydrogen 2.780 N/A ILE 10.A N GLU 43.A O no hydrogen 2.788 N/A ALA 11.A N VAL 106.A O no hydrogen 2.882 N/A ILE 12.A N LYS 45.A O no hydrogen 2.987 N/A PHE 13.A N PHE 108.A O no hydrogen 2.802 N/A GLY 14.A N PHE 47.A O no hydrogen 3.093 N/A THR 16.A OG1 THR 49.A OG1 no hydrogen 2.762 N/A THR 16.A OG1 ASP 109.A OD1 no hydrogen 2.702 N/A THR 16.A OG1 ASP 109.A OD2 no hydrogen 3.387 N/A HIS 17.A NE2 ASP 64.A OD1 no hydrogen 2.813 N/A GLY 18.A N ARG 59.A O no hydrogen 3.198 N/A GLU 20.A N HIS 17.A O no hydrogen 3.134 N/A THR 22.A N ASN 112.A OD1 no hydrogen 3.105 N/A THR 22.A OG1 ASN 112.A OD1 no hydrogen 3.139 N/A PHE 25.A N LEU 21.A O no hydrogen 2.815 N/A LEU 26.A N THR 22.A O no hydrogen 2.952 N/A VAL 27.A N GLY 23.A O no hydrogen 3.014 N/A THR 28.A N VAL 24.A O no hydrogen 2.893 N/A THR 28.A OG1 VAL 24.A O no hydrogen 2.818 N/A HIS 29.A N PHE 25.A O no hydrogen 2.983 N/A TRP 30.A N LEU 26.A O no hydrogen 2.847 N/A TRP 30.A NE1 GLU 36.A OE1 no hydrogen 2.838 N/A LEU 31.A N VAL 27.A O no hydrogen 2.883 N/A LYS 32.A N THR 28.A O no hydrogen 3.417 N/A ASN 33.A N HIS 29.A O no hydrogen 2.788 N/A ASN 33.A ND2 HIS 29.A O no hydrogen 3.057 N/A VAL 37.A N GLY 34.A O no hydrogen 3.017 N/A HIS 38.A N ALA 35.A O no hydrogen 3.263 N/A ARG 39.A NE ASP 194.A OD1 no hydrogen 2.836 N/A ARG 39.A NH1 GLU 36.A O no hydrogen 2.944 N/A ARG 39.A NH1 HIS 38.A O no hydrogen 2.830 N/A ARG 39.A NH2 LYS 190.A O no hydrogen 3.183 N/A ARG 39.A NH2 ASP 194.A OD1 no hydrogen 3.060 N/A LEU 42.A N ARG 39.A O no hydrogen 3.122 N/A GLU 43.A N LYS 8.A O no hydrogen 2.924 N/A LYS 45.A N ILE 10.A O no hydrogen 2.832 N/A LYS 45.A NZ PRO 46.A O no hydrogen 2.869 N/A PHE 47.A N ILE 12.A O no hydrogen 2.781 N/A THR 49.A N GLY 14.A O no hydrogen 2.997 N/A THR 49.A OG1 GLY 14.A O no hydrogen 3.318 N/A THR 49.A OG1 THR 16.A OG1 no hydrogen 2.762 N/A ASN 50.A N GLY 15.A O no hydrogen 3.078 N/A ASN 50.A ND2 GLU 84.A OE2 no hydrogen 3.014 N/A ALA 53.A N ASN 50.A OD1 no hydrogen 3.288 N/A VAL 54.A N ASN 50.A O no hydrogen 2.944 N/A GLU 55.A N PRO 51.A O no hydrogen 2.882 N/A LYS 56.A N ARG 52.A O no hydrogen 3.393 N/A CYS 57.A N VAL 54.A O no hydrogen 2.949 N/A THR 58.A N ALA 53.A O no hydrogen 3.043 N/A ARG 59.A NH2 ASP 64.A OD2 no hydrogen 2.949 N/A TYR 60.A OH GLU 279.A OE2 no hydrogen 2.816 N/A ILE 61.A N GLU 84.A OE2 no hydrogen 2.666 N/A ASP 62.A N GLU 84.A OE1 no hydrogen 2.823 N/A CYS 63.A N GLU 84.A OE1 no hydrogen 3.073 N/A ASN 66.A N ASP 64.A OD1 no hydrogen 2.875 N/A ARG 67.A N ASP 64.A O no hydrogen 3.125 N/A PHE 69.A N ALA 157.A O no hydrogen 2.931 N/A ASN 73.A N ASP 70.A OD2 no hydrogen 3.212 N/A ASN 73.A ND2 ASP 70.A OD1 no hydrogen 2.807 N/A LEU 74.A N ASP 70.A O no hydrogen 2.995 N/A SER 75.A N LEU 71.A O no hydrogen 2.957 N/A SER 75.A OG LEU 71.A O no hydrogen 2.702 N/A SER 75.A OG GLU 72.A O no hydrogen 3.367 N/A LYS 76.A N ASN 73.A O no hydrogen 3.244 N/A LYS 76.A NZ ASN 73.A OD1 no hydrogen 2.867 N/A LEU 81.A N SER 78.A O no hydrogen 3.110 N/A TYR 83.A N ASP 62.A OD2 no hydrogen 2.786 N/A VAL 85.A N PRO 82.A O no hydrogen 3.061 N/A ARG 86.A NH1 GLU 90.A OE2 no hydrogen 3.545 N/A ARG 87.A N TYR 83.A O no hydrogen 3.013 N/A ARG 87.A NE THR 49.A O no hydrogen 2.771 N/A ARG 87.A NH1 GLU 90.A OE1 no hydrogen 2.924 N/A ARG 87.A NH2 ILE 48.A O no hydrogen 3.242 N/A ARG 87.A NH2 THR 49.A O no hydrogen 3.495 N/A ALA 88.A N GLU 84.A O no hydrogen 2.842 N/A GLN 89.A N VAL 85.A O no hydrogen 3.139 N/A GLN 89.A NE2 ASN 73.A O no hydrogen 2.883 N/A GLN 89.A NE2 LYS 76.A O no hydrogen 2.910 N/A GLU 90.A N ARG 86.A O no hydrogen 3.036 N/A ILE 91.A N ARG 87.A O no hydrogen 2.949 N/A ASN 92.A N ALA 88.A O no hydrogen 2.857 N/A HIS 93.A N GLN 89.A O no hydrogen 2.918 N/A LEU 94.A N GLU 90.A O no hydrogen 3.265 N/A PHE 95.A N ILE 91.A O no hydrogen 2.827 N/A GLY 96.A N ASN 92.A O no hydrogen 2.824 N/A LYS 98.A N ASN 92.A OD1 no hydrogen 2.809 N/A LYS 98.A NZ PHE 69.A O no hydrogen 2.730 N/A LYS 98.A NZ TYR 156.A O no hydrogen 2.603 N/A LYS 98.A NZ SER 161.A OG no hydrogen 2.825 N/A SER 100.A N PRO 97.A O no hydrogen 2.979 N/A SER 100.A OG PRO 97.A O no hydrogen 2.782 N/A ASP 102.A N SER 100.A OG no hydrogen 3.237 N/A ALA 103.A N SER 100.A O no hydrogen 3.221 N/A TYR 104.A N PHE 95.A O no hydrogen 2.915 N/A ASP 105.A N LYS 9.A O no hydrogen 3.017 N/A VAL 106.A N LYS 9.A O no hydrogen 3.278 N/A VAL 107.A N TYR 165.A O no hydrogen 3.412 N/A PHE 108.A N ALA 11.A O no hydrogen 2.933 N/A ASP 109.A N VAL 167.A O no hydrogen 2.944 N/A LEU 110.A N PHE 13.A O no hydrogen 3.003 N/A HIS 111.A N ILE 169.A O no hydrogen 2.689 N/A HIS 111.A NE2 ASP 109.A OD2 no hydrogen 2.731 N/A ASN 112.A N GLU 20.A OE1 no hydrogen 3.033 N/A ASN 112.A ND2 THR 22.A OG1 no hydrogen 2.925 N/A ASN 112.A ND2 VAL 171.A O no hydrogen 3.199 N/A THR 113.A N VAL 171.A O no hydrogen 3.263 N/A THR 113.A OG1 SER 115.A OG no hydrogen 3.300 N/A THR 113.A OG1 GLU 274.A OE1 no hydrogen 2.543 N/A THR 114.A N GLU 274.A OE1 no hydrogen 2.905 N/A THR 114.A OG1 ASN 273.A O no hydrogen 3.085 N/A THR 114.A OG1 GLU 274.A OE1 no hydrogen 3.504 N/A SER 115.A N THR 113.A OG1 no hydrogen 3.012 N/A SER 115.A OG THR 113.A OG1 no hydrogen 3.300 N/A SER 115.A OG VAL 272.A O no hydrogen 2.883 N/A ASN 116.A ND2 ASP 238.A O no hydrogen 2.861 N/A THR 119.A N GLU 170.A O no hydrogen 2.881 N/A THR 119.A OG1 GLY 117.A O no hydrogen 3.426 N/A LEU 120.A N SER 145.A O no hydrogen 2.845 N/A ILE 121.A N GLY 168.A O no hydrogen 2.920 N/A LEU 122.A N TYR 147.A O no hydrogen 2.879 N/A SER 125.A OG GLU 150.A OE1 no hydrogen 3.340 N/A SER 125.A OG GLU 150.A OE2 no hydrogen 2.882 N/A GLY 126.A N ASP 124.A OD1 no hydrogen 3.005 N/A ASN 127.A N ASP 124.A O no hydrogen 3.231 N/A LEU 130.A N ASN 127.A OD1 no hydrogen 2.971 N/A ILE 131.A N ASN 127.A O no hydrogen 3.040 N/A GLN 132.A N ASP 128.A O no hydrogen 2.904 N/A GLN 132.A NE2 PRO 206.A O no hydrogen 2.747 N/A GLN 132.A NE2 LYS 295.A O no hydrogen 2.993 N/A HIS 134.A N ILE 131.A O no hydrogen 2.919 N/A TYR 135.A N GLN 132.A O no hydrogen 2.920 N/A LYS 137.A N PHE 133.A O no hydrogen 2.909 N/A LYS 137.A NZ CYS 144.A O no hydrogen 2.779 N/A THR 138.A N HIS 134.A O no hydrogen 2.992 N/A THR 138.A OG1 HIS 134.A O no hydrogen 2.953 N/A CYS 139.A N TYR 135.A O no hydrogen 2.995 N/A CYS 139.A SG TYR 135.A O no hydrogen 3.429 N/A SER 145.A N CYS 118.A O no hydrogen 2.902 N/A TYR 147.A N LEU 120.A O no hydrogen 2.840 N/A LEU 148.A N TYR 213.A O no hydrogen 2.756 N/A ILE 149.A N LEU 122.A O no hydrogen 3.006 N/A LYS 155.A N PRO 152.A O no hydrogen 3.126 N/A LYS 155.A NZ GLY 123.A O no hydrogen 2.492 N/A LYS 155.A NZ ILE 149.A O no hydrogen 3.220 N/A LYS 155.A NZ GLU 150.A O no hydrogen 3.222 N/A TYR 156.A N PRO 152.A O no hydrogen 2.909 N/A THR 158.A N LYS 155.A O no hydrogen 3.344 N/A THR 158.A OG1 LYS 155.A O no hydrogen 2.820 N/A THR 159.A N ASN 66.A OD1 no hydrogen 2.989 N/A THR 159.A OG1 LEU 65.A O no hydrogen 3.386 N/A THR 159.A OG1 ASN 66.A OD1 no hydrogen 3.526 N/A SER 161.A N THR 158.A O no hydrogen 3.149 N/A SER 161.A OG TYR 156.A O no hydrogen 3.360 N/A SER 161.A OG THR 158.A O no hydrogen 2.630 N/A ALA 163.A N ARG 160.A O no hydrogen 3.047 N/A LYS 164.A N TYR 104.A O no hydrogen 3.100 N/A LYS 164.A NZ ASP 101.A O no hydrogen 3.064 N/A LYS 164.A NZ ASP 105.A OD1 no hydrogen 3.517 N/A TYR 165.A N ASP 105.A O no hydrogen 2.802 N/A TYR 165.A OH GLU 4.A OE2 no hydrogen 2.442 N/A VAL 167.A N VAL 107.A O no hydrogen 2.868 N/A GLY 168.A N ILE 121.A O no hydrogen 3.463 N/A ILE 169.A N ASP 109.A O no hydrogen 2.918 N/A GLU 170.A N THR 119.A O no hydrogen 2.877 N/A VAL 171.A N HIS 111.A O no hydrogen 2.986 N/A GLY 172.A N GLY 117.A O no hydrogen 3.386 N/A GLN 174.A N THR 113.A O no hydrogen 2.910 N/A GLN 174.A NE2 THR 22.A OG1 no hydrogen 2.949 N/A HIS 176.A NE2 GLU 274.A OE2 no hydrogen 2.811 N/A GLY 177.A N ASN 19.A O no hydrogen 2.891 N/A VAL 178.A N PRO 175.A O no hydrogen 3.227 N/A ARG 180.A N GLN 174.A OE1 no hydrogen 2.978 N/A ARG 180.A NE ASP 182.A OD1 no hydrogen 2.891 N/A ARG 180.A NH2 ASP 182.A OD2 no hydrogen 3.013 N/A LEU 184.A N ARG 180.A O no hydrogen 3.069 N/A ASP 185.A N ALA 181.A O no hydrogen 2.892 N/A GLN 186.A N ASP 182.A O no hydrogen 2.996 N/A ARG 187.A NE GLU 36.A OE2 no hydrogen 2.977 N/A ARG 187.A NH2 GLU 36.A OE1 no hydrogen 2.797 N/A ARG 188.A N ASP 185.A O no hydrogen 3.083 N/A LYS 190.A N ARG 187.A O no hydrogen 2.873 N/A HIS 191.A N ARG 188.A O no hydrogen 3.070 N/A LEU 193.A N LEU 189.A O no hydrogen 2.891 N/A ASP 194.A N LYS 190.A O no hydrogen 3.043 N/A PHE 195.A N HIS 191.A O no hydrogen 2.900 N/A ILE 196.A N ALA 192.A O no hydrogen 3.115 N/A GLN 197.A N LEU 193.A O no hydrogen 2.972 N/A GLN 197.A NE2 GLU 201.A OE2 no hydrogen 2.944 N/A ARG 198.A N ASP 194.A O no hydrogen 2.921 N/A PHE 199.A N PHE 195.A O no hydrogen 2.859 N/A ASN 200.A N ILE 196.A O no hydrogen 2.860 N/A ASN 200.A ND2 ILE 7.A O no hydrogen 2.825 N/A GLU 201.A N GLN 197.A O no hydrogen 2.925 N/A GLY 202.A N PHE 199.A O no hydrogen 3.026 N/A LYS 203.A N ARG 198.A O no hydrogen 3.106 N/A PHE 205.A N ILE 297.A O no hydrogen 3.062 N/A CYS 208.A N ALA 294.A O no hydrogen 3.120 N/A ILE 210.A N LEU 292.A O no hydrogen 2.898 N/A VAL 212.A N LEU 290.A O no hydrogen 2.817 N/A TYR 213.A N VAL 146.A O no hydrogen 2.902 N/A LYS 214.A N THR 288.A O no hydrogen 2.819 N/A ILE 215.A N LEU 148.A O no hydrogen 3.269 N/A VAL 218.A N PHE 284.A O no hydrogen 2.838 N/A TYR 220.A OH ASN 273.A OD1 no hydrogen 3.110 N/A ARG 222.A NE ASP 219.A OD1 no hydrogen 3.169 N/A ARG 222.A NE ASP 219.A OD2 no hydrogen 2.693 N/A ARG 222.A NH1 GLY 226.A O no hydrogen 3.302 N/A ARG 222.A NH2 ASP 219.A OD1 no hydrogen 2.826 N/A ARG 222.A NH2 TYR 278.A O no hydrogen 3.083 N/A ASN 223.A N ASP 227.A O no hydrogen 2.866 N/A ASN 223.A ND2 ASP 227.A OD1 no hydrogen 3.523 N/A ASN 223.A ND2 ASP 227.A OD2 no hydrogen 3.341 N/A SER 225.A OG ASP 227.A OD1 no hydrogen 2.769 N/A GLY 226.A N ASN 223.A O no hydrogen 2.558 N/A ALA 229.A N PRO 221.A O no hydrogen 2.834 N/A VAL 231.A N VAL 252.A O no hydrogen 2.918 N/A HIS 233.A N VAL 250.A O no hydrogen 2.836 N/A ASN 235.A N HIS 233.A ND1 no hydrogen 2.963 N/A LEU 236.A N HIS 233.A O no hydrogen 2.881 N/A GLN 237.A N HIS 233.A O no hydrogen 2.906 N/A GLN 237.A NE2 ASP 238.A OD1 no hydrogen 3.090 N/A GLN 239.A N LEU 236.A O no hydrogen 2.871 N/A GLN 239.A NE2 GLN 237.A O no hydrogen 3.686 N/A TRP 241.A N PRO 269.A O no hydrogen 2.722 N/A LYS 242.A N GLN 239.A O no hydrogen 3.164 N/A LYS 242.A NZ GLN 239.A OE1 no hydrogen 2.953 N/A LEU 244.A N VAL 267.A O no hydrogen 2.746 N/A HIS 245.A N ASP 248.A OD2 no hydrogen 2.643 N/A ASP 248.A N HIS 245.A O no hydrogen 2.845 N/A VAL 250.A N ILE 259.A O no hydrogen 2.832 N/A PHE 251.A N ILE 259.A O no hydrogen 3.075 N/A VAL 252.A N VAL 231.A O no hydrogen 2.865 N/A SER 253.A N LYS 257.A O no hydrogen 2.914 N/A SER 253.A OG ASP 255.A OD1 no hydrogen 2.165 N/A GLY 256.A N SER 253.A O no hydrogen 2.927 N/A ILE 259.A N PHE 251.A O no hydrogen 2.957 N/A LEU 261.A N ASP 248.A O no hydrogen 2.872 N/A GLY 262.A N PRO 246.A O no hydrogen 2.868 N/A CYS 265.A SG THR 266.A O no hydrogen 3.970 N/A VAL 267.A N LEU 244.A O no hydrogen 2.943 N/A TYR 268.A N THR 287.A O no hydrogen 2.865 N/A VAL 270.A N ALA 285.A O no hydrogen 2.955 N/A VAL 272.A N ASP 240.A OD2 no hydrogen 2.872 N/A ASN 273.A N ALA 283.A O no hydrogen 2.948 N/A ASN 273.A ND2 GLN 237.A OE1 no hydrogen 2.745 N/A ALA 275.A N THR 114.A OG1 no hydrogen 2.939 N/A ALA 276.A N GLU 274.A OE2 no hydrogen 2.731 N/A TYR 277.A N GLU 274.A O no hydrogen 3.206 N/A TYR 278.A N ALA 275.A O no hydrogen 3.491 N/A TYR 278.A OH ASN 273.A OD1 no hydrogen 2.562 N/A LYS 280.A N TYR 277.A O no hydrogen 3.089 N/A LYS 280.A NZ ASP 64.A OD2 no hydrogen 2.883 N/A LYS 281.A N TYR 278.A O no hydrogen 3.129 N/A LYS 281.A NZ ASP 219.A OD2 no hydrogen 3.493 N/A GLU 282.A N TYR 277.A O no hydrogen 3.100 N/A ALA 283.A N VAL 218.A O no hydrogen 2.743 N/A PHE 284.A N VAL 218.A O no hydrogen 3.488 N/A ALA 285.A N VAL 270.A O no hydrogen 2.834 N/A LYS 286.A N GLU 216.A O no hydrogen 2.775 N/A LYS 286.A NZ GLU 216.A OE2 no hydrogen 2.893 N/A THR 287.A N TYR 268.A O no hydrogen 3.053 N/A THR 287.A OG1 TYR 268.A O no hydrogen 2.645 N/A THR 288.A N LYS 214.A O no hydrogen 2.973 N/A LEU 290.A N VAL 212.A O no hydrogen 2.900 N/A THR 291.A OG1 ASP 211.A OD1 no hydrogen 3.045 N/A LEU 292.A N ILE 210.A O no hydrogen 2.793 N/A ALA 294.A N CYS 208.A O no hydrogen 2.832 N/A LYS 295.A N ASP 128.A OD1 no hydrogen 3.117 N/A ILE 297.A N PHE 205.A O no hydrogen 3.066 N/A ARG 298.A N VAL 2.A O no hydrogen 3.231 N/A ARG 298.A NE GLY 202.A O no hydrogen 3.453 N/A SER 299.A OG THR 300.A O no hydrogen 3.515 N/A THR 300.A N GLU 4.A O no hydrogen 2.594 N/A THR 300.A OG1 GLU 4.A O no hydrogen 3.085 N/A