Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qe4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N GLU 5.A OE1 no hydrogen 2.834 N/A MET 6.A N ASP 2.A O no hydrogen 2.894 N/A ILE 7.A N GLU 3.A O no hydrogen 3.002 N/A LYS 8.A N PHE 4.A O no hydrogen 2.765 N/A THR 11.A N LYS 8.A O no hydrogen 3.357 N/A THR 11.A OG1 LYS 8.A O no hydrogen 2.774 N/A SER 12.A N HIS 192.A O no hydrogen 2.725 N/A GLU 13.A N HIS 192.A O no hydrogen 3.486 N/A ILE 15.A N CYS 190.A O no hydrogen 2.822 N/A SER 16.A OG GLU 19.A OE2 no hydrogen 2.890 N/A GLU 17.A N ILE 14.A O no hydrogen 3.340 N/A LEU 20.A N SER 16.A O no hydrogen 3.002 N/A ARG 21.A N GLU 17.A O no hydrogen 3.190 N/A ARG 21.A NH1 GLU 18.A OE1 no hydrogen 3.049 N/A GLU 22.A N GLU 18.A O no hydrogen 3.289 N/A VAL 23.A N GLU 19.A O no hydrogen 2.930 N/A LEU 24.A N LEU 20.A O no hydrogen 2.941 N/A LYS 25.A N ARG 21.A O no hydrogen 3.276 N/A LYS 25.A N GLU 22.A O no hydrogen 3.051 N/A LYS 26.A N VAL 23.A O no hydrogen 2.913 N/A LYS 26.A NZ GLU 22.A OE2 no hydrogen 3.398 N/A LYS 29.A NZ LYS 26.A O no hydrogen 2.736 N/A LYS 29.A NZ ASP 27.A O no hydrogen 3.474 N/A SER 30.A N ASP 165.A OD2 no hydrogen 2.955 N/A SER 30.A OG.A GLY 163.A O no hydrogen 3.319 N/A SER 30.A OG.A ASP 165.A OD2 no hydrogen 2.976 N/A ALA 31.A N ASP 61.A O no hydrogen 2.840 N/A LEU 32.A N VAL 166.A O no hydrogen 3.076 N/A ILE 33.A N ILE 63.A O no hydrogen 3.219 N/A PHE 35.A N VAL 65.A O no hydrogen 2.909 N/A SER 38.A OG LYS 40.A O no hydrogen 2.668 N/A SER 38.A OG SER 207.A OG no hydrogen 2.705 N/A LEU 43.A N ILE 213.A O no hydrogen 3.133 N/A GLY 44.A N HIS 42.A ND1 no hydrogen 3.070 N/A TYR 46.A N HIS 42.A O no hydrogen 3.216 N/A LEU 47.A N LEU 43.A O no hydrogen 3.088 N/A ILE 49.A N HIS 45.A O no hydrogen 3.099 N/A LYS 50.A N TYR 46.A O no hydrogen 2.805 N/A LYS 51.A N LEU 47.A O no hydrogen 3.256 N/A LYS 51.A NZ MET 6.A O no hydrogen 3.229 N/A LYS 51.A NZ ILE 7.A O no hydrogen 2.775 N/A LYS 51.A NZ ARG 9.A O no hydrogen 2.561 N/A LYS 51.A NZ ASP 54.A OD2 no hydrogen 2.782 N/A MET 52.A N GLN 48.A O no hydrogen 3.015 N/A ILE 53.A N ILE 49.A O no hydrogen 2.879 N/A ASP 54.A N LYS 50.A O no hydrogen 3.004 N/A LEU 55.A N LYS 51.A O no hydrogen 2.994 N/A GLN 56.A N MET 52.A O no hydrogen 2.656 N/A ASN 57.A N ILE 53.A O no hydrogen 2.770 N/A ALA 58.A N ASP 54.A O no hydrogen 3.236 N/A ALA 58.A N LEU 55.A O no hydrogen 3.016 N/A GLY 59.A N GLN 56.A O no hydrogen 3.180 N/A PHE 60.A N LEU 55.A O no hydrogen 3.180 N/A ASP 61.A N LYS 29.A O no hydrogen 2.832 N/A ILE 63.A N ALA 31.A O no hydrogen 2.822 N/A ILE 64.A N LYS 101.A O no hydrogen 2.832 N/A VAL 65.A N ILE 33.A O no hydrogen 2.881 N/A LEU 66.A N VAL 103.A O no hydrogen 2.725 N/A ALA 67.A N PHE 35.A O no hydrogen 2.929 N/A ALA 71.A N ALA 67.A O no hydrogen 3.142 N/A TYR 72.A N ASP 68.A O no hydrogen 2.994 N/A LEU 73.A N LEU 69.A O no hydrogen 2.948 N/A ASN 74.A N HIS 70.A O no hydrogen 2.761 N/A GLN 75.A N TYR 72.A O no hydrogen 3.188 N/A GLN 75.A NE2 ASP 141.A OD1 no hydrogen 2.707 N/A LYS 76.A N ALA 71.A O no hydrogen 2.996 N/A LYS 76.A NZ ASN 74.A O no hydrogen 3.201 N/A LEU 79.A N GLU 78.A OE2 no hydrogen 3.134 N/A ILE 82.A N GLU 78.A O no hydrogen 2.929 N/A ARG 83.A N LEU 79.A O no hydrogen 3.150 N/A LYS 84.A N ASP 80.A O no hydrogen 3.260 N/A ILE 85.A N GLU 81.A O no hydrogen 3.352 N/A GLY 86.A N ILE 82.A O no hydrogen 2.838 N/A ASP 87.A N ARG 83.A O no hydrogen 2.753 N/A ASP 87.A N LYS 84.A O no hydrogen 2.989 N/A TYR 88.A N LYS 84.A O no hydrogen 3.192 N/A ASN 89.A N ILE 85.A O no hydrogen 3.007 N/A ASN 89.A ND2 SER 38.A O no hydrogen 3.378 N/A LYS 90.A N GLY 86.A O no hydrogen 3.115 N/A LYS 90.A NZ GLU 94.A OE2 no hydrogen 2.937 N/A LYS 91.A N ASP 87.A O no hydrogen 3.390 N/A LYS 91.A NZ ASP 87.A O no hydrogen 2.815 N/A VAL 92.A N TYR 88.A O no hydrogen 3.115 N/A PHE 93.A N ASN 89.A O no hydrogen 2.901 N/A GLU 94.A N LYS 90.A O no hydrogen 2.762 N/A ALA 95.A N VAL 92.A O no hydrogen 3.009 N/A MET 96.A N PHE 93.A O no hydrogen 3.226 N/A LYS 99.A N GLN 56.A OE1 no hydrogen 3.394 N/A LYS 101.A N ILE 62.A O no hydrogen 2.870 N/A VAL 103.A N ILE 64.A O no hydrogen 2.848 N/A TYR 104.A N GLU 107.A OE2 no hydrogen 3.199 N/A TYR 104.A OH ASP 87.A OD1 no hydrogen 2.739 N/A GLY 105.A N LEU 66.A O no hydrogen 2.871 N/A SER 106.A N ASP 68.A OD1 no hydrogen 2.840 N/A SER 106.A OG ASP 68.A OD1 no hydrogen 3.218 N/A SER 106.A OG ASP 68.A OD2 no hydrogen 2.577 N/A GLU 107.A N TYR 104.A O no hydrogen 3.092 N/A MET 109.A N GLY 105.A O no hydrogen 2.781 N/A ASP 111.A N TRP 108.A O no hydrogen 3.330 N/A TYR 114.A OH MET 154.A O no hydrogen 2.413 N/A THR 115.A N ASP 111.A O no hydrogen 2.883 N/A THR 115.A OG1 ASP 111.A O no hydrogen 3.084 N/A LEU 116.A N LYS 112.A O no hydrogen 2.822 N/A ASN 117.A N ASP 113.A O no hydrogen 3.394 N/A ASN 117.A ND2 ASN 157.A OD1 no hydrogen 2.753 N/A VAL 118.A N TYR 114.A O no hydrogen 3.097 N/A TYR 119.A N THR 115.A O no hydrogen 3.190 N/A ARG 120.A N LEU 116.A O no hydrogen 3.156 N/A ARG 120.A NE ASN 117.A OD1 no hydrogen 3.355 N/A ARG 120.A NH2 ASN 117.A OD1 no hydrogen 3.368 N/A LEU 121.A N ASN 117.A O no hydrogen 2.933 N/A ALA 122.A N VAL 118.A O no hydrogen 2.883 N/A LEU 123.A N TYR 119.A O no hydrogen 3.226 N/A LYS 124.A N LEU 121.A O no hydrogen 3.112 N/A THR 125.A N LEU 121.A O no hydrogen 2.823 N/A THR 125.A OG1 LEU 121.A O no hydrogen 2.562 N/A ARG 129.A N THR 126.A OG1 no hydrogen 3.219 N/A ALA 130.A N THR 126.A O no hydrogen 3.127 N/A ARG 131.A N LEU 127.A O no hydrogen 2.809 N/A ARG 131.A NE GLU 148.A OE1 no hydrogen 3.350 N/A ARG 132.A N LYS 128.A O no hydrogen 2.893 N/A SER 133.A N ARG 129.A O no hydrogen 2.965 N/A SER 133.A OG ARG 129.A O no hydrogen 3.518 N/A SER 133.A OG ALA 130.A O no hydrogen 2.739 N/A MET 134.A N ARG 131.A O no hydrogen 3.290 N/A GLU 135.A N ARG 132.A O no hydrogen 3.415 N/A ILE 137.A N MET 134.A O no hydrogen 2.776 N/A ALA 138.A N MET 134.A O no hydrogen 2.807 N/A ASN 143.A N ASP 141.A OD2 no hydrogen 2.971 N/A LYS 145.A NZ ASP 141.A OD1 no hydrogen 3.222 N/A LYS 145.A NZ ASP 141.A OD2 no hydrogen 3.376 N/A LYS 145.A NZ ASN 143.A O no hydrogen 2.606 N/A GLU 148.A N LYS 145.A O no hydrogen 3.141 N/A VAL 149.A N VAL 146.A O no hydrogen 3.259 N/A TYR 151.A N ALA 147.A O no hydrogen 3.096 N/A TYR 151.A OH GLU 36.A OE2 no hydrogen 2.617 N/A MET 154.A N ILE 150.A O no hydrogen 3.068 N/A MET 154.A N TYR 151.A O no hydrogen 3.294 N/A GLN 155.A N TYR 151.A O no hydrogen 3.163 N/A GLN 155.A NE2 GLN 173.A OE1 no hydrogen 3.067 N/A VAL 156.A N PRO 152.A O no hydrogen 2.915 N/A ASN 157.A N ILE 153.A O no hydrogen 3.189 N/A ASN 157.A ND2 TYR 114.A O no hydrogen 3.327 N/A GLY 158.A N GLN 155.A O no hydrogen 3.036 N/A TYR 161.A N ASN 157.A O no hydrogen 2.740 N/A LEU 162.A N GLY 158.A O no hydrogen 2.973 N/A GLY 163.A N HIS 160.A O no hydrogen 3.175 N/A ASP 165.A N SER 30.A O no hydrogen 2.863 N/A VAL 166.A N SER 30.A O no hydrogen 3.194 N/A ALA 167.A N VAL 189.A O no hydrogen 2.726 N/A VAL 168.A N LEU 32.A O no hydrogen 2.804 N/A GLY 169.A N ILE 191.A O no hydrogen 3.193 N/A MET 171.A N ASN 193.A O no hydrogen 3.046 N/A GLN 173.A N GLY 170.A O no hydrogen 3.122 N/A GLN 173.A NE2 GLU 172.A OE2 no hydrogen 3.114 N/A ARG 174.A N MET 171.A O no hydrogen 3.134 N/A ARG 174.A NH1 GLU 13.A OE2 no hydrogen 3.022 N/A HIS 177.A N GLN 173.A O no hydrogen 2.930 N/A MET 178.A N ARG 174.A O no hydrogen 2.940 N/A LEU 179.A N LYS 175.A O no hydrogen 3.002 N/A ALA 180.A N ILE 176.A O no hydrogen 2.897 N/A ARG 181.A N HIS 177.A O no hydrogen 3.086 N/A ARG 181.A NH1 GLU 19.A OE1 no hydrogen 3.373 N/A ARG 181.A NH1 VAL 188.A O no hydrogen 2.740 N/A ARG 181.A NH2 GLU 19.A OE2 no hydrogen 2.721 N/A GLU 182.A N LEU 179.A O no hydrogen 2.915 N/A LEU 183.A N LEU 179.A O no hydrogen 2.837 N/A LEU 184.A N ALA 180.A O no hydrogen 3.135 N/A LYS 186.A NZ ASP 165.A OD1 no hydrogen 3.251 N/A VAL 189.A N ASP 165.A O no hydrogen 2.794 N/A CYS 190.A N ILE 15.A O no hydrogen 2.736 N/A CYS 190.A SG HIS 177.A O no hydrogen 3.956 N/A CYS 190.A SG VAL 188.A O no hydrogen 3.692 N/A ILE 191.A N ALA 167.A O no hydrogen 2.941 N/A HIS 192.A N GLU 13.A O no hydrogen 2.852 N/A ASN 193.A N GLY 169.A O no hydrogen 3.043 N/A ASN 193.A ND2 GLN 48.A OE1 no hydrogen 2.809 N/A ASN 193.A ND2 GLY 169.A O no hydrogen 3.685 N/A THR 197.A N GLU 243.A OE1 no hydrogen 2.719 N/A THR 197.A OG1 GLU 243.A OE1 no hydrogen 3.547 N/A THR 197.A OG1 GLU 243.A OE2 no hydrogen 2.635 N/A LEU 199.A N ASN 211.A O no hydrogen 2.742 N/A GLY 201.A N GLY 198.A O no hydrogen 3.038 N/A GLU 202.A N ASP 200.A OD1 no hydrogen 3.349 N/A MET 205.A N LEU 196.A O no hydrogen 3.214 N/A SER 206.A N ASN 211.A OD1 no hydrogen 3.309 N/A SER 206.A OG SER 208.A OG no hydrogen 3.273 N/A SER 207.A OG SER 38.A OG no hydrogen 2.705 N/A SER 207.A OG LYS 40.A O no hydrogen 3.044 N/A SER 208.A OG SER 206.A OG no hydrogen 3.273 N/A LYS 209.A N SER 206.A O no hydrogen 3.175 N/A LYS 209.A NZ GLU 202.A O no hydrogen 2.943 N/A LYS 209.A NZ LYS 204.A O no hydrogen 3.352 N/A GLY 210.A N SER 206.A O no hydrogen 3.334 N/A ASN 211.A ND2 ASP 200.A OD1 no hydrogen 2.800 N/A ASN 211.A ND2 GLU 202.A O no hydrogen 3.662 N/A ASN 211.A ND2 LYS 204.A O no hydrogen 3.302 N/A ALA 214.A N ASP 217.A OD1 no hydrogen 2.962 N/A VAL 215.A N ILE 41.A O no hydrogen 2.803 N/A ASP 217.A N ALA 214.A O no hydrogen 3.172 N/A SER 218.A N GLU 221.A OE2 no hydrogen 3.068 N/A GLU 220.A N GLU 220.A OE1 no hydrogen 2.597 N/A ILE 222.A N SER 218.A O no hydrogen 3.089 N/A ARG 223.A N PRO 219.A O no hydrogen 2.995 N/A ARG 223.A NE GLU 293.A OE2 no hydrogen 3.010 N/A ARG 223.A NH2 GLU 293.A OE1 no hydrogen 3.413 N/A ALA 224.A N GLU 220.A O no hydrogen 2.958 N/A LYS 225.A N GLU 221.A O no hydrogen 2.883 N/A LYS 225.A NZ PHE 212.A O no hydrogen 2.959 N/A LYS 225.A NZ ASP 217.A OD1 no hydrogen 2.811 N/A ILE 226.A N ILE 222.A O no hydrogen 2.874 N/A LYS 227.A N ARG 223.A O no hydrogen 2.915 N/A LYS 228.A N ALA 224.A O no hydrogen 3.066 N/A ALA 229.A N LYS 225.A O no hydrogen 3.100 N/A TYR 230.A N LEU 199.A O no hydrogen 2.924 N/A CYS 231.A SG ASN 239.A OD1 no hydrogen 3.700 N/A ASN 239.A N VAL 236.A O no hydrogen 3.206 N/A ASN 239.A ND2 VAL 235.A O no hydrogen 2.903 N/A MET 242.A N ASN 239.A OD1 no hydrogen 2.948 N/A GLU 243.A N ASN 239.A O no hydrogen 3.037 N/A ILE 244.A N PRO 240.A O no hydrogen 3.134 N/A ALA 245.A N ILE 241.A O no hydrogen 3.086 N/A LYS 246.A N MET 242.A O no hydrogen 2.929 N/A LYS 246.A NZ ASN 10.A OD1 no hydrogen 3.124 N/A LYS 246.A NZ TYR 247.A OH no hydrogen 3.455 N/A TYR 247.A N GLU 243.A O no hydrogen 3.004 N/A PHE 248.A N ILE 244.A O no hydrogen 2.943 N/A TYR 251.A OH ALA 245.A O no hydrogen 2.854 N/A LEU 253.A N VAL 267.A O no hydrogen 2.695 N/A THR 254.A OG1 THR 266.A OG1 no hydrogen 2.972 N/A ILE 255.A N LEU 265.A O no hydrogen 2.748 N/A ARG 257.A N ASP 264.A OD2 no hydrogen 3.205 N/A PHE 261.A N PRO 258.A O no hydrogen 3.006 N/A GLY 263.A N PRO 258.A O no hydrogen 3.259 N/A THR 266.A OG1 THR 254.A OG1 no hydrogen 2.972 N/A VAL 267.A N LEU 253.A O no hydrogen 2.579 N/A ASN 268.A N GLU 272.A OE1 no hydrogen 2.621 N/A TYR 270.A OH GLU 274.A OE2 no hydrogen 3.330 N/A GLU 272.A N SER 269.A OG no hydrogen 3.099 N/A LEU 273.A N SER 269.A O no hydrogen 3.104 N/A GLU 274.A N TYR 270.A O no hydrogen 2.763 N/A SER 275.A N GLU 271.A O no hydrogen 3.041 N/A SER 275.A OG GLU 272.A O no hydrogen 3.308 N/A LEU 276.A N GLU 272.A O no hydrogen 2.986 N/A PHE 277.A N LEU 273.A O no hydrogen 2.860 N/A LYS 278.A N GLU 274.A O no hydrogen 2.829 N/A ASN 279.A N SER 275.A O no hydrogen 3.206 N/A LYS 280.A N PHE 277.A O no hydrogen 3.159 N/A LYS 280.A NZ ALA 233.A O no hydrogen 3.212 N/A LEU 282.A N LEU 276.A O no hydrogen 3.317 N/A LEU 287.A N HIS 283.A O no hydrogen 2.994 N/A LYS 288.A N PRO 284.A O no hydrogen 2.724 N/A LYS 288.A NZ ILE 226.A O no hydrogen 3.327 N/A LYS 288.A NZ LYS 227.A O no hydrogen 2.767 N/A LYS 288.A NZ ALA 229.A O no hydrogen 2.696 N/A ASN 289.A N MET 285.A O no hydrogen 2.958 N/A ALA 290.A N ASP 286.A O no hydrogen 3.181 N/A VAL 291.A N LEU 287.A O no hydrogen 2.846 N/A ALA 292.A N LYS 288.A O no hydrogen 2.826 N/A GLU 293.A N ASN 289.A O no hydrogen 3.079 N/A GLU 294.A N ALA 290.A O no hydrogen 3.043 N/A LEU 295.A N VAL 291.A O no hydrogen 2.883 N/A ILE 296.A N ALA 292.A O no hydrogen 3.003 N/A LYS 297.A N GLU 293.A O no hydrogen 3.361 N/A ILE 298.A N GLU 294.A O no hydrogen 3.051 N/A LEU 299.A N LEU 295.A O no hydrogen 2.993 N/A ARG 303.A N LEU 299.A O no hydrogen 2.917 N/A ARG 303.A NH1 ILE 296.A O no hydrogen 3.485 N/A ARG 303.A NH2 ILE 296.A O no hydrogen 3.406 N/A LYS 304.A N GLU 300.A O no hydrogen 2.922 N/A ARG 305.A N PRO 301.A O no hydrogen 3.028 N/A ARG 305.A NH1 PRO 301.A O no hydrogen 2.965 N/A LEU 306.A N ILE 302.A O no hydrogen 3.257 N/A LEU 306.A N ARG 303.A O no hydrogen 3.094 N/A