Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5fd4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE PRO 77.A O no hydrogen 2.888 N/A ARG 2.A NH2 PRO 77.A O no hydrogen 2.899 N/A ARG 2.A NH2 TYR 79.A O no hydrogen 2.616 N/A GLY 3.A N ASP 78.A OD1 no hydrogen 2.798 N/A MET 6.A N ARG 2.A O no hydrogen 3.155 N/A VAL 8.A N GLY 3.A O no hydrogen 2.951 N/A TRP 9.A NE1 GLU 15.A OE2 no hydrogen 3.074 N/A GLU 15.A N GLU 15.A OE1 no hydrogen 2.879 N/A PHE 16.A N ASN 12.A O no hydrogen 2.960 N/A GLY 17.A N ASP 13.A O no hydrogen 3.082 N/A GLN 18.A N LYS 14.A O no hydrogen 2.927 N/A ARG 19.A N GLU 15.A O no hydrogen 3.290 N/A ARG 19.A NE LEU 75.A O no hydrogen 3.473 N/A VAL 20.A N PHE 16.A O no hydrogen 2.915 N/A ARG 21.A N GLY 17.A O no hydrogen 3.066 N/A ARG 21.A NE GLU 25.A OE2 no hydrogen 3.122 N/A GLN 22.A N GLN 18.A O no hydrogen 3.156 N/A LEU 23.A N ARG 19.A O no hydrogen 3.068 N/A ARG 24.A N VAL 20.A O no hydrogen 3.159 N/A ARG 24.A NE GLU 50.A OE2 no hydrogen 2.691 N/A ARG 24.A NH1 GLU 50.A OE1 no hydrogen 3.176 N/A ARG 24.A NH1 GLU 50.A OE2 no hydrogen 3.116 N/A ARG 24.A NH2 MET 29.A O no hydrogen 3.307 N/A GLU 25.A N ARG 21.A O no hydrogen 2.845 N/A SER 26.A N GLN 22.A O no hydrogen 2.929 N/A SER 26.A OG GLN 22.A O no hydrogen 3.377 N/A SER 26.A OG LEU 23.A O no hydrogen 3.411 N/A ALA 27.A N LEU 23.A O no hydrogen 3.202 N/A ALA 27.A N ARG 24.A O no hydrogen 3.101 N/A SER 28.A N GLU 25.A O no hydrogen 2.819 N/A MET 29.A N ARG 24.A O no hydrogen 3.374 N/A THR 30.A OG1 GLU 32.A OE1 no hydrogen 3.501 N/A THR 30.A OG1 GLN 33.A OE1 no hydrogen 3.037 N/A ARG 31.A NE GLU 50.A OE1 no hydrogen 2.850 N/A ARG 31.A NH2 GLU 50.A OE1 no hydrogen 3.400 N/A GLU 32.A N GLU 32.A OE1 no hydrogen 2.640 N/A PHE 34.A N THR 30.A O no hydrogen 2.829 N/A CYS 35.A N ARG 31.A O no hydrogen 2.999 N/A CYS 35.A SG ARG 31.A O no hydrogen 3.448 N/A ASP 36.A N GLU 32.A O no hydrogen 3.395 N/A GLU 38.A N CYS 35.A O no hydrogen 2.940 N/A LEU 39.A N ASP 37.A OD1 no hydrogen 3.349 N/A SER 42.A N GLN 45.A OE1 no hydrogen 3.107 N/A SER 42.A OG ASP 155.A OD1 no hydrogen 3.093 N/A SER 42.A OG ASP 155.A OD2 no hydrogen 2.736 N/A VAL 43.A N GLU 38.A OE1 no hydrogen 3.218 N/A ARG 44.A N SER 42.A OG no hydrogen 3.150 N/A LEU 46.A N SER 42.A O no hydrogen 2.834 N/A THR 47.A N VAL 43.A O no hydrogen 2.949 N/A THR 47.A OG1 VAL 43.A O no hydrogen 2.656 N/A ARG 48.A N ARG 44.A O no hydrogen 3.233 N/A ARG 48.A NH2 GLU 125.A OE2 no hydrogen 2.747 N/A ILE 49.A N GLN 45.A O no hydrogen 3.186 N/A GLU 50.A N LEU 46.A O no hydrogen 2.895 N/A ALA 51.A N THR 47.A O no hydrogen 2.828 N/A GLY 52.A N ILE 49.A O no hydrogen 3.026 N/A ALA 53.A N ARG 48.A O no hydrogen 2.794 N/A SER 54.A N ARG 48.A O no hydrogen 3.087 N/A LYS 55.A NZ GLU 122.A O no hydrogen 3.252 N/A LYS 60.A NZ GLU 40.A O no hydrogen 3.136 N/A LYS 60.A NZ GLN 45.A OE1 no hydrogen 2.910 N/A ILE 61.A N THR 57.A O no hydrogen 3.050 N/A GLN 62.A N PHE 58.A O no hydrogen 2.915 N/A TYR 63.A N SER 59.A O no hydrogen 3.130 N/A TYR 63.A OH PHE 34.A O no hydrogen 2.689 N/A ILE 64.A N LYS 60.A O no hydrogen 2.949 N/A ALA 65.A N ILE 61.A O no hydrogen 2.863 N/A THR 66.A N GLN 62.A O no hydrogen 3.014 N/A THR 66.A OG1 GLN 62.A O no hydrogen 3.131 N/A ARG 67.A N TYR 63.A O no hydrogen 2.899 N/A LEU 68.A N ALA 65.A O no hydrogen 2.842 N/A GLY 69.A N THR 66.A O no hydrogen 3.069 N/A MET 70.A N ALA 65.A O no hydrogen 2.965 N/A LEU 75.A N GLY 71.A O no hydrogen 3.257 N/A MET 76.A N LEU 72.A O no hydrogen 3.017 N/A TYR 79.A N MET 76.A O no hydrogen 3.135 N/A ARG 85.A NE GLU 114.A OE2 no hydrogen 2.998 N/A ARG 85.A NH2 GLU 114.A OE1 no hydrogen 3.184 N/A ARG 85.A NH2 GLU 114.A OE2 no hydrogen 3.436 N/A TYR 86.A OH GLU 127.A OE2 no hydrogen 3.035 N/A SER 87.A N PRO 83.A O no hydrogen 3.112 N/A LYS 88.A N GLU 84.A O no hydrogen 3.057 N/A LYS 88.A NZ ASP 92.A OD2 no hydrogen 3.072 N/A LEU 89.A N ARG 85.A O no hydrogen 3.073 N/A LYS 90.A N TYR 86.A O no hydrogen 2.930 N/A LYS 90.A NZ GLU 127.A OE2 no hydrogen 2.644 N/A LYS 90.A NZ ASN 169.A OD1 no hydrogen 3.002 N/A PHE 91.A N SER 87.A O no hydrogen 3.102 N/A ASP 92.A N LYS 88.A O no hydrogen 2.877 N/A VAL 93.A N LEU 89.A O no hydrogen 2.929 N/A LEU 94.A N LYS 90.A O no hydrogen 3.066 N/A ARG 95.A N PHE 91.A O no hydrogen 3.145 N/A ARG 95.A N ASP 92.A O no hydrogen 3.216 N/A ARG 95.A NH1 ASP 252.A OD2 no hydrogen 3.320 N/A THR 96.A N VAL 93.A O no hydrogen 3.379 N/A THR 96.A OG1 ASP 92.A O no hydrogen 2.643 N/A THR 96.A OG1 VAL 93.A O no hydrogen 3.182 N/A TYR 99.A OH ASP 303.A OD2 no hydrogen 2.854 N/A ASN 101.A N THR 98.A O no hydrogen 3.008 N/A GLU 102.A N GLU 295.A OE2 no hydrogen 3.081 N/A GLU 106.A N ASP 103.A O no hydrogen 3.236 N/A LYS 107.A N ASP 103.A O no hydrogen 3.225 N/A ARG 108.A N LEU 104.A O no hydrogen 2.948 N/A ARG 108.A NH2 GLN 135.A OE1 no hydrogen 3.469 N/A ALA 110.A N GLU 106.A O no hydrogen 3.264 N/A MET 111.A N LYS 107.A O no hydrogen 2.959 N/A MET 112.A N ARG 108.A O no hydrogen 3.024 N/A THR 113.A N ASP 109.A O no hydrogen 2.993 N/A THR 113.A OG1 ASP 109.A O no hydrogen 2.605 N/A GLU 114.A N ALA 110.A O no hydrogen 3.110 N/A ILE 115.A N MET 111.A O no hydrogen 2.945 N/A TYR 116.A N MET 112.A O no hydrogen 3.084 N/A TYR 116.A OH ASP 132.A OD1 no hydrogen 2.936 N/A ASP 117.A N THR 113.A O no hydrogen 2.762 N/A ASP 118.A N GLU 114.A O no hydrogen 3.011 N/A TYR 119.A N ILE 115.A O no hydrogen 2.940 N/A TYR 120.A N ILE 115.A O no hydrogen 2.905 N/A TYR 120.A OH ASP 132.A OD1 no hydrogen 3.350 N/A TYR 120.A OH ASP 132.A OD2 no hydrogen 2.799 N/A GLU 122.A N TYR 119.A O no hydrogen 3.187 N/A LEU 123.A N TYR 120.A O no hydrogen 3.078 N/A GLU 125.A N LYS 55.A O no hydrogen 2.900 N/A LYS 128.A N PRO 124.A O no hydrogen 3.074 N/A LYS 128.A NZ ASP 121.A O no hydrogen 3.441 N/A ILE 129.A N GLU 125.A O no hydrogen 3.053 N/A ALA 130.A N GLU 126.A O no hydrogen 3.064 N/A ILE 131.A N GLU 127.A O no hydrogen 3.112 N/A ASP 132.A N LYS 128.A O no hydrogen 2.973 N/A ALA 133.A N ILE 129.A O no hydrogen 2.757 N/A ILE 134.A N ILE 131.A O no hydrogen 3.266 N/A GLN 135.A N ASP 132.A O no hydrogen 3.205 N/A SER 136.A N ASP 132.A O no hydrogen 2.853 N/A SER 136.A OG ASP 132.A O no hydrogen 2.937 N/A SER 136.A OG THR 145.A OG1 no hydrogen 3.408 N/A SER 143.A N THR 140.A O no hydrogen 3.197 N/A SER 143.A OG THR 140.A O no hydrogen 3.146 N/A ILE 152.A N GLY 149.A O no hydrogen 2.926 N/A GLU 154.A N LYS 150.A O no hydrogen 2.773 N/A ASP 155.A N GLU 151.A O no hydrogen 3.376 N/A TYR 156.A N ILE 152.A O no hydrogen 3.119 N/A TYR 156.A OH GLU 125.A OE1 no hydrogen 2.931 N/A PHE 157.A N LEU 153.A O no hydrogen 2.757 N/A GLU 158.A N GLU 154.A O no hydrogen 2.774 N/A GLN 159.A N ASP 155.A O no hydrogen 3.145 N/A GLN 159.A NE2 GLU 38.A O no hydrogen 3.521 N/A GLN 159.A NE2 GLN 45.A OE1 no hydrogen 2.821 N/A ILE 160.A N TYR 156.A O no hydrogen 3.190 N/A PHE 161.A N PHE 157.A O no hydrogen 3.129 N/A ARG 162.A N GLU 158.A O no hydrogen 3.455 N/A LYS 163.A N GLN 159.A O no hydrogen 3.275 N/A LYS 163.A NZ LEU 39.A O no hydrogen 3.332 N/A TYR 166.A N GLN 204.A OE1 no hydrogen 2.729 N/A GLU 167.A N ASP 170.A OD2 no hydrogen 2.886 N/A ASN 169.A ND2 GLU 127.A OE1 no hydrogen 3.264 N/A LEU 171.A N GLU 167.A O no hydrogen 3.249 N/A LEU 172.A N LEU 168.A O no hydrogen 3.172 N/A ILE 173.A N ASN 169.A O no hydrogen 2.826 N/A VAL 174.A N ASP 170.A O no hydrogen 3.022 N/A ARG 175.A N LEU 172.A O no hydrogen 2.912 N/A ARG 175.A NE THR 219.A OG1 no hydrogen 2.908 N/A ARG 175.A NH2 VAL 215.A O no hydrogen 3.109 N/A ARG 175.A NH2 THR 219.A OG1 no hydrogen 3.142 N/A LEU 176.A N ILE 173.A O no hydrogen 3.119 N/A HIS 177.A NE2 GLN 193.A OE1 no hydrogen 3.146 N/A LEU 178.A N VAL 174.A O no hydrogen 3.345 N/A TYR 180.A OH SER 143.A O no hydrogen 2.714 N/A VAL 181.A N HIS 177.A O no hydrogen 3.213 N/A ARG 182.A N LEU 178.A O no hydrogen 3.154 N/A ARG 182.A NE GLU 179.A OE1 no hydrogen 3.485 N/A ARG 182.A NH1 ASN 225.A OD1 no hydrogen 2.983 N/A ARG 182.A NH2 GLU 179.A OE2 no hydrogen 3.074 N/A ARG 182.A NH2 ASN 225.A OD1 no hydrogen 3.338 N/A LEU 183.A N TYR 180.A O no hydrogen 3.148 N/A SER 184.A N VAL 181.A O no hydrogen 3.120 N/A SER 184.A OG TYR 180.A O no hydrogen 3.050 N/A SER 188.A N SER 185.A O no hydrogen 3.117 N/A SER 188.A OG SER 185.A O no hydrogen 2.596 N/A PHE 191.A N SER 188.A OG no hydrogen 3.219 N/A ARG 192.A N SER 188.A O no hydrogen 3.429 N/A GLN 193.A N GLU 189.A O no hydrogen 2.941 N/A PHE 194.A N ILE 190.A O no hydrogen 2.965 N/A LEU 195.A N PHE 191.A O no hydrogen 3.113 N/A LYS 196.A N ARG 192.A O no hydrogen 3.405 N/A ILE 197.A N GLN 193.A O no hydrogen 2.927 N/A ILE 198.A N PHE 194.A O no hydrogen 3.177 N/A GLU 199.A N LEU 195.A O no hydrogen 3.179 N/A HIS 200.A N LYS 196.A O no hydrogen 2.974 N/A LEU 201.A N ILE 197.A O no hydrogen 2.847 N/A HIS 202.A N ILE 198.A O no hydrogen 3.142 N/A HIS 202.A ND1 SER 242.A OG no hydrogen 2.839 N/A GLU 203.A N GLU 199.A O no hydrogen 3.424 N/A GLN 204.A N HIS 200.A O no hydrogen 2.921 N/A GLN 204.A NE2 ARG 164.A O no hydrogen 2.865 N/A ILE 205.A N HIS 202.A O no hydrogen 3.253 N/A ILE 207.A N GLN 204.A O no hydrogen 2.877 N/A ILE 208.A N GLN 204.A O no hydrogen 2.958 N/A ASN 211.A N ASN 209.A OD1 no hydrogen 2.862 N/A ASP 212.A N ASN 209.A O no hydrogen 2.932 N/A LEU 213.A N SER 210.A O no hydrogen 3.172 N/A VAL 215.A N ASP 212.A O no hydrogen 2.940 N/A LEU 216.A N ASP 212.A O no hydrogen 3.465 N/A ARG 217.A N LEU 213.A O no hydrogen 2.946 N/A ARG 217.A NE ASP 218.A OD1 no hydrogen 3.079 N/A ARG 217.A NH1 ASP 252.A OD2 no hydrogen 3.011 N/A ARG 217.A NH2 ASP 218.A OD1 no hydrogen 3.469 N/A ARG 217.A NH2 ASP 218.A OD2 no hydrogen 3.295 N/A ASP 218.A N PHE 214.A O no hydrogen 3.328 N/A THR 219.A N VAL 215.A O no hydrogen 2.946 N/A THR 219.A OG1 LEU 171.A O no hydrogen 2.911 N/A THR 219.A OG1 VAL 215.A O no hydrogen 3.039 N/A LEU 220.A N LEU 216.A O no hydrogen 2.906 N/A LEU 221.A N ARG 217.A O no hydrogen 3.010 N/A SER 222.A N ASP 218.A O no hydrogen 3.025 N/A SER 222.A OG ASP 218.A O no hydrogen 3.005 N/A CYS 223.A N THR 219.A O no hydrogen 3.326 N/A CYS 223.A N LEU 220.A O no hydrogen 3.214 N/A CYS 223.A SG THR 219.A O no hydrogen 3.583 N/A VAL 224.A N LEU 221.A O no hydrogen 3.134 N/A LEU 227.A N CYS 223.A O no hydrogen 2.831 N/A GLY 228.A N VAL 224.A O no hydrogen 2.879 N/A SER 229.A N ASN 225.A O no hydrogen 2.912 N/A SER 229.A OG ILE 226.A O no hydrogen 2.998 N/A LYS 230.A N ILE 226.A O no hydrogen 3.326 N/A LYS 230.A N LEU 227.A O no hydrogen 3.328 N/A LYS 230.A NZ ARG 182.A O no hydrogen 3.193 N/A LYS 230.A NZ SER 184.A O no hydrogen 2.410 N/A LYS 231.A N GLY 228.A O no hydrogen 3.113 N/A TYR 232.A N LEU 227.A O no hydrogen 3.008 N/A ILE 236.A N TYR 233.A O no hydrogen 3.150 N/A ILE 239.A N PRO 235.A O no hydrogen 3.402 N/A PHE 240.A N ILE 236.A O no hydrogen 3.076 N/A ASP 241.A N PRO 237.A O no hydrogen 2.982 N/A SER 242.A N LYS 238.A O no hydrogen 3.080 N/A SER 242.A OG HIS 202.A ND1 no hydrogen 2.839 N/A SER 242.A OG LYS 238.A O no hydrogen 3.560 N/A VAL 243.A N ILE 239.A O no hydrogen 2.853 N/A ASP 244.A N PHE 240.A O no hydrogen 2.912 N/A LYS 245.A N ASP 241.A O no hydrogen 2.991 N/A ILE 246.A N SER 242.A O no hydrogen 2.892 N/A ILE 247.A N VAL 243.A O no hydrogen 3.014 N/A GLN 248.A N ASP 244.A O no hydrogen 3.027 N/A SER 249.A N LYS 245.A O no hydrogen 3.373 N/A SER 249.A OG LYS 245.A O no hydrogen 2.860 N/A THR 250.A N ILE 246.A O no hydrogen 2.968 N/A THR 250.A OG1 ILE 246.A O no hydrogen 2.906 N/A THR 250.A OG1 ILE 247.A O no hydrogen 3.402 N/A GLN 251.A N ILE 247.A O no hydrogen 2.962 N/A LYS 255.A NZ ASP 218.A OD1 no hydrogen 2.814 N/A LYS 256.A N PHE 253.A O no hydrogen 3.313 N/A VAL 259.A N LYS 255.A O no hydrogen 2.872 N/A SER 260.A N LYS 256.A O no hydrogen 2.989 N/A SER 260.A OG LYS 256.A O no hydrogen 3.565 N/A VAL 261.A N PRO 257.A O no hydrogen 2.926 N/A LEU 262.A N ILE 258.A O no hydrogen 3.053 N/A LYS 263.A N VAL 259.A O no hydrogen 2.748 N/A LYS 263.A NZ ASP 244.A OD1 no hydrogen 3.439 N/A LYS 263.A NZ ASP 244.A OD2 no hydrogen 2.628 N/A TRP 264.A N SER 260.A O no hydrogen 3.061 N/A TRP 264.A NE1 ASP 307.A OD2 no hydrogen 3.122 N/A LYS 265.A N VAL 261.A O no hydrogen 2.964 N/A LYS 265.A NZ ASP 307.A OD1 no hydrogen 3.327 N/A LYS 265.A NZ ASP 307.A OD2 no hydrogen 2.778 N/A TYR 266.A N LEU 262.A O no hydrogen 3.193 N/A ALA 267.A N LYS 263.A O no hydrogen 3.229 N/A LEU 268.A N TRP 264.A O no hydrogen 2.770 N/A PHE 269.A N LYS 265.A O no hydrogen 2.784 N/A VAL 270.A N TYR 266.A O no hydrogen 2.825 N/A ASP 271.A N TYR 266.A O no hydrogen 3.124 N/A ASP 273.A N ALA 267.A O no hydrogen 2.887 N/A GLU 276.A N ASP 273.A OD1 no hydrogen 3.303 N/A ALA 277.A N ASP 273.A O no hydrogen 3.181 N/A GLU 278.A N ARG 274.A O no hydrogen 3.273 N/A LYS 279.A NZ GLU 276.A OE1 no hydrogen 3.386 N/A TYR 281.A N ALA 277.A O no hydrogen 3.105 N/A TYR 281.A OH GLU 301.A OE1 no hydrogen 2.427 N/A LEU 282.A N GLU 278.A O no hydrogen 2.992 N/A ASP 283.A N LYS 279.A O no hydrogen 3.090 N/A ALA 284.A N HIS 280.A O no hydrogen 3.083 N/A VAL 285.A N TYR 281.A O no hydrogen 3.198 N/A LEU 286.A N LEU 282.A O no hydrogen 2.903 N/A PHE 287.A N ASP 283.A O no hydrogen 2.864 N/A ALA 288.A N ALA 284.A O no hydrogen 3.084 N/A LYS 289.A N VAL 285.A O no hydrogen 2.842 N/A LEU 290.A N LEU 286.A O no hydrogen 2.957 N/A ILE 291.A N PHE 287.A O no hydrogen 3.089 N/A GLU 292.A N LYS 289.A O no hydrogen 3.068 N/A ASN 293.A N ALA 288.A O no hydrogen 3.026 N/A ASN 293.A ND2 ASN 101.A OD1 no hydrogen 3.368 N/A LEU 296.A N ASN 293.A OD1 no hydrogen 3.169 N/A GLU 297.A N ASN 293.A O no hydrogen 2.981 N/A GLN 298.A N ARG 294.A O no hydrogen 2.790 N/A LYS 299.A N GLU 295.A O no hydrogen 2.943 N/A LYS 299.A NZ ASP 303.A OD1 no hydrogen 3.403 N/A LYS 299.A NZ ASP 303.A OD2 no hydrogen 3.533 N/A ILE 300.A N LEU 296.A O no hydrogen 2.945 N/A GLU 301.A N GLU 297.A O no hydrogen 2.877 N/A GLU 302.A N GLN 298.A O no hydrogen 2.875 N/A ASP 303.A N LYS 299.A O no hydrogen 2.928 N/A TRP 304.A N ILE 300.A O no hydrogen 3.159 N/A ARG 305.A N GLU 301.A O no hydrogen 3.215 N/A VAL 306.A N GLU 302.A O no hydrogen 2.937 N/A ASP 307.A N ASP 303.A O no hydrogen 2.946 N/A ASN 308.A N ARG 305.A O no hydrogen 3.110 N/A