Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2iqt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N ASN 1.A O no hydrogen 3.317 N/A GLU 5.A N ALA 2.A O no hydrogen 3.037 N/A LEU 7.A N ASN 3.A O no hydrogen 2.728 N/A GLN 8.A N LYS 4.A O no hydrogen 3.068 N/A GLN 9.A N.A GLU 5.A O no hydrogen 3.043 N/A GLN 9.A N.B GLU 5.A O no hydrogen 3.069 N/A GLN 9.A NE2.A ILE 66.A O no hydrogen 2.855 N/A GLN 9.A NE2.A HIS 91.A O no hydrogen 2.851 N/A GLN 9.A NE2.B GLU 5.A O no hydrogen 3.569 N/A GLN 11.A N.A GLN 8.A O no hydrogen 2.790 N/A GLN 11.A N.B GLN 8.A O no hydrogen 2.826 N/A ALA 12.A N GLN 9.A O.A no hydrogen 2.804 N/A ALA 12.A N GLN 9.A O.B no hydrogen 3.262 N/A PHE 15.A N LYS 64.A O no hydrogen 2.799 N/A VAL 16.A N ALA 246.A O no hydrogen 3.081 N/A GLY 17.A N GLY 67.A O no hydrogen 2.879 N/A ALA 18.A N PHE 248.A O no hydrogen 3.011 N/A LEU 19.A N ILE 69.A O no hydrogen 2.879 N/A GLN 21.A N GLN 21.A OE1 no hydrogen 2.840 N/A SER 25.A N SER 22.A O no hydrogen 3.016 N/A THR 26.A N GLY 23.A O no hydrogen 3.167 N/A LEU 30.A N THR 26.A O no hydrogen 2.903 N/A LYS 31.A N PRO 27.A O no hydrogen 2.887 N/A LYS 31.A NZ GLN 36.A OE1 no hydrogen 3.071 N/A ALA 32.A N LYS 28.A O no hydrogen 3.228 N/A TYR 33.A N ALA 29.A O no hydrogen 3.121 N/A GLY 34.A N LYS 31.A O no hydrogen 2.827 N/A ILE 35.A N LEU 30.A O no hydrogen 2.829 N/A ALA 39.A N GLN 36.A O no hydrogen 2.755 N/A TYR 40.A N PRO 37.A O no hydrogen 3.402 N/A GLN 41.A N GLU 45.A OE1 no hydrogen 3.212 N/A GLU 45.A N SER 42.A OG no hydrogen 3.385 N/A ASP 47.A N GLU 44.A O.A no hydrogen 2.977 N/A ASP 47.A N GLU 44.A O.B no hydrogen 3.081 N/A ASP 47.A N GLU 44.A O.C no hydrogen 3.160 N/A LEU 48.A N GLU 45.A O no hydrogen 3.010 N/A HIS 50.A N PHE 46.A O no hydrogen 2.976 N/A GLN 51.A N ASP 47.A O no hydrogen 2.754 N/A ARG 52.A NH2 GLN 21.A O no hydrogen 3.219 N/A ARG 52.A NH2 GLN 21.A OE1 no hydrogen 3.071 N/A THR 53.A N HIS 50.A O no hydrogen 2.940 N/A THR 53.A OG1 HIS 50.A O no hydrogen 2.696 N/A ARG 54.A N GLN 51.A O no hydrogen 2.790 N/A ARG 54.A NH1 TYR 33.A OH no hydrogen 2.906 N/A ARG 54.A NH1 SER 257.A O no hydrogen 3.078 N/A ARG 54.A NH2 GLN 260.A O no hydrogen 3.025 N/A ARG 54.A NH2 ASP 262.A OD2 no hydrogen 3.038 N/A THR 56.A N THR 53.A O no hydrogen 2.825 N/A THR 56.A OG1 THR 53.A O no hydrogen 2.833 N/A ALA 59.A N SER 57.A OG no hydrogen 3.246 N/A PHE 60.A N SER 57.A O no hydrogen 2.905 N/A ALA 61.A N PRO 58.A O no hydrogen 3.093 N/A THR 62.A OG1 ALA 59.A O no hydrogen 3.393 N/A LYS 64.A N THR 62.A OG1 no hydrogen 3.167 N/A LYS 64.A NZ GLU 273.A OE1 no hydrogen 2.485 N/A ILE 66.A N PHE 15.A O no hydrogen 2.706 N/A VAL 68.A N VAL 93.A O no hydrogen 2.854 N/A ILE 69.A N GLY 17.A O no hydrogen 2.949 N/A LEU 70.A N PHE 95.A O no hydrogen 2.721 N/A ARG 73.A NH1 GLU 44.A OE2.C no hydrogen 3.482 N/A ARG 73.A NH2 GLU 44.A OE1.C no hydrogen 2.774 N/A ARG 75.A NE GLU 123.A OE2 no hydrogen 2.499 N/A ARG 75.A NH1 GLU 72.A OE1 no hydrogen 2.905 N/A ARG 75.A NH2 GLU 72.A OE1 no hydrogen 3.189 N/A ARG 75.A NH2 GLU 123.A OE1 no hydrogen 2.767 N/A GLY 76.A N THR 74.A O no hydrogen 3.032 N/A THR 82.A N GLY 76.A O no hydrogen 3.253 N/A THR 82.A OG1 THR 74.A O no hydrogen 2.829 N/A THR 82.A OG1 GLY 76.A O no hydrogen 3.292 N/A PHE 85.A N PRO 81.A O no hydrogen 2.921 N/A LEU 86.A N THR 82.A O no hydrogen 2.850 N/A TRP 87.A N ALA 83.A O no hydrogen 3.066 N/A GLU 88.A N ASP 84.A O no hydrogen 2.738 N/A LYS 89.A N PHE 85.A O no hydrogen 3.111 N/A ARG 90.A NE ILE 55.A O no hydrogen 2.981 N/A ARG 90.A NH1 LYS 89.A O no hydrogen 3.419 N/A ARG 90.A NH2 ILE 55.A O no hydrogen 3.363 N/A HIS 91.A N TRP 87.A O no hydrogen 3.113 N/A ILE 92.A N LEU 86.A O no hydrogen 2.916 N/A VAL 93.A N ILE 66.A O no hydrogen 2.944 N/A PHE 95.A N VAL 68.A O no hydrogen 2.651 N/A LEU 96.A N GLY 131.A O no hydrogen 2.906 N/A LYS 97.A N.A LEU 70.A O no hydrogen 2.943 N/A LYS 97.A N.B LEU 70.A O no hydrogen 2.955 N/A LYS 97.A NZ.A ASP 99.A OD2 no hydrogen 2.912 N/A LYS 97.A NZ.B ASP 20.A O no hydrogen 2.575 N/A LYS 97.A NZ.B ASP 20.A OD2 no hydrogen 3.328 N/A VAL 98.A N LYS 133.A O no hydrogen 2.826 N/A LYS 100.A NZ GLU 72.A OE2 no hydrogen 2.700 N/A GLY 101.A N ASP 99.A OD2 no hydrogen 2.959 N/A GLN 103.A N LEU 111.A O no hydrogen 2.725 N/A ALA 106.A N VAL 109.A O no hydrogen 2.899 N/A VAL 109.A N ALA 106.A O no hydrogen 3.190 N/A GLN 110.A N VAL 136.A O no hydrogen 2.735 N/A LYS 112.A N GLY 101.A O no hydrogen 2.862 N/A LEU 117.A N PHE 114.A O no hydrogen 3.114 N/A LEU 120.A N GLU 116.A O.A no hydrogen 3.148 N/A LEU 120.A N GLU 116.A O.B no hydrogen 3.189 N/A CYS 121.A N LEU 117.A O no hydrogen 2.878 N/A CYS 121.A SG LEU 117.A O no hydrogen 3.456 N/A GLU 122.A N GLY 118.A O no hydrogen 3.142 N/A GLU 123.A N LYS 119.A O no hydrogen 3.050 N/A ALA 124.A N LEU 120.A O no hydrogen 2.883 N/A VAL 125.A N CYS 121.A O no hydrogen 2.892 N/A GLY 126.A N GLU 122.A O no hydrogen 3.128 N/A TYR 127.A N GLU 123.A O no hydrogen 3.198 N/A TYR 127.A N ALA 124.A O no hydrogen 2.940 N/A HIS 128.A N VAL 125.A O no hydrogen 2.816 N/A HIS 128.A ND1 ASP 84.A OD1 no hydrogen 2.769 N/A VAL 129.A N ALA 124.A O no hydrogen 3.030 N/A PHE 130.A N PRO 94.A O no hydrogen 3.035 N/A THR 132.A N VAL 165.A O no hydrogen 2.885 N/A LYS 133.A N LEU 96.A O no hydrogen 2.918 N/A LYS 133.A NZ ASP 20.A OD2 no hydrogen 2.694 N/A LYS 133.A NZ GLU 169.A OE1 no hydrogen 3.141 N/A ARG 134.A NE GLU 171.A OE2 no hydrogen 2.820 N/A ARG 134.A NH2 GLU 171.A OE2 no hydrogen 2.691 N/A SER 135.A N GLU 169.A O no hydrogen 2.821 N/A VAL 136.A N GLN 110.A O no hydrogen 3.093 N/A ILE 137.A N GLU 171.A O no hydrogen 2.611 N/A LYS 138.A N GLY 108.A O no hydrogen 2.810 N/A GLY 144.A N ASN 141.A OD1 no hydrogen 3.006 N/A ILE 145.A N ASN 141.A O no hydrogen 2.852 N/A ARG 146.A N GLU 142.A O no hydrogen 2.858 N/A ASP 147.A N GLN 143.A O no hydrogen 2.976 N/A ILE 148.A N GLY 144.A O no hydrogen 2.950 N/A VAL 149.A N ILE 145.A O no hydrogen 3.136 N/A GLU 150.A N ARG 146.A O no hydrogen 3.148 N/A GLN 151.A N ASP 147.A O no hydrogen 2.893 N/A GLN 152.A N ILE 148.A O no hydrogen 2.983 N/A PHE 153.A N VAL 149.A O no hydrogen 2.953 N/A GLN 154.A N.A GLU 150.A O no hydrogen 3.090 N/A GLN 154.A N.B GLU 150.A O no hydrogen 3.073 N/A GLN 154.A N.C GLU 150.A O no hydrogen 3.139 N/A GLN 154.A NE2.A GLU 150.A OE2 no hydrogen 2.847 N/A TRP 155.A N GLN 151.A O no hydrogen 3.045 N/A GLY 156.A N GLN 152.A O no hydrogen 2.989 N/A LYS 157.A N PHE 153.A O no hydrogen 2.815 N/A GLU 158.A N GLN 154.A O.A no hydrogen 3.122 N/A GLU 158.A N GLN 154.A O.B no hydrogen 3.169 N/A GLU 158.A N GLN 154.A O.C no hydrogen 3.275 N/A ILE 159.A N TRP 155.A O no hydrogen 2.889 N/A LEU 160.A N GLY 156.A O no hydrogen 2.975 N/A SER 161.A N LYS 157.A O no hydrogen 3.305 N/A SER 161.A N GLU 158.A O no hydrogen 3.234 N/A HIS 162.A N ILE 159.A O no hydrogen 3.030 N/A HIS 162.A ND1 GLU 122.A OE2 no hydrogen 2.458 N/A GLY 163.A N LEU 160.A O no hydrogen 2.662 N/A VAL 165.A N PHE 130.A O no hydrogen 3.122 N/A ILE 167.A N THR 132.A O no hydrogen 2.781 N/A GLU 171.A N SER 135.A O no hydrogen 2.886 N/A ASP 173.A N ILE 137.A O no hydrogen 2.996 N/A HIS 175.A N ASP 173.A OD1 no hydrogen 2.748 N/A CYS 176.A N ASP 173.A O no hydrogen 3.049 N/A CYS 176.A SG LYS 138.A O no hydrogen 3.500 N/A LYS 179.A NZ GLU 183.A OE1 no hydrogen 3.325 N/A LYS 179.A NZ GLU 183.A OE2 no hydrogen 2.574 N/A LYS 179.A NZ ILE 205.A O no hydrogen 3.144 N/A LYS 179.A NZ THR 207.A OG1 no hydrogen 2.953 N/A ALA 182.A N GLU 178.A O no hydrogen 2.905 N/A GLU 183.A N LYS 179.A O no hydrogen 2.824 N/A GLU 184.A N ALA 180.A O no hydrogen 2.839 N/A ILE 185.A N LYS 181.A O no hydrogen 3.056 N/A LEU 186.A N ALA 182.A O no hydrogen 2.878 N/A LYS 187.A N GLU 183.A O no hydrogen 2.824 N/A LYS 187.A NZ PHE 211.A O no hydrogen 2.729 N/A LYS 187.A NZ GLU 214.A OE1 no hydrogen 2.882 N/A ARG 188.A N.A GLU 184.A O no hydrogen 3.201 N/A ARG 188.A N.B GLU 184.A O no hydrogen 3.217 N/A ARG 188.A NH2.A GLU 142.A OE1 no hydrogen 3.274 N/A GLU 189.A N ILE 185.A O no hydrogen 2.923 N/A LEU 190.A N LEU 186.A O no hydrogen 2.872 N/A LEU 191.A N LYS 187.A O no hydrogen 2.946 N/A ALA 192.A N ARG 188.A O.A no hydrogen 3.413 N/A ALA 192.A N ARG 188.A O.B no hydrogen 3.136 N/A GLN 193.A N GLU 189.A O no hydrogen 3.106 N/A GLN 193.A NE2 GLU 150.A OE1 no hydrogen 2.969 N/A LEU 194.A N LEU 190.A O no hydrogen 2.989 N/A ASP 195.A N LEU 191.A O no hydrogen 2.857 N/A LYS 196.A N GLN 193.A O no hydrogen 2.984 N/A LYS 202.A N LEU 168.A O no hydrogen 2.701 N/A LYS 202.A NZ SER 247.A O no hydrogen 3.144 N/A LYS 202.A NZ SER 247.A OG no hydrogen 2.782 N/A ILE 203.A N VAL 223.A O no hydrogen 2.979 N/A THR 204.A OG1 VAL 172.A O no hydrogen 2.712 N/A THR 207.A N GLU 183.A OE1 no hydrogen 2.936 N/A PHE 211.A N VAL 208.A O no hydrogen 3.069 N/A LYS 213.A N ASN 210.A O no hydrogen 3.294 N/A LYS 213.A NZ GLU 217.A OE2 no hydrogen 3.244 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.762 N/A ILE 216.A N TYR 212.A O no hydrogen 2.881 N/A GLU 217.A N LYS 213.A O no hydrogen 2.865 N/A HIS 218.A N ILE 215.A O no hydrogen 2.915 N/A HIS 218.A NE2 ASP 195.A OD1 no hydrogen 2.593 N/A LEU 220.A N VAL 200.A O no hydrogen 2.661 N/A ARG 221.A NH1 ALA 12.A O no hydrogen 2.795 N/A ARG 221.A NH2 ALA 12.A O no hydrogen 2.818 N/A VAL 223.A N LEU 201.A O no hydrogen 2.733 N/A ALA 224.A N ILE 245.A O no hydrogen 2.864 N/A LEU 225.A N ILE 203.A O no hydrogen 3.032 N/A ARG 231.A N GLU 254.A OE2 no hydrogen 2.981 N/A ARG 231.A NH1 ALA 251.A O no hydrogen 2.960 N/A ARG 231.A NH1 GLU 254.A O no hydrogen 3.399 N/A GLN 233.A N SER 230.A OG no hydrogen 3.087 N/A ALA 234.A N SER 230.A O no hydrogen 2.824 N/A ASN 235.A N ARG 231.A O no hydrogen 3.023 N/A GLU 236.A N GLU 232.A O.A no hydrogen 3.150 N/A GLU 236.A N GLU 232.A O.B no hydrogen 3.162 N/A LEU 237.A N GLN 233.A O no hydrogen 3.004 N/A LEU 238.A N ALA 234.A O no hydrogen 2.698 N/A SER 239.A N ASN 235.A O no hydrogen 2.782 N/A SER 239.A OG ASN 235.A O no hydrogen 2.754 N/A ARG 240.A N LEU 237.A O no hydrogen 3.023 N/A ARG 240.A NH2 GLU 236.A OE1 no hydrogen 2.763 N/A ASN 241.A N LEU 238.A O no hydrogen 2.918 N/A HIS 242.A N ASN 210.A OD1 no hydrogen 2.776 N/A HIS 242.A ND1 LYS 281.A OXT no hydrogen 2.862 N/A GLY 243.A N LYS 281.A O no hydrogen 3.029 N/A VAL 244.A N ASN 241.A O no hydrogen 3.320 N/A ILE 245.A N VAL 222.A O no hydrogen 3.227 N/A ALA 246.A N SER 279.A OG no hydrogen 2.781 N/A SER 247.A N ALA 224.A O no hydrogen 2.928 N/A ARG 250.A N.A SER 249.A OG no hydrogen 2.688 N/A ARG 250.A N.B SER 249.A OG no hydrogen 2.664 N/A LEU 252.A N SER 249.A O no hydrogen 3.106 N/A VAL 253.A N ARG 250.A O.A no hydrogen 3.229 N/A VAL 253.A N ARG 250.A O.B no hydrogen 2.903 N/A LEU 256.A N VAL 253.A O no hydrogen 3.040 N/A SER 257.A N GLN 260.A OE1 no hydrogen 2.851 N/A ALA 258.A N TYR 33.A O no hydrogen 2.935 N/A GLN 260.A NE2 GLU 264.A OE1 no hydrogen 2.984 N/A GLU 264.A N THR 261.A OG1 no hydrogen 3.044 N/A PHE 265.A N THR 261.A O no hydrogen 2.991 N/A ASN 266.A N.A ASP 262.A O no hydrogen 3.042 N/A ASN 266.A N.B ASP 262.A O no hydrogen 3.047 N/A ALA 267.A N ALA 263.A O no hydrogen 3.196 N/A GLU 269.A N.A ASN 266.A O.A no hydrogen 2.766 N/A GLU 269.A N.A ASN 266.A O.B no hydrogen 2.565 N/A GLU 269.A N.B ASN 266.A O.A no hydrogen 2.785 N/A GLU 269.A N.B ASN 266.A O.B no hydrogen 2.586 N/A ALA 270.A N ALA 267.A O no hydrogen 2.890 N/A SER 271.A OG LEU 252.A O no hydrogen 2.678 N/A ILE 272.A N LEU 268.A O no hydrogen 3.160 N/A GLU 273.A N GLU 269.A O.A no hydrogen 2.940 N/A GLU 273.A N GLU 269.A O.B no hydrogen 2.757 N/A ASP 274.A N ALA 270.A O no hydrogen 2.889 N/A VAL 275.A N SER 271.A O no hydrogen 2.865 N/A TYR 276.A N ILE 272.A O no hydrogen 2.792 N/A GLN 277.A N GLU 273.A O no hydrogen 2.982 N/A GLN 277.A NE2 GLU 273.A OE2 no hydrogen 3.070 N/A ALA 278.A N ASP 274.A O no hydrogen 3.131 N/A SER 279.A N VAL 275.A O no hydrogen 2.817 N/A SER 279.A OG VAL 275.A O no hydrogen 2.792 N/A ILE 280.A N TYR 276.A O no hydrogen 2.846 N/A LYS 281.A NZ GLN 277.A O no hydrogen 3.053 N/A LYS 281.A NZ GLN 277.A OE1 no hydrogen 2.828 N/A