Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4i40_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N THR 2.A OG1 no hydrogen 3.196 N/A ILE 6.A N THR 2.A O no hydrogen 3.081 N/A ASP 7.A N LEU 3.A O no hydrogen 2.881 N/A LYS 8.A N GLN 4.A O no hydrogen 2.685 N/A LEU 9.A N GLN 5.A O no hydrogen 3.259 N/A ILE 10.A N ILE 6.A O no hydrogen 2.994 N/A CYS 11.A N ASP 7.A O no hydrogen 2.943 N/A CYS 11.A SG ASP 7.A O no hydrogen 3.443 N/A CYS 11.A SG ASP 7.A OD1 no hydrogen 3.359 N/A SER 12.A N LYS 8.A O no hydrogen 3.221 N/A TRP 13.A N LEU 9.A O no hydrogen 3.074 N/A LEU 14.A N ILE 10.A O no hydrogen 2.830 N/A LYS 15.A N CYS 11.A O no hydrogen 2.774 N/A GLN 16.A N SER 12.A O no hydrogen 3.013 N/A ILE 17.A N TRP 13.A O no hydrogen 3.246 N/A ILE 17.A N LEU 14.A O no hydrogen 3.139 N/A ASN 19.A N GLN 16.A O no hydrogen 3.285 N/A ASN 19.A ND2 GLN 16.A O no hydrogen 3.657 N/A VAL 20.A N ILE 17.A O no hydrogen 3.295 N/A ILE 21.A N ILE 17.A O no hydrogen 3.017 N/A LEU 24.A N VAL 20.A O no hydrogen 3.456 N/A ILE 25.A N ILE 21.A O no hydrogen 2.925 N/A MET 26.A N PRO 22.A O no hydrogen 2.974 N/A GLU 27.A N GLN 23.A O no hydrogen 2.996 N/A MET 28.A N ILE 25.A O no hydrogen 3.182 N/A GLU 31.A N VAL 40.A O no hydrogen 2.781 N/A LYS 33.A N ASP 38.A O no hydrogen 2.876 N/A LYS 33.A NZ GLU 67.A OE1 no hydrogen 3.377 N/A LYS 33.A NZ GLU 68.A OE1 no hydrogen 2.798 N/A ARG 34.A N ASP 38.A OD2 no hydrogen 3.385 N/A PHE 37.A N HIS 35.A ND1 no hydrogen 3.133 N/A ASP 38.A N HIS 35.A O no hydrogen 3.370 N/A VAL 40.A N GLU 31.A O no hydrogen 2.741 N/A THR 41.A N ASP 44.A OD1 no hydrogen 2.881 N/A THR 41.A OG1 ASP 44.A OD1 no hydrogen 2.770 N/A ASN 42.A N THR 29.A O no hydrogen 3.341 N/A ASN 42.A ND2 THR 29.A O no hydrogen 3.607 N/A VAL 43.A N THR 41.A OG1 no hydrogen 2.985 N/A LYS 45.A N THR 41.A O no hydrogen 3.306 N/A GLN 46.A N ASN 42.A O no hydrogen 2.903 N/A GLN 46.A NE2 GLN 50.A OE1 no hydrogen 3.305 N/A ILE 47.A N VAL 43.A O no hydrogen 3.102 N/A GLN 48.A N ASP 44.A O no hydrogen 3.263 N/A GLN 49.A N LYS 45.A O no hydrogen 2.877 N/A GLN 50.A N GLN 46.A O no hydrogen 2.929 N/A PHE 51.A N ILE 47.A O no hydrogen 3.132 N/A PHE 51.A N GLN 48.A O no hydrogen 3.081 N/A GLN 52.A N GLN 48.A O no hydrogen 2.975 N/A GLN 53.A N GLN 49.A O no hydrogen 3.012 N/A PHE 54.A N GLN 50.A O no hydrogen 3.067 N/A LEU 55.A N PHE 51.A O no hydrogen 2.813 N/A ALA 56.A N GLN 52.A O no hydrogen 2.759 N/A THR 57.A N GLN 53.A O no hydrogen 2.942 N/A TYR 58.A N LEU 55.A O no hydrogen 3.239 N/A PHE 59.A N LEU 55.A O no hydrogen 2.967 N/A HIS 62.A N PHE 59.A O no hydrogen 2.953 N/A GLN 63.A N HIS 80.A O no hydrogen 2.978 N/A LEU 65.A N TRP 82.A O no hydrogen 2.874 N/A ALA 66.A N ASN 71.A OD1 no hydrogen 3.015 N/A GLU 67.A N MET 84.A O no hydrogen 3.394 N/A LYS 69.A NZ SER 70.A O no hydrogen 2.946 N/A LYS 69.A NZ ASN 71.A OD1 no hydrogen 3.404 N/A ASN 71.A ND2 ALA 66.A O no hydrogen 2.848 N/A ASN 79.A N GLU 77.A O no hydrogen 3.198 N/A HIS 80.A ND1 TYR 106.A OH no hydrogen 2.656 N/A LEU 81.A N PHE 107.A O no hydrogen 2.995 N/A TRP 82.A N GLN 63.A O no hydrogen 2.865 N/A TRP 82.A NE1 HIS 62.A ND1 no hydrogen 3.087 N/A ILE 83.A N ALA 105.A O no hydrogen 2.896 N/A MET 84.A N LEU 65.A O no hydrogen 2.863 N/A ASP 85.A N ILE 103.A O no hydrogen 2.846 N/A ASP 88.A N CYS 101.A O no hydrogen 2.624 N/A THR 90.A OG1 ASP 44.A OD2 no hydrogen 2.465 N/A THR 90.A OG1 ILE 87.A O no hydrogen 3.267 N/A ASN 92.A ND2 ASP 99.A O no hydrogen 2.767 N/A ASN 92.A ND2 VAL 179.A O no hydrogen 2.885 N/A LEU 93.A N GLY 89.A O no hydrogen 3.011 N/A VAL 94.A N THR 90.A O no hydrogen 2.873 N/A LYS 95.A N ALA 91.A O no hydrogen 2.778 N/A GLN 96.A N ASN 92.A O no hydrogen 2.727 N/A GLN 97.A N LEU 93.A O no hydrogen 2.886 N/A CYS 101.A N ASP 88.A O no hydrogen 2.898 N/A CYS 101.A SG ASP 88.A OD2 no hydrogen 3.772 N/A ILE 102.A N TYR 118.A O no hydrogen 3.150 N/A ILE 103.A N ASP 85.A O no hydrogen 3.008 N/A LEU 104.A N TYR 116.A O no hydrogen 2.989 N/A ALA 105.A N ILE 83.A O no hydrogen 2.908 N/A TYR 106.A N LEU 114.A O no hydrogen 2.775 N/A TYR 106.A OH HIS 80.A ND1 no hydrogen 2.656 N/A PHE 107.A N LEU 81.A O no hydrogen 2.778 N/A TYR 108.A N LYS 111.A O no hydrogen 2.886 N/A GLU 109.A N ASN 79.A O no hydrogen 2.694 N/A LYS 111.A N TYR 108.A O no hydrogen 2.826 N/A MET 113.A N TYR 106.A O no hydrogen 2.708 N/A LEU 114.A N TYR 106.A O no hydrogen 3.490 N/A SER 115.A N ALA 128.A O no hydrogen 2.997 N/A SER 115.A OG ALA 209.A O no hydrogen 3.280 N/A TYR 116.A N LEU 104.A O no hydrogen 2.775 N/A TYR 116.A OH ASP 7.A OD1 no hydrogen 2.554 N/A VAL 117.A N TYR 126.A O no hydrogen 2.854 N/A TYR 118.A N ILE 102.A O no hydrogen 2.912 N/A TYR 118.A OH ASP 18.A OD1 no hydrogen 2.703 N/A TYR 118.A OH ASP 18.A OD2 no hydrogen 3.184 N/A ASP 119.A N LYS 124.A O no hydrogen 2.776 N/A TYR 120.A N TYR 118.A O no hydrogen 3.033 N/A HIS 122.A N ASP 119.A O no hydrogen 3.197 N/A HIS 122.A N ASP 119.A OD1 no hydrogen 3.485 N/A LYS 123.A N TYR 120.A O no hydrogen 2.988 N/A LYS 123.A NZ TYR 120.A O no hydrogen 3.257 N/A LYS 124.A N ASP 119.A O no hydrogen 3.115 N/A LEU 125.A N ASN 137.A OD1 no hydrogen 2.850 N/A TYR 126.A N VAL 117.A O no hydrogen 2.950 N/A LYS 127.A N PHE 135.A O no hydrogen 2.929 N/A LYS 127.A NZ ASP 7.A OD2 no hydrogen 3.200 N/A ALA 128.A N SER 115.A O no hydrogen 2.925 N/A ILE 129.A N GLY 133.A O no hydrogen 2.805 N/A ARG 130.A N MET 113.A O no hydrogen 3.199 N/A ARG 130.A NH1 PRO 112.A O no hydrogen 2.345 N/A ARG 130.A NH2 GLU 215.A OE1 no hydrogen 3.008 N/A GLU 132.A N ILE 129.A O no hydrogen 3.183 N/A GLY 133.A N ILE 129.A O no hydrogen 2.744 N/A PHE 135.A N LYS 127.A O no hydrogen 2.875 N/A CYS 136.A N ILE 139.A O no hydrogen 2.944 N/A ASN 137.A N LEU 125.A O no hydrogen 2.766 N/A ASN 137.A ND2 LYS 123.A O no hydrogen 3.042 N/A ILE 139.A N CYS 136.A O no hydrogen 2.935 N/A LYS 140.A NZ GLU 142.A OE2 no hydrogen 3.239 N/A MET 141.A N ALA 134.A O no hydrogen 2.716 N/A LEU 147.A N ASN 241.A OD1 no hydrogen 2.925 N/A GLU 150.A N GLU 150.A OE2 no hydrogen 2.940 N/A ASP 151.A N LYS 148.A O no hydrogen 2.978 N/A ALA 152.A N LEU 149.A O no hydrogen 3.042 N/A ILE 154.A N SER 175.A O no hydrogen 2.944 N/A SER 155.A N ALA 196.A O no hydrogen 3.067 N/A SER 155.A OG ASP 185.A OD1 no hydrogen 2.658 N/A SER 155.A OG HIS 197.A ND1 no hydrogen 2.836 N/A GLN 159.A N ASN 157.A OD1 no hydrogen 2.858 N/A ASN 162.A N TYR 258.A O no hydrogen 2.968 N/A ASN 162.A ND2 GLY 257.A O no hydrogen 3.532 N/A ASN 162.A ND2 GLN 259.A O no hydrogen 3.252 N/A ASP 164.A N ASN 162.A OD1 no hydrogen 2.961 N/A VAL 166.A N ASN 162.A O no hydrogen 3.208 N/A GLN 167.A N LEU 163.A O no hydrogen 2.925 N/A ASP 168.A N ASP 164.A O no hydrogen 3.018 N/A LEU 169.A N THR 165.A O no hydrogen 2.989 N/A LEU 169.A N VAL 166.A O no hydrogen 3.118 N/A PHE 170.A N VAL 166.A O no hydrogen 2.978 N/A ASP 171.A N GLN 167.A O no hydrogen 2.815 N/A ALA 172.A N ASP 168.A O no hydrogen 2.958 N/A SER 173.A N PHE 170.A O no hydrogen 3.393 N/A SER 173.A OG LEU 169.A O no hydrogen 2.595 N/A SER 173.A OG PHE 170.A O no hydrogen 3.500 N/A PHE 174.A N ALA 152.A O no hydrogen 2.837 N/A TYR 176.A OH PHE 156.A O no hydrogen 2.446 N/A ARG 177.A N ILE 154.A O no hydrogen 3.117 N/A ARG 177.A NE TYR 176.A O no hydrogen 2.969 N/A ARG 177.A NH2 TYR 176.A O no hydrogen 3.442 N/A VAL 179.A N ASP 185.A OD1 no hydrogen 2.982 N/A GLY 180.A N ASP 185.A OD2 no hydrogen 2.942 N/A ALA 181.A N ASP 185.A OD2 no hydrogen 3.228 N/A CYS 182.A SG ASP 206.A O no hydrogen 3.216 N/A GLY 183.A N ASP 88.A OD2 no hydrogen 2.687 N/A LEU 184.A N ALA 181.A O no hydrogen 2.892 N/A ASP 185.A N ALA 181.A O no hydrogen 2.817 N/A SER 186.A N CYS 182.A O no hydrogen 2.756 N/A SER 186.A OG CYS 182.A O no hydrogen 2.831 N/A MET 187.A N GLY 183.A O no hydrogen 2.867 N/A ARG 188.A N LEU 184.A O no hydrogen 2.994 N/A VAL 189.A N ASP 185.A O no hydrogen 3.399 N/A ALA 190.A N SER 186.A O no hydrogen 3.103 N/A LYS 191.A N MET 187.A O no hydrogen 2.939 N/A LYS 191.A NZ TYR 126.A OH no hydrogen 3.228 N/A LYS 191.A NZ GLN 193.A OE1 no hydrogen 2.645 N/A GLY 192.A N VAL 189.A O no hydrogen 3.304 N/A GLN 193.A N ARG 188.A O no hydrogen 2.875 N/A PHE 194.A N ARG 188.A O no hydrogen 3.017 N/A GLY 195.A N ILE 153.A O no hydrogen 2.790 N/A HIS 197.A N ILE 239.A O no hydrogen 2.993 N/A HIS 197.A ND1 SER 155.A OG no hydrogen 2.836 N/A ILE 198.A N SER 155.A O no hydrogen 3.042 N/A ASN 199.A N PHE 237.A O no hydrogen 3.084 N/A ASN 201.A N ASN 199.A OD1 no hydrogen 2.871 N/A LYS 203.A N ASP 206.A OD2 no hydrogen 2.914 N/A ASP 206.A N LYS 203.A O no hydrogen 3.104 N/A GLN 210.A N ILE 207.A O no hydrogen 3.160 N/A GLN 210.A NE2 ASP 206.A O no hydrogen 2.935 N/A ALA 214.A N GLN 210.A O no hydrogen 2.865 N/A GLU 215.A N PHE 211.A O no hydrogen 2.883 N/A LEU 216.A N LEU 212.A O no hydrogen 2.825 N/A LEU 217.A N PHE 213.A O no hydrogen 2.951 N/A ASN 218.A N GLU 215.A O no hydrogen 3.391 N/A ASN 218.A ND2 GLU 143.A OE1 no hydrogen 3.356 N/A ASN 218.A ND2 GLU 143.A OE2 no hydrogen 3.522 N/A LEU 219.A N ALA 214.A O no hydrogen 2.819 N/A LYS 220.A N SER 240.A O no hydrogen 2.900 N/A THR 222.A N ILE 238.A O no hydrogen 3.204 N/A THR 222.A OG1 THR 223.A O no hydrogen 2.726 N/A THR 223.A N LYS 227.A O no hydrogen 3.001 N/A LEU 224.A N PRO 236.A O no hydrogen 3.255 N/A ASP 225.A N THR 223.A OG1 no hydrogen 3.164 N/A GLY 226.A N THR 223.A O no hydrogen 2.915 N/A LYS 227.A N THR 223.A OG1 no hydrogen 3.203 N/A LEU 232.A N ASP 230.A OD1 no hydrogen 3.070 N/A LYS 233.A N ASP 230.A O no hydrogen 3.225 N/A PHE 237.A N ASN 199.A O no hydrogen 3.033 N/A ILE 238.A N THR 222.A O no hydrogen 3.012 N/A ILE 239.A N HIS 197.A O no hydrogen 3.052 N/A SER 240.A N LYS 220.A O no hydrogen 2.831 N/A SER 240.A OG GLY 195.A O no hydrogen 3.396 N/A SER 240.A OG ASN 241.A O no hydrogen 2.713 N/A ASN 241.A N GLY 195.A O no hydrogen 2.836 N/A ASN 241.A ND2 PRO 145.A O no hydrogen 2.906 N/A LYS 242.A NZ GLU 143.A OE2 no hydrogen 2.969 N/A ALA 243.A N ASN 241.A OD1 no hydrogen 3.060 N/A CYS 244.A N ASN 241.A O no hydrogen 3.430 N/A CYS 244.A SG LEU 147.A O no hydrogen 3.425 N/A CYS 244.A SG GLY 195.A O no hydrogen 3.563 N/A CYS 244.A SG SER 240.A OG no hydrogen 3.555 N/A HIS 245.A N ASN 241.A O no hydrogen 3.262 N/A VAL 248.A N CYS 244.A O no hydrogen 3.073 N/A LEU 249.A N HIS 245.A O no hydrogen 3.054 N/A LYS 250.A N GLU 246.A O no hydrogen 2.919 N/A ILE 251.A N THR 247.A O no hydrogen 2.999 N/A LEU 252.A N VAL 248.A O no hydrogen 2.861 N/A ASN 253.A N LEU 249.A O no hydrogen 3.013 N/A ASN 253.A ND2 LEU 224.A O no hydrogen 2.864 N/A ASN 253.A ND2 LEU 249.A O no hydrogen 3.028 N/A ALA 254.A N LYS 250.A O no hydrogen 2.950 N/A ALA 254.A N ILE 251.A O no hydrogen 3.377 N/A GLY 257.A N ALA 254.A O no hydrogen 3.277 N/A LYS 260.A NZ GLN 159.A O no hydrogen 3.218 N/A ARG 262.A NE GLY 257.A O no hydrogen 3.289 N/A ARG 262.A NH2 ALA 254.A O no hydrogen 3.358 N/A ARG 262.A NH2 GLY 257.A O no hydrogen 3.404 N/A