Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4j40_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 ALA 2.A O no hydrogen 3.123 N/A GLN 3.A NE2 GLN 48.A OE1 no hydrogen 2.831 N/A ALA 9.A N ASP 6.A OD2 no hydrogen 2.964 N/A ILE 10.A N ASP 6.A O no hydrogen 3.208 N/A LEU 11.A N VAL 7.A O no hydrogen 2.850 N/A GLN 12.A N ILE 8.A O no hydrogen 2.958 N/A GLN 13.A N ILE 10.A O no hydrogen 2.930 N/A ALA 14.A N LEU 11.A O no hydrogen 3.095 N/A LEU 15.A N LEU 11.A O no hydrogen 3.012 N/A SER 19.A N ALA 14.A O no hydrogen 3.190 N/A ARG 21.A N ARG 43.A O no hydrogen 2.914 N/A LEU 23.A N LEU 41.A O no hydrogen 2.905 N/A PHE 24.A N SER 243.A O no hydrogen 2.767 N/A GLN 25.A N GLU 39.A O no hydrogen 2.933 N/A GLN 25.A NE2 GLN 240.A O no hydrogen 3.649 N/A VAL 27.A N ASN 37.A O no hydrogen 2.509 N/A ILE 28.A N ILE 234.A O no hydrogen 2.893 N/A SER 29.A OG ASP 33.A O no hydrogen 2.857 N/A LEU 30.A N THR 232.A O no hydrogen 3.025 N/A ARG 31.A N THR 232.A O no hydrogen 3.161 N/A ARG 31.A NH1 TRP 227.A O no hydrogen 3.071 N/A ARG 31.A NH2 TRP 227.A O no hydrogen 2.672 N/A ARG 31.A NH2 ALA 231.A O no hydrogen 3.354 N/A GLY 32.A N SER 29.A OG no hydrogen 2.932 N/A ASP 33.A N TYR 233.A OH no hydrogen 3.205 N/A GLU 36.A N GLN 91.A O no hydrogen 3.373 N/A ASN 37.A ND2 ASP 33.A OD1 no hydrogen 3.182 N/A TYR 38.A N LYS 93.A O no hydrogen 2.973 N/A GLU 39.A N GLN 25.A O no hydrogen 2.881 N/A VAL 40.A N PHE 95.A O no hydrogen 3.090 N/A LEU 41.A N LEU 23.A O no hydrogen 2.896 N/A ARG 43.A N ARG 21.A O no hydrogen 2.902 N/A ASN 46.A N GLN 50.A O no hydrogen 3.071 N/A ASN 46.A ND2 GLN 3.A OE1 no hydrogen 2.452 N/A GLY 49.A N ASN 46.A O no hydrogen 3.358 N/A VAL 52.A N LEU 44.A O no hydrogen 3.060 N/A PHE 57.A N PRO 53.A O no hydrogen 3.193 N/A LEU 58.A N PRO 54.A O no hydrogen 2.870 N/A HIS 59.A N ALA 55.A O no hydrogen 2.973 N/A ALA 60.A N GLU 56.A O no hydrogen 2.936 N/A ALA 61.A N PHE 57.A O no hydrogen 2.899 N/A LYS 62.A N LEU 58.A O no hydrogen 2.976 N/A GLU 63.A N HIS 59.A O no hydrogen 2.940 N/A LEU 66.A N ALA 61.A O no hydrogen 2.948 N/A ILE 70.A N LEU 66.A O no hydrogen 3.032 N/A ASP 71.A N ALA 67.A O no hydrogen 2.922 N/A ARG 72.A N GLU 68.A O no hydrogen 2.895 N/A TRP 73.A N LYS 69.A O no hydrogen 2.953 N/A VAL 74.A N ILE 70.A O no hydrogen 2.922 N/A ILE 75.A N ASP 71.A O no hydrogen 2.888 N/A LEU 76.A N ARG 72.A O no hydrogen 2.922 N/A ASN 77.A N TRP 73.A O no hydrogen 2.967 N/A SER 78.A N VAL 74.A O no hydrogen 2.863 N/A SER 78.A OG VAL 74.A O no hydrogen 2.631 N/A ILE 79.A N ILE 75.A O no hydrogen 2.921 N/A LYS 80.A N LEU 76.A O no hydrogen 2.954 N/A LEU 81.A N ASN 77.A O no hydrogen 2.914 N/A LEU 82.A N SER 78.A O no hydrogen 2.900 N/A ALA 83.A N ILE 79.A O no hydrogen 2.912 N/A GLU 84.A N LYS 80.A O no hydrogen 2.957 N/A HIS 85.A N LEU 81.A O no hydrogen 2.907 N/A ARG 86.A N LEU 82.A O no hydrogen 2.885 N/A ARG 86.A NE THR 92.A O no hydrogen 3.104 N/A ALA 87.A N ALA 83.A O no hydrogen 3.151 N/A LYS 88.A N HIS 85.A O no hydrogen 3.165 N/A HIS 90.A ND1 GLU 36.A OE2 no hydrogen 2.520 N/A LYS 93.A N GLU 36.A O no hydrogen 2.715 N/A LYS 93.A NZ GLN 155.A OE1 no hydrogen 2.968 N/A LEU 94.A N SER 125.A O no hydrogen 3.338 N/A PHE 95.A N TYR 38.A O no hydrogen 2.655 N/A VAL 96.A N VAL 127.A O no hydrogen 2.718 N/A HIS 97.A NE2 GLU 39.A OE2 no hydrogen 2.786 N/A LEU 98.A N GLN 129.A O no hydrogen 2.963 N/A SER 99.A N ASP 71.A OD2 no hydrogen 2.836 N/A SER 99.A OG ASP 71.A OD2 no hydrogen 2.393 N/A SER 99.A OG SER 102.A OG no hydrogen 3.265 N/A SER 102.A OG ASP 71.A OD2 no hydrogen 2.324 N/A SER 102.A OG SER 99.A OG no hydrogen 3.265 N/A LEU 103.A N SER 99.A O no hydrogen 2.978 N/A GLN 104.A N SER 100.A O no hydrogen 2.947 N/A ASP 105.A N ALA 101.A O no hydrogen 3.099 N/A GLY 107.A N ASP 105.A OD2 no hydrogen 2.530 N/A TRP 111.A N GLY 107.A O no hydrogen 2.992 N/A LEU 112.A N LEU 108.A O no hydrogen 2.893 N/A GLY 113.A N LEU 109.A O no hydrogen 2.904 N/A VAL 114.A N PRO 110.A O no hydrogen 2.990 N/A ALA 115.A N TRP 111.A O no hydrogen 2.969 N/A LEU 116.A N LEU 112.A O no hydrogen 2.850 N/A LYS 117.A N GLY 113.A O no hydrogen 2.969 N/A ALA 118.A N VAL 114.A O no hydrogen 2.949 N/A ALA 119.A N LEU 116.A O no hydrogen 3.034 N/A ARG 120.A N LYS 117.A O no hydrogen 3.344 N/A LEU 121.A N LEU 116.A O no hydrogen 3.512 N/A GLU 124.A N HIS 153.A O no hydrogen 2.687 N/A VAL 127.A N LEU 94.A O no hydrogen 2.732 N/A PHE 128.A N GLN 155.A O no hydrogen 2.875 N/A GLN 129.A N VAL 96.A O no hydrogen 2.741 N/A GLN 129.A NE2 GLU 39.A OE2 no hydrogen 3.155 N/A ILE 130.A N ALA 157.A O no hydrogen 2.911 N/A GLU 132.A N SER 159.A O no hydrogen 2.822 N/A ASP 134.A N SER 131.A OG no hydrogen 3.279 N/A ALA 135.A N SER 131.A O no hydrogen 2.922 N/A THR 136.A N GLU 132.A O no hydrogen 2.903 N/A THR 136.A OG1 GLU 132.A O no hydrogen 2.996 N/A SER 137.A N ALA 133.A O no hydrogen 2.902 N/A SER 137.A OG ALA 133.A O no hydrogen 2.662 N/A TYR 138.A N ASP 134.A O no hydrogen 3.086 N/A ALA 142.A N TYR 138.A O no hydrogen 2.919 N/A LYS 143.A N LEU 139.A O no hydrogen 2.875 N/A GLN 144.A N LYS 140.A O no hydrogen 2.914 N/A LEU 145.A N GLN 141.A O no hydrogen 2.894 N/A THR 146.A N ALA 142.A O no hydrogen 2.933 N/A THR 146.A OG1 ALA 142.A O no hydrogen 2.888 N/A THR 146.A OG1 LYS 143.A O no hydrogen 2.883 N/A GLN 147.A N LYS 143.A O no hydrogen 2.872 N/A GLY 148.A N GLN 144.A O no hydrogen 2.927 N/A LEU 149.A N LEU 145.A O no hydrogen 2.846 N/A ALA 150.A N THR 146.A O no hydrogen 2.949 N/A THR 151.A OG1 GLY 148.A O no hydrogen 2.497 N/A LEU 152.A N GLY 148.A O no hydrogen 3.280 N/A LEU 152.A N LEU 149.A O no hydrogen 3.225 N/A HIS 153.A N ALA 150.A O no hydrogen 3.039 N/A CYS 154.A N LEU 149.A O no hydrogen 2.969 N/A CYS 154.A SG LEU 152.A O no hydrogen 3.947 N/A GLN 155.A N LEU 126.A O no hydrogen 2.845 N/A ALA 156.A N GLN 177.A OE1 no hydrogen 2.858 N/A ALA 157.A N PHE 128.A O no hydrogen 2.869 N/A ILE 158.A N PHE 178.A O no hydrogen 3.112 N/A SER 159.A N ILE 130.A O no hydrogen 2.920 N/A SER 159.A OG ILE 130.A O no hydrogen 3.514 N/A SER 159.A OG GLN 160.A OE1 no hydrogen 2.564 N/A PHE 161.A N LYS 180.A O no hydrogen 3.009 N/A GLY 162.A N GLU 132.A OE1 no hydrogen 3.132 N/A GLY 162.A N GLU 132.A OE2 no hydrogen 2.945 N/A CYS 163.A N GLU 132.A OE1 no hydrogen 2.809 N/A CYS 163.A SG GLN 160.A O no hydrogen 3.877 N/A CYS 163.A SG ASP 182.A OD2 no hydrogen 3.095 N/A SER 164.A N GLU 132.A OE1 no hydrogen 2.967 N/A ASN 169.A N ASN 166.A O no hydrogen 2.983 N/A LYS 172.A N ASN 169.A O no hydrogen 3.101 N/A HIS 173.A N ALA 170.A O no hydrogen 3.315 N/A LEU 174.A N LEU 171.A O no hydrogen 3.310 N/A THR 175.A N THR 146.A OG1 no hydrogen 3.255 N/A GLN 177.A N ALA 156.A O no hydrogen 3.257 N/A PHE 178.A N ALA 156.A O no hydrogen 3.292 N/A ILE 179.A N LEU 211.A O no hydrogen 2.903 N/A LYS 180.A N ILE 158.A O no hydrogen 2.604 N/A LYS 180.A NZ GLU 39.A OE2 no hydrogen 3.316 N/A LYS 180.A NZ GLN 235.A OE1 no hydrogen 2.454 N/A ILE 181.A N ILE 213.A O no hydrogen 2.900 N/A ASP 182.A N PHE 161.A O no hydrogen 3.011 N/A SER 184.A N ASP 182.A OD2 no hydrogen 3.341 N/A SER 184.A OG ASP 182.A OD2 no hydrogen 2.622 N/A PHE 185.A N ASP 182.A O no hydrogen 3.164 N/A VAL 186.A N GLY 183.A O no hydrogen 2.859 N/A GLN 187.A NE2 SER 184.A O no hydrogen 3.545 N/A ASN 190.A ND2 ASP 188.A OD2 no hydrogen 2.848 N/A GLN 191.A N ASP 188.A O no hydrogen 3.273 N/A ASN 194.A ND2 GLN 187.A O no hydrogen 3.337 N/A ASN 194.A ND2 ASP 188.A O no hydrogen 2.604 N/A GLN 195.A NE2 LEU 189.A O no hydrogen 2.873 N/A GLU 196.A N VAL 192.A O no hydrogen 2.958 N/A ILE 197.A N GLU 193.A O no hydrogen 2.922 N/A LEU 198.A N ASN 194.A O no hydrogen 2.906 N/A LYS 199.A N GLN 195.A O no hydrogen 2.919 N/A GLY 200.A N GLU 196.A O no hydrogen 2.935 N/A LEU 201.A N ILE 197.A O no hydrogen 2.924 N/A ILE 202.A N LEU 198.A O no hydrogen 2.921 N/A ALA 203.A N LYS 199.A O no hydrogen 2.895 N/A GLU 204.A N GLY 200.A O no hydrogen 2.930 N/A LEU 205.A N LEU 201.A O no hydrogen 2.935 N/A HIS 206.A N ILE 202.A O no hydrogen 2.884 N/A HIS 206.A ND1 HIS 206.A O no hydrogen 2.684 N/A GLU 207.A N ALA 203.A O no hydrogen 2.943 N/A GLN 208.A N GLU 204.A O no hydrogen 3.229 N/A GLN 208.A N LEU 205.A O no hydrogen 3.289 N/A GLN 209.A N HIS 206.A O no hydrogen 3.063 N/A LYS 210.A N LEU 205.A O no hydrogen 3.028 N/A LYS 210.A NZ VAL 176.A O no hydrogen 2.695 N/A LEU 211.A N GLN 177.A O no hydrogen 2.704 N/A ILE 213.A N ILE 179.A O no hydrogen 2.899 N/A VAL 214.A N TYR 233.A O no hydrogen 3.062 N/A VAL 217.A N GLN 235.A O no hydrogen 3.104 N/A VAL 222.A N SER 219.A OG no hydrogen 3.284 N/A LEU 223.A N SER 219.A O no hydrogen 3.172 N/A ALA 224.A N ALA 220.A O no hydrogen 2.917 N/A THR 225.A N SER 221.A O no hydrogen 2.951 N/A THR 225.A OG1 SER 221.A O no hydrogen 2.769 N/A LEU 226.A N VAL 222.A O no hydrogen 2.886 N/A TRP 227.A N LEU 223.A O no hydrogen 2.914 N/A GLN 228.A N ALA 224.A O no hydrogen 2.934 N/A ALA 229.A N THR 225.A O no hydrogen 2.933 N/A GLY 230.A N LEU 226.A O no hydrogen 3.080 N/A GLY 230.A N TRP 227.A O no hydrogen 3.184 N/A ALA 231.A N LEU 226.A O no hydrogen 3.301 N/A TYR 233.A N SER 212.A O no hydrogen 2.863 N/A TYR 233.A OH ASP 33.A OD1 no hydrogen 2.814 N/A ILE 234.A N ILE 28.A O no hydrogen 2.894 N/A GLN 235.A N VAL 214.A O no hydrogen 3.052 N/A GLN 235.A NE2 GLN 25.A O no hydrogen 3.377 N/A GLN 235.A NE2 GLU 39.A OE1 no hydrogen 3.023 N/A TYR 237.A N GLU 218.A OE2 no hydrogen 3.088 N/A TYR 238.A N VAL 217.A O no hydrogen 3.251 N/A LEU 239.A N GLY 236.A O no hydrogen 3.238 N/A GLN 240.A N GLY 236.A O no hydrogen 2.782 N/A SER 243.A N PHE 24.A O no hydrogen 2.665 N/A SER 243.A OG ALA 245.A O no hydrogen 2.958 N/A ALA 245.A N SER 243.A OG no hydrogen 2.983 N/A ASP 247.A N ALA 245.A O no hydrogen 2.697 N/A SER 251.A OG ASP 249.A OD1 no hydrogen 3.217 N/A