Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4afe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 5.A OD2 no hydrogen 3.243 N/A SER 1.A OG ASP 70.A OD1 no hydrogen 3.315 N/A SER 1.A OG ASP 70.A OD2 no hydrogen 3.501 N/A ARG 2.A N ASP 5.A OD2 no hydrogen 2.758 N/A ASP 5.A N ARG 2.A O no hydrogen 2.924 N/A TYR 6.A N ALA 3.A O no hydrogen 3.199 N/A TYR 6.A OH ASP 70.A OD2 no hydrogen 3.172 N/A GLU 7.A N ARG 24.A O no hydrogen 2.769 N/A LEU 9.A N LYS 22.A O no hydrogen 2.805 N/A ILE 12.A N CYS 20.A O no hydrogen 2.567 N/A GLY 13.A N CYS 20.A O no hydrogen 3.096 N/A GLY 15.A N GLY 18.A O no hydrogen 2.582 N/A ARG 19.A N GLU 36.A O no hydrogen 3.241 N/A ARG 19.A NE GLU 36.A OE1 no hydrogen 3.150 N/A ARG 19.A NH2 GLU 36.A OE2 no hydrogen 3.147 N/A CYS 20.A N GLY 13.A O no hydrogen 2.685 N/A CYS 20.A SG TRP 34.A O no hydrogen 3.924 N/A GLN 21.A N TRP 34.A O no hydrogen 3.041 N/A GLN 21.A NE2 THR 11.A OG1 no hydrogen 2.961 N/A LYS 22.A N TYR 10.A O no hydrogen 2.771 N/A LYS 22.A NZ TYR 10.A OH no hydrogen 3.183 N/A LYS 22.A NZ TYR 86.A OH no hydrogen 3.450 N/A ILE 23.A N LEU 32.A O no hydrogen 2.754 N/A ARG 24.A N GLU 7.A O no hydrogen 2.820 N/A ARG 25.A N LYS 30.A O no hydrogen 2.929 N/A ARG 25.A NE ASP 28.A OD1 no hydrogen 3.084 N/A ARG 25.A NH2 ASP 28.A OD2 no hydrogen 2.957 N/A LYS 26.A N ASP 5.A O no hydrogen 2.844 N/A LYS 26.A NZ GLU 4.A O no hydrogen 3.320 N/A GLY 29.A N ARG 25.A O no hydrogen 2.663 N/A LYS 30.A N ASP 28.A OD1 no hydrogen 3.184 N/A LEU 32.A N ILE 23.A O no hydrogen 2.821 N/A VAL 33.A N MET 84.A O no hydrogen 3.096 N/A TRP 34.A N GLN 21.A O no hydrogen 2.985 N/A TRP 34.A NE1 GLN 21.A OE1 no hydrogen 3.005 N/A LYS 35.A N ILE 82.A O no hydrogen 2.875 N/A LYS 35.A NZ ASP 150.A OD2 no hydrogen 2.724 N/A GLU 36.A N ARG 19.A O no hydrogen 2.564 N/A LEU 37.A N LEU 80.A O no hydrogen 2.763 N/A TYR 39.A N THR 78.A O no hydrogen 3.063 N/A GLY 40.A N ASP 38.A OD1 no hydrogen 2.883 N/A MET 42.A N TYR 39.A O no hydrogen 3.060 N/A THR 43.A N GLU 46.A OE1 no hydrogen 2.872 N/A GLU 46.A N THR 43.A OG1 no hydrogen 3.280 N/A LYS 47.A N THR 43.A O no hydrogen 3.222 N/A GLN 48.A N GLU 44.A O no hydrogen 2.876 N/A MET 49.A N ALA 45.A O no hydrogen 2.835 N/A LEU 50.A N GLU 46.A O no hydrogen 2.861 N/A VAL 51.A N LYS 47.A O no hydrogen 3.062 N/A SER 52.A N GLN 48.A O no hydrogen 2.925 N/A GLU 53.A N MET 49.A O no hydrogen 2.916 N/A VAL 54.A N LEU 50.A O no hydrogen 3.078 N/A ASN 55.A N VAL 51.A O no hydrogen 3.218 N/A LEU 56.A N GLU 53.A O no hydrogen 2.972 N/A LEU 57.A N GLU 53.A O no hydrogen 3.372 N/A GLU 59.A N LEU 56.A O no hydrogen 3.032 N/A ASN 64.A N HIS 62.A ND1 no hydrogen 3.089 N/A ASN 64.A ND2 GLN 117.A OE1 no hydrogen 2.996 N/A ASN 64.A ND2 VAL 146.A O no hydrogen 2.800 N/A ILE 65.A N HIS 62.A O no hydrogen 3.066 N/A VAL 66.A N LEU 148.A O no hydrogen 2.840 N/A ARG 67.A N GLU 85.A OE2 no hydrogen 2.650 N/A TYR 69.A N VAL 83.A O no hydrogen 2.714 N/A ILE 72.A N TYR 81.A O no hydrogen 2.728 N/A ASP 74.A N THR 79.A O no hydrogen 2.965 N/A ASN 77.A N ASP 74.A OD2 no hydrogen 2.510 N/A THR 78.A OG1 ASP 38.A OD1 no hydrogen 2.908 N/A THR 78.A OG1 ASN 77.A O no hydrogen 2.576 N/A THR 79.A N ASP 74.A O no hydrogen 2.934 N/A THR 79.A OG1 ASN 77.A O no hydrogen 3.393 N/A LEU 80.A N LEU 37.A O no hydrogen 2.518 N/A TYR 81.A N ILE 72.A O no hydrogen 2.717 N/A ILE 82.A N LYS 35.A O no hydrogen 3.090 N/A VAL 83.A N ASP 70.A O no hydrogen 2.944 N/A MET 84.A N VAL 33.A O no hydrogen 2.830 N/A GLU 85.A N ARG 67.A O no hydrogen 3.066 N/A CYS 87.A SG GLU 85.A O no hydrogen 3.895 N/A GLY 89.A N LEU 140.A O no hydrogen 2.929 N/A GLY 90.A N CYS 87.A O no hydrogen 2.988 N/A LEU 92.A N PRO 135.A O no hydrogen 3.221 N/A LEU 92.A N VAL 138.A O no hydrogen 3.013 N/A ALA 93.A N PRO 135.A O no hydrogen 3.243 N/A SER 94.A N ASP 91.A OD1 no hydrogen 2.680 N/A SER 94.A OG ASP 91.A OD1 no hydrogen 3.039 N/A SER 94.A OG ASP 91.A OD2 no hydrogen 3.298 N/A ILE 96.A N LEU 92.A O no hydrogen 2.939 N/A THR 97.A N ALA 93.A O no hydrogen 2.813 N/A THR 97.A OG1 ALA 93.A O no hydrogen 3.362 N/A LYS 98.A N SER 94.A O no hydrogen 2.772 N/A GLY 99.A N VAL 95.A O no hydrogen 2.900 N/A THR 100.A N ILE 96.A O no hydrogen 2.891 N/A THR 100.A OG1 ILE 96.A O no hydrogen 2.942 N/A THR 100.A OG1 LEU 186.A O no hydrogen 3.499 N/A LYS 101.A N THR 97.A O no hydrogen 2.819 N/A GLU 102.A N LYS 98.A O no hydrogen 3.081 N/A GLN 104.A N GLY 99.A O no hydrogen 3.013 N/A GLN 104.A NE2 TYR 105.A O no hydrogen 2.899 N/A PHE 110.A N ASP 107.A O no hydrogen 2.891 N/A VAL 111.A N ASP 107.A O no hydrogen 3.093 N/A LEU 112.A N GLU 108.A O no hydrogen 2.830 N/A ARG 113.A N GLU 109.A O no hydrogen 3.102 N/A VAL 114.A N PHE 110.A O no hydrogen 3.112 N/A MET 115.A N VAL 111.A O no hydrogen 2.825 N/A THR 116.A N LEU 112.A O no hydrogen 2.873 N/A THR 116.A OG1 LEU 112.A O no hydrogen 2.810 N/A GLN 117.A N ARG 113.A O no hydrogen 3.045 N/A GLN 117.A NE2 HIS 249.A O no hydrogen 2.924 N/A LEU 118.A N VAL 114.A O no hydrogen 2.939 N/A THR 119.A N MET 115.A O no hydrogen 3.146 N/A THR 119.A OG1 MET 115.A O no hydrogen 2.653 N/A LEU 120.A N THR 116.A O no hydrogen 3.187 N/A ALA 121.A N GLN 117.A O no hydrogen 2.980 N/A LEU 122.A N LEU 118.A O no hydrogen 2.894 N/A LYS 123.A N THR 119.A O no hydrogen 3.045 N/A GLU 124.A N LEU 120.A O no hydrogen 3.154 N/A CYS 125.A N ALA 121.A O no hydrogen 3.248 N/A HIS 126.A N LEU 122.A O no hydrogen 2.871 N/A HIS 126.A NE2 ASP 172.A OD2 no hydrogen 2.358 N/A ARG 127.A NE GLU 124.A OE1 no hydrogen 3.281 N/A ARG 127.A NH2 GLU 124.A OE2 no hydrogen 2.624 N/A ARG 128.A N GLU 124.A O no hydrogen 3.277 N/A SER 129.A OG CYS 125.A O no hydrogen 3.468 N/A SER 129.A OG ARG 128.A O no hydrogen 2.804 N/A ARG 131.A NH1 GLY 149.A O no hydrogen 2.512 N/A ASP 132.A N PHE 151.A O no hydrogen 3.221 N/A ASN 137.A N LYS 134.A O no hydrogen 2.716 N/A ASN 137.A ND2 ASP 132.A O no hydrogen 3.202 N/A VAL 138.A N PRO 135.A O no hydrogen 3.321 N/A PHE 139.A N LYS 147.A O no hydrogen 2.640 N/A LEU 140.A N GLY 90.A O no hydrogen 2.894 N/A ASP 141.A N ASN 145.A O no hydrogen 3.149 N/A LYS 143.A N ASP 141.A OD1 no hydrogen 2.952 N/A ASN 145.A N ASP 141.A OD1 no hydrogen 2.755 N/A ASN 145.A ND2 ASP 141.A OD2 no hydrogen 2.896 N/A ASN 145.A ND2 HIS 252.A O no hydrogen 2.675 N/A VAL 146.A N GLN 117.A OE1 no hydrogen 2.711 N/A LYS 147.A N PHE 139.A O no hydrogen 2.545 N/A LYS 147.A NZ PRO 63.A O no hydrogen 3.305 N/A LYS 147.A NZ GLU 85.A OE1 no hydrogen 3.163 N/A LYS 147.A NZ GLU 85.A OE2 no hydrogen 3.296 N/A LEU 148.A N ASN 64.A O no hydrogen 2.854 N/A GLY 149.A N ASN 137.A O no hydrogen 2.886 N/A PHE 151.A N ASN 137.A OD1 no hydrogen 3.319 N/A LEU 153.A N ASP 150.A O no hydrogen 2.943 N/A TYR 158.A N THR 156.A O no hydrogen 2.813 N/A TYR 159.A OH GLU 182.A OE1 no hydrogen 2.529 N/A MET 160.A N PRO 157.A O no hydrogen 3.003 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.981 N/A MET 165.A N SER 161.A O no hydrogen 2.845 N/A ASN 166.A N GLU 163.A O no hydrogen 2.823 N/A ASN 168.A ND2 SER 171.A OG no hydrogen 3.366 N/A LYS 170.A NZ ARG 233.A O no hydrogen 2.770 N/A SER 171.A N ASN 168.A O no hydrogen 2.874 N/A SER 171.A OG GLU 163.A OE2 no hydrogen 2.871 N/A ASP 172.A N GLU 169.A O no hydrogen 2.828 N/A TRP 174.A N LYS 170.A O no hydrogen 3.407 N/A SER 175.A N SER 171.A O no hydrogen 3.356 N/A SER 175.A OG TYR 159.A O no hydrogen 3.233 N/A SER 175.A OG SER 171.A O no hydrogen 3.535 N/A LEU 176.A N ASP 172.A O no hydrogen 2.862 N/A GLY 177.A N ILE 173.A O no hydrogen 2.754 N/A CYS 178.A N TRP 174.A O no hydrogen 2.815 N/A CYS 178.A SG TYR 158.A O no hydrogen 4.016 N/A CYS 178.A SG TRP 174.A O no hydrogen 3.680 N/A LEU 179.A N SER 175.A O no hydrogen 2.937 N/A LEU 180.A N LEU 176.A O no hydrogen 2.937 N/A TYR 181.A N GLY 177.A O no hydrogen 2.938 N/A TYR 181.A OH ARG 208.A O no hydrogen 2.686 N/A GLU 182.A N CYS 178.A O no hydrogen 2.891 N/A LEU 183.A N LEU 179.A O no hydrogen 2.912 N/A CYS 184.A N LEU 180.A O no hydrogen 2.917 N/A CYS 184.A SG LEU 180.A O no hydrogen 3.470 N/A ALA 185.A N TYR 181.A O no hydrogen 2.788 N/A PHE 193.A N GLU 197.A OE1 no hydrogen 2.795 N/A LEU 198.A N SER 194.A O no hydrogen 2.985 N/A ALA 199.A N GLN 195.A O no hydrogen 2.825 N/A GLY 200.A N LYS 196.A O no hydrogen 3.007 N/A LYS 201.A N GLU 197.A O no hydrogen 3.049 N/A LYS 201.A NZ THR 191.A O no hydrogen 2.668 N/A LYS 201.A NZ GLU 197.A OE2 no hydrogen 3.461 N/A ILE 202.A N LEU 198.A O no hydrogen 2.956 N/A ARG 203.A N ALA 199.A O no hydrogen 3.126 N/A GLY 205.A N LYS 201.A O no hydrogen 3.107 N/A LYS 206.A NZ GLU 204.A OE2 no hydrogen 2.827 N/A ARG 209.A NH1 ILE 210.A O no hydrogen 2.593 N/A ARG 209.A NH1 PRO 211.A O no hydrogen 2.990 N/A ARG 209.A NH1 TYR 214.A O no hydrogen 3.373 N/A ARG 209.A NH2 TYR 214.A O no hydrogen 3.089 N/A ARG 209.A NH2 ASP 216.A OD1 no hydrogen 2.799 N/A TYR 214.A N PRO 211.A O no hydrogen 3.166 N/A TYR 214.A OH LEU 106.A O no hydrogen 2.621 N/A SER 215.A N GLU 108.A OE1 no hydrogen 3.054 N/A SER 215.A OG GLU 108.A OE2 no hydrogen 2.592 N/A SER 215.A OG GLU 217.A OE1 no hydrogen 3.439 N/A GLU 217.A N GLU 217.A OE1 no hydrogen 2.576 N/A LEU 218.A N SER 215.A OG no hydrogen 3.380 N/A ASN 219.A N SER 215.A O no hydrogen 3.152 N/A GLU 220.A N ASP 216.A O no hydrogen 2.744 N/A GLU 220.A N GLU 217.A O no hydrogen 3.072 N/A ILE 221.A N GLU 217.A O no hydrogen 3.150 N/A ILE 222.A N LEU 218.A O no hydrogen 3.235 N/A THR 223.A N ASN 219.A O no hydrogen 2.965 N/A THR 223.A OG1 ASN 219.A O no hydrogen 2.596 N/A ARG 224.A N GLU 220.A O no hydrogen 2.883 N/A MET 225.A N ILE 221.A O no hydrogen 3.154 N/A LEU 226.A N ILE 222.A O no hydrogen 3.141 N/A LEU 226.A N THR 223.A O no hydrogen 3.012 N/A ASN 227.A N ARG 224.A O no hydrogen 3.418 N/A LYS 229.A N ASN 227.A OD1 no hydrogen 3.001 N/A TYR 231.A N ASP 230.A OD1 no hydrogen 2.793 N/A HIS 232.A N LYS 229.A O no hydrogen 2.958 N/A ARG 233.A N ASP 230.A O no hydrogen 3.130 N/A ARG 233.A NE ASN 227.A O no hydrogen 2.811 N/A ARG 233.A NH1 GLU 163.A OE1 no hydrogen 3.230 N/A ARG 233.A NH1 GLU 163.A OE2 no hydrogen 2.812 N/A ARG 233.A NH1 LYS 170.A O no hydrogen 2.997 N/A ARG 233.A NH2 GLU 163.A OE1 no hydrogen 3.130 N/A ARG 233.A NH2 ASN 227.A O no hydrogen 2.984 N/A SER 235.A N GLU 238.A OE1 no hydrogen 3.053 N/A GLU 237.A N GLU 237.A OE1 no hydrogen 2.685 N/A GLU 238.A N SER 235.A OG no hydrogen 2.833 N/A ILE 239.A N SER 235.A O no hydrogen 2.882 N/A LEU 240.A N VAL 236.A O no hydrogen 3.111 N/A GLU 241.A N GLU 237.A O no hydrogen 3.166 N/A ASN 242.A N ILE 239.A O no hydrogen 3.238 N/A LEU 244.A N ASN 242.A OD1 no hydrogen 2.907 N/A ILE 245.A N ASN 242.A O no hydrogen 2.931 N/A LEU 246.A N HIS 249.A ND1 no hydrogen 3.263 N/A HIS 248.A NE2 GLU 109.A OE1 no hydrogen 2.682 N/A HIS 249.A N LEU 246.A O no hydrogen 3.126 N/A HIS 249.A NE2 GLU 109.A OE1 no hydrogen 3.175 N/A HIS 250.A N GLU 247.A O no hydrogen 3.048 N/A HIS 250.A ND1 LEU 246.A O no hydrogen 2.950 N/A HIS 252.A N ASN 145.A OD1 no hydrogen 2.771 N/A HIS 252.A NE2 GLU 247.A OE2 no hydrogen 3.215 N/A