Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3aln_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 16.A N ASP 19.A OD1 no hydrogen 2.660 N/A LYS 21.A N VAL 38.A O no hydrogen 2.863 N/A LEU 23.A N LYS 36.A O no hydrogen 2.598 N/A GLY 24.A N ASP 22.A OD1 no hydrogen 2.878 N/A GLY 24.A N ASP 22.A OD2 no hydrogen 3.076 N/A ILE 26.A N VAL 34.A O no hydrogen 2.733 N/A SER 33.A N ARG 50.A O no hydrogen 3.357 N/A VAL 34.A N GLY 27.A O no hydrogen 2.883 N/A ASN 35.A N VAL 48.A O no hydrogen 3.227 N/A LYS 36.A N GLY 24.A O no hydrogen 2.932 N/A MET 37.A N MET 46.A O no hydrogen 2.980 N/A VAL 38.A N LYS 21.A O no hydrogen 2.958 N/A HIS 39.A N GLN 44.A O no hydrogen 2.711 N/A LYS 40.A N ASP 19.A O no hydrogen 2.692 N/A SER 42.A N HIS 39.A O no hydrogen 2.945 N/A SER 42.A OG HIS 39.A O no hydrogen 3.400 N/A GLY 43.A N HIS 39.A O no hydrogen 2.658 N/A GLN 44.A NE2 ILE 45.A O no hydrogen 3.536 N/A MET 46.A N MET 37.A O no hydrogen 3.003 N/A ALA 47.A N MET 96.A O no hydrogen 3.136 N/A VAL 48.A N ASN 35.A O no hydrogen 3.184 N/A LYS 49.A N ILE 94.A O no hydrogen 3.082 N/A LYS 49.A NZ ASP 165.A OD1 no hydrogen 2.654 N/A LYS 49.A NZ SER 169.A OG no hydrogen 3.389 N/A ARG 50.A N SER 33.A O no hydrogen 2.975 N/A ILE 51.A N CYS 92.A O no hydrogen 2.910 N/A ARG 52.A NH2 GLY 90.A O no hydrogen 3.112 N/A THR 54.A OG1 SER 53.A O no hydrogen 2.589 N/A THR 54.A OG1 THR 54.A O no hydrogen 2.648 N/A GLN 60.A N GLU 57.A O no hydrogen 3.213 N/A LEU 64.A N GLN 60.A O no hydrogen 2.942 N/A MET 65.A N LYS 61.A O no hydrogen 3.049 N/A ASP 66.A N GLN 62.A O no hydrogen 2.338 N/A LEU 67.A N LEU 64.A O no hydrogen 3.286 N/A ASP 68.A N LEU 64.A O no hydrogen 3.289 N/A ASP 68.A N MET 65.A O no hydrogen 3.090 N/A VAL 69.A N MET 65.A O no hydrogen 3.120 N/A MET 71.A N LEU 67.A O no hydrogen 3.005 N/A ARG 72.A N ASP 68.A O no hydrogen 2.738 N/A SER 73.A OG VAL 69.A O no hydrogen 2.794 N/A SER 74.A OG SER 74.A O no hydrogen 2.635 N/A ASP 75.A N SER 73.A O no hydrogen 3.294 N/A VAL 80.A N LEU 163.A O no hydrogen 3.002 N/A GLN 81.A N GLU 97.A OE1 no hydrogen 3.093 N/A TYR 83.A N CYS 95.A O no hydrogen 2.729 N/A GLY 84.A N CYS 95.A O no hydrogen 3.463 N/A LEU 86.A N TRP 93.A O no hydrogen 2.679 N/A ARG 88.A N ASP 91.A O no hydrogen 2.836 N/A CYS 92.A N ILE 51.A O no hydrogen 3.059 N/A CYS 92.A SG LEU 86.A O no hydrogen 3.957 N/A TRP 93.A N LEU 86.A O no hydrogen 2.683 N/A TRP 93.A NE1 ASP 91.A OD2 no hydrogen 2.456 N/A ILE 94.A N LYS 49.A O no hydrogen 3.052 N/A CYS 95.A N GLY 84.A O no hydrogen 3.263 N/A MET 96.A N ALA 47.A O no hydrogen 2.987 N/A GLU 97.A N GLN 81.A O no hydrogen 3.154 N/A SER 100.A N LEU 155.A O no hydrogen 3.092 N/A SER 102.A OG ASP 104.A OD2 no hydrogen 2.842 N/A PHE 103.A N PRO 150.A O no hydrogen 3.230 N/A PHE 103.A N ILE 153.A O no hydrogen 3.050 N/A LYS 105.A N SER 102.A O no hydrogen 3.235 N/A LYS 105.A NZ THR 101.A OG1 no hydrogen 2.737 N/A PHE 106.A N SER 102.A O no hydrogen 2.932 N/A TYR 107.A N PHE 103.A O no hydrogen 2.941 N/A TYR 109.A N LYS 105.A O no hydrogen 3.195 N/A TYR 109.A N PHE 106.A O no hydrogen 3.192 N/A VAL 110.A N PHE 106.A O no hydrogen 2.918 N/A TYR 111.A N TYR 107.A O no hydrogen 3.162 N/A SER 112.A N LYS 108.A O no hydrogen 3.249 N/A SER 112.A OG LYS 108.A O no hydrogen 3.196 N/A VAL 113.A N TYR 109.A O no hydrogen 3.050 N/A ASP 116.A N VAL 110.A O no hydrogen 2.799 N/A VAL 117.A N ASP 116.A OD1 no hydrogen 2.635 N/A LEU 123.A N PRO 119.A O no hydrogen 3.268 N/A GLY 124.A N GLU 120.A O no hydrogen 2.666 N/A LYS 125.A N GLU 121.A O no hydrogen 3.101 N/A LYS 125.A NZ TYR 251.A O no hydrogen 2.558 N/A LYS 125.A NZ ARG 254.A O no hydrogen 3.394 N/A ILE 126.A N ILE 122.A O no hydrogen 2.862 N/A THR 127.A N LEU 123.A O no hydrogen 2.762 N/A LEU 128.A N GLY 124.A O no hydrogen 3.002 N/A ALA 129.A N LYS 125.A O no hydrogen 2.806 N/A THR 130.A N ILE 126.A O no hydrogen 2.938 N/A THR 130.A OG1 ILE 126.A O no hydrogen 2.801 N/A VAL 131.A N THR 127.A O no hydrogen 3.078 N/A LYS 132.A N LEU 128.A O no hydrogen 2.857 N/A LYS 132.A NZ TYR 78.A OH no hydrogen 2.810 N/A ALA 133.A N ALA 129.A O no hydrogen 2.665 N/A LEU 134.A N THR 130.A O no hydrogen 2.780 N/A ASN 135.A N VAL 131.A O no hydrogen 2.639 N/A HIS 136.A N LYS 132.A O no hydrogen 3.182 N/A LEU 137.A N ALA 133.A O no hydrogen 3.037 N/A LYS 138.A N LEU 134.A O no hydrogen 3.382 N/A GLU 139.A N ASN 135.A O no hydrogen 2.922 N/A ASN 140.A N HIS 136.A O no hydrogen 2.710 N/A LYS 142.A NZ GLU 139.A O no hydrogen 3.117 N/A ILE 143.A N LEU 137.A O no hydrogen 2.706 N/A HIS 145.A NE2 CYS 164.A O no hydrogen 2.728 N/A ARG 146.A N ASP 177.A OD2 no hydrogen 2.891 N/A ARG 146.A NH1 GLY 170.A O no hydrogen 2.817 N/A ASP 147.A N HIS 145.A ND1 no hydrogen 2.940 N/A ASN 152.A N LYS 149.A O no hydrogen 2.827 N/A ASN 152.A ND2 ASP 147.A O no hydrogen 3.207 N/A ILE 153.A N PRO 150.A O no hydrogen 2.931 N/A LEU 154.A N LYS 162.A O no hydrogen 3.064 N/A LEU 155.A N THR 101.A O no hydrogen 2.993 N/A ARG 157.A NH1 ASP 267.A OD1 no hydrogen 3.133 N/A ARG 157.A NH2 ASP 267.A OD1 no hydrogen 3.287 N/A SER 158.A N ASP 156.A O no hydrogen 2.167 N/A SER 158.A N ASP 156.A OD1 no hydrogen 3.121 N/A GLY 159.A N ASP 156.A O no hydrogen 2.597 N/A ASN 160.A ND2 ASP 156.A OD1 no hydrogen 3.495 N/A ASN 160.A ND2 ASP 156.A OD2 no hydrogen 3.370 N/A LYS 162.A N LEU 154.A O no hydrogen 3.329 N/A LYS 162.A NZ GLU 97.A OE1 no hydrogen 2.644 N/A LYS 162.A NZ GLU 97.A OE2 no hydrogen 3.203 N/A LEU 163.A N TYR 78.A O no hydrogen 2.916 N/A CYS 164.A SG ASN 152.A O no hydrogen 3.553 N/A CYS 164.A SG ASN 152.A OD1 no hydrogen 3.632 N/A CYS 164.A SG ASP 165.A OD2 no hydrogen 2.628 N/A SER 169.A OG ASP 165.A O no hydrogen 2.979 N/A ARG 175.A NE ASP 173.A OD2 no hydrogen 2.667 N/A SER 176.A OG ASP 173.A O no hydrogen 3.205 N/A SER 176.A OG ASP 177.A OD1 no hydrogen 3.385 N/A VAL 178.A N VAL 174.A O no hydrogen 3.251 N/A TRP 179.A N ARG 175.A O no hydrogen 2.939 N/A LEU 181.A N ASP 177.A O no hydrogen 2.788 N/A GLY 182.A N TRP 179.A O no hydrogen 2.524 N/A ILE 183.A N TRP 179.A O no hydrogen 3.152 N/A THR 184.A N SER 180.A O no hydrogen 3.144 N/A THR 184.A OG1 SER 180.A O no hydrogen 3.034 N/A LEU 185.A N LEU 181.A O no hydrogen 3.013 N/A TYR 186.A N GLY 182.A O no hydrogen 3.062 N/A GLU 187.A N ILE 183.A O no hydrogen 3.192 N/A LEU 188.A N THR 184.A O no hydrogen 3.079 N/A ALA 189.A N TYR 186.A O no hydrogen 2.555 N/A THR 190.A N TYR 186.A O no hydrogen 2.935 N/A THR 190.A OG1 TYR 186.A O no hydrogen 3.255 N/A THR 190.A OG1 ARG 192.A O no hydrogen 3.250 N/A GLY 191.A N GLU 187.A O no hydrogen 2.743 N/A ARG 192.A N THR 190.A OG1 no hydrogen 2.710 N/A ARG 192.A NH2 GLU 214.A OE1 no hydrogen 3.279 N/A SER 210.A OG GLN 208.A O no hydrogen 2.609 N/A SER 212.A OG GLU 214.A OE2 no hydrogen 3.536 N/A ARG 215.A NH1 ILE 118.A O no hydrogen 3.046 N/A ARG 215.A NH2 ILE 118.A O no hydrogen 2.780 N/A PHE 217.A N ASN 211.A OD1 no hydrogen 2.831 N/A SER 218.A N GLU 120.A OE1 no hydrogen 3.249 N/A ILE 222.A N SER 218.A O no hydrogen 3.210 N/A ASN 223.A N PRO 219.A O no hydrogen 2.962 N/A ASN 223.A N SER 220.A O no hydrogen 3.071 N/A PHE 224.A N SER 220.A O no hydrogen 3.140 N/A VAL 225.A N PHE 221.A O no hydrogen 3.399 N/A ASN 226.A N ILE 222.A O no hydrogen 3.308 N/A ASN 226.A N ASN 223.A O no hydrogen 3.106 N/A ASN 226.A ND2 LEU 209.A O no hydrogen 3.507 N/A LEU 227.A N ASN 223.A O no hydrogen 2.774 N/A CYS 228.A N PHE 224.A O no hydrogen 3.075 N/A CYS 228.A SG PHE 224.A O no hydrogen 3.405 N/A LEU 229.A N VAL 225.A O no hydrogen 3.082 N/A THR 230.A N LEU 227.A O no hydrogen 2.529 N/A THR 230.A OG1 LEU 227.A O no hydrogen 2.301 N/A LYS 231.A NZ LYS 203.A O no hydrogen 3.267 N/A SER 234.A OG ASP 232.A OD1 no hydrogen 3.402 N/A SER 234.A OG ASP 232.A OD2 no hydrogen 2.864 N/A LYS 235.A N ASP 232.A O no hydrogen 2.842 N/A ARG 236.A N ASP 232.A O no hydrogen 3.232 N/A ARG 236.A NE THR 230.A O no hydrogen 3.093 N/A ARG 236.A NH2 THR 230.A O no hydrogen 2.852 N/A LYS 238.A NZ ARG 236.A O no hydrogen 2.822 N/A LYS 238.A NZ PRO 237.A O no hydrogen 2.383 N/A GLU 241.A N LYS 238.A O no hydrogen 2.780 N/A LEU 242.A N LYS 238.A O no hydrogen 3.190 N/A LEU 243.A N TYR 239.A O no hydrogen 2.740 N/A LYS 244.A N GLU 241.A O no hydrogen 2.717 N/A HIS 245.A N LEU 242.A O no hydrogen 2.676 N/A PHE 247.A N HIS 245.A ND1 no hydrogen 2.983 N/A TYR 251.A N PHE 247.A O no hydrogen 3.097 N/A TYR 251.A OH GLU 120.A OE2 no hydrogen 3.414 N/A GLU 252.A N ILE 248.A O no hydrogen 2.958 N/A GLU 253.A N MET 250.A O no hydrogen 3.342 N/A ARG 254.A N MET 250.A O no hydrogen 3.063 N/A ARG 254.A NE ALA 255.A O no hydrogen 2.864 N/A ARG 254.A NH2 ALA 255.A O no hydrogen 2.765 N/A VAL 258.A N VAL 256.A O no hydrogen 2.811 N/A TYR 261.A N GLU 257.A O no hydrogen 3.458 N/A VAL 262.A N VAL 258.A O no hydrogen 3.069 N/A VAL 262.A N ALA 259.A O no hydrogen 3.252 N/A CYS 263.A N ALA 259.A O no hydrogen 3.119 N/A CYS 263.A SG ARG 157.A O no hydrogen 3.164 N/A CYS 263.A SG ALA 259.A O no hydrogen 3.099 N/A LYS 264.A N CYS 260.A O no hydrogen 3.027 N/A ILE 265.A N TYR 261.A O no hydrogen 3.024 N/A LEU 266.A N VAL 262.A O no hydrogen 2.806 N/A ASP 267.A N CYS 263.A O no hydrogen 2.629 N/A GLN 268.A N LYS 264.A O no hydrogen 3.240 N/A MET 269.A N ILE 265.A O no hydrogen 3.328 N/A MET 269.A N LEU 266.A O no hydrogen 3.304 N/A