Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3otb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N SER 1.A OG no hydrogen 3.207 N/A GLU 4.A N SER 1.A OG no hydrogen 2.648 N/A VAL 6.A N PHE 3.A O no hydrogen 3.294 N/A ARG 7.A N GLU 4.A O no hydrogen 3.024 N/A ASP 8.A N TYR 5.A O no hydrogen 2.774 N/A PHE 9.A N VAL 6.A O no hydrogen 3.353 N/A GLU 10.A N ARG 7.A O no hydrogen 3.217 N/A THR 14.A N ASP 12.A OD2 no hydrogen 3.087 N/A THR 14.A OG1 ASP 12.A OD1 no hydrogen 2.489 N/A THR 14.A OG1 ASP 12.A OD2 no hydrogen 3.283 N/A CYS 15.A N ARG 88.A O no hydrogen 2.922 N/A CYS 15.A SG ARG 88.A O no hydrogen 3.666 N/A CYS 19.A SG ALA 17.A O no hydrogen 3.665 N/A TRP 20.A N TYR 131.A O no hydrogen 2.871 N/A TRP 20.A NE1 ASN 134.A OD1 no hydrogen 3.194 N/A VAL 22.A N VAL 129.A O no hydrogen 2.913 N/A VAL 23.A N PHE 77.A O no hydrogen 2.899 N/A ARG 24.A N ARG 127.A O no hydrogen 3.136 N/A LEU 25.A N TYR 75.A O no hydrogen 2.705 N/A ASP 26.A N ASP 125.A O no hydrogen 3.252 N/A GLY 27.A N ASP 73.A O no hydrogen 2.711 N/A ARG 28.A N GLY 123.A O no hydrogen 2.679 N/A PHE 33.A N ASN 29.A O no hydrogen 3.263 N/A ALA 34.A N PHE 30.A O no hydrogen 2.823 N/A GLU 35.A N HIS 31.A O no hydrogen 3.373 N/A LYS 36.A N ARG 32.A O no hydrogen 3.323 N/A HIS 37.A N PHE 33.A O no hydrogen 3.054 N/A HIS 37.A ND1 PHE 33.A O no hydrogen 3.087 N/A ASN 38.A N GLU 35.A O no hydrogen 2.944 N/A ASN 38.A ND2 GLN 116.A OE1 no hydrogen 2.889 N/A PHE 39.A N ALA 34.A O no hydrogen 2.869 N/A ALA 40.A N ASP 44.A OD2 no hydrogen 2.628 N/A ASN 43.A ND2 ASN 152.A OD1 no hydrogen 2.975 N/A SER 45.A OG TYR 203.A OH no hydrogen 2.992 N/A ARG 46.A NE ASP 44.A OD1 no hydrogen 3.155 N/A ARG 46.A NH2 ASN 38.A O no hydrogen 2.773 N/A ARG 46.A NH2 ASP 44.A OD2 no hydrogen 2.945 N/A ALA 47.A N ASP 44.A OD1 no hydrogen 3.244 N/A LEU 48.A N ASP 44.A O no hydrogen 3.375 N/A GLN 49.A N SER 45.A O no hydrogen 3.264 N/A LEU 50.A N ARG 46.A O no hydrogen 2.858 N/A MET 51.A N ALA 47.A O no hydrogen 2.858 N/A THR 52.A N LEU 48.A O no hydrogen 2.963 N/A THR 52.A OG1 LEU 48.A O no hydrogen 2.683 N/A THR 52.A OG1 TYR 75.A OH no hydrogen 3.073 N/A LYS 53.A N GLN 49.A O no hydrogen 2.775 N/A CYS 54.A N LEU 50.A O no hydrogen 2.804 N/A CYS 54.A SG LEU 50.A O no hydrogen 3.455 N/A CYS 54.A SG PHE 101.A O no hydrogen 3.726 N/A ALA 55.A N MET 51.A O no hydrogen 2.878 N/A GLN 56.A N THR 52.A O no hydrogen 3.318 N/A GLN 56.A N LYS 53.A O no hydrogen 2.547 N/A GLN 56.A NE2 PRO 215.A O no hydrogen 2.621 N/A THR 57.A N LYS 53.A O no hydrogen 3.100 N/A VAL 58.A N CYS 54.A O no hydrogen 2.938 N/A MET 59.A N ALA 55.A O no hydrogen 2.970 N/A GLU 60.A N THR 57.A O no hydrogen 3.028 N/A GLU 61.A N THR 57.A O no hydrogen 2.789 N/A LEU 62.A N VAL 58.A O no hydrogen 2.924 N/A VAL 66.A N VAL 78.A O no hydrogen 3.071 N/A TYR 69.A N SER 76.A O no hydrogen 2.990 N/A TYR 69.A OH LYS 205.A O no hydrogen 3.149 N/A GLY 70.A N THR 207.A O no hydrogen 2.835 N/A GLN 71.A N GLU 74.A O no hydrogen 3.078 N/A GLN 71.A NE2 ARG 144.A O no hydrogen 3.037 N/A GLU 74.A N GLN 71.A O no hydrogen 2.853 N/A TYR 75.A N LEU 25.A O no hydrogen 2.901 N/A TYR 75.A OH THR 52.A OG1 no hydrogen 3.073 N/A SER 76.A N TYR 69.A O no hydrogen 2.851 N/A SER 76.A OG TYR 140.A OH no hydrogen 2.891 N/A PHE 77.A N VAL 23.A O no hydrogen 2.793 N/A VAL 78.A N ILE 67.A O no hydrogen 2.857 N/A PHE 79.A N VAL 21.A O no hydrogen 2.994 N/A LYS 80.A N ASP 64.A O no hydrogen 2.644 N/A LYS 80.A NZ ASP 64.A OD1 no hydrogen 3.287 N/A LYS 80.A NZ GLU 237.A OE2 no hydrogen 3.313 N/A LYS 82.A NZ GLU 237.A O no hydrogen 2.552 N/A THR 83.A N LYS 80.A O no hydrogen 2.700 N/A THR 83.A OG1 ASP 64.A OD2 no hydrogen 3.047 N/A TRP 85.A N THR 83.A OG1 no hydrogen 3.069 N/A LYS 87.A N ASN 84.A O no hydrogen 3.057 N/A ARG 88.A N TRP 85.A O no hydrogen 3.288 N/A ARG 88.A NE CYS 15.A O no hydrogen 3.110 N/A ARG 88.A NH1 ARG 81.A O no hydrogen 2.904 N/A ARG 88.A NH1 THR 83.A O no hydrogen 2.837 N/A ARG 88.A NH2 LEU 16.A O no hydrogen 3.144 N/A ARG 88.A NH2 CYS 19.A O no hydrogen 2.773 N/A ARG 88.A NH2 ARG 81.A O no hydrogen 3.499 N/A ARG 89.A N PHE 86.A O no hydrogen 2.995 N/A ALA 90.A N ASP 13.A O no hydrogen 2.931 N/A SER 91.A N ASP 13.A OD2 no hydrogen 3.291 N/A SER 91.A OG ASP 13.A OD2 no hydrogen 2.782 N/A LYS 92.A N ARG 89.A O no hydrogen 2.947 N/A PHE 93.A N ARG 89.A O no hydrogen 3.362 N/A MET 94.A N ALA 90.A O no hydrogen 3.146 N/A THR 95.A N SER 91.A O no hydrogen 3.121 N/A THR 95.A OG1 SER 91.A O no hydrogen 2.766 N/A THR 95.A OG1 LYS 92.A O no hydrogen 3.281 N/A HIS 96.A N LYS 92.A O no hydrogen 2.955 N/A VAL 97.A N PHE 93.A O no hydrogen 3.461 N/A ALA 98.A N MET 94.A O no hydrogen 2.886 N/A SER 99.A N THR 95.A O no hydrogen 2.856 N/A SER 99.A OG THR 95.A O no hydrogen 3.187 N/A SER 99.A OG HIS 96.A O no hydrogen 3.046 N/A GLN 100.A N HIS 96.A O no hydrogen 2.831 N/A PHE 101.A N VAL 97.A O no hydrogen 3.039 N/A ALA 102.A N ALA 98.A O no hydrogen 3.128 N/A SER 103.A N SER 99.A O no hydrogen 2.983 N/A SER 103.A N GLN 100.A O no hydrogen 3.141 N/A SER 103.A OG GLN 100.A O no hydrogen 2.940 N/A SER 104.A N GLN 100.A O no hydrogen 2.905 N/A SER 104.A OG GLN 100.A O no hydrogen 3.188 N/A TYR 105.A N PHE 101.A O no hydrogen 2.887 N/A PHE 107.A N SER 103.A O no hydrogen 3.079 N/A TYR 108.A N SER 104.A O no hydrogen 3.009 N/A TRP 109.A N VAL 106.A O no hydrogen 3.408 N/A TRP 109.A NE1 GLN 116.A O no hydrogen 2.982 N/A TYR 112.A N TRP 109.A O no hydrogen 3.199 N/A PHE 113.A N TRP 109.A O no hydrogen 2.907 N/A GLN 116.A NE2 PRO 117.A O no hydrogen 3.105 N/A LEU 119.A N HIS 37.A NE2 no hydrogen 3.115 N/A ASP 125.A N ASP 26.A O no hydrogen 3.269 N/A ARG 127.A NH2 ASP 125.A OD2 no hydrogen 3.480 N/A VAL 129.A N VAL 22.A O no hydrogen 2.815 N/A TYR 131.A N TRP 20.A O no hydrogen 2.794 N/A SER 133.A N THR 136.A OG1 no hydrogen 2.905 N/A SER 133.A OG THR 136.A OG1 no hydrogen 2.593 N/A THR 136.A N SER 133.A OG no hydrogen 2.998 N/A THR 136.A OG1 SER 133.A O no hydrogen 2.564 N/A THR 136.A OG1 SER 133.A OG no hydrogen 2.593 N/A LEU 137.A N SER 133.A O no hydrogen 2.987 N/A LYS 138.A N ASN 134.A O no hydrogen 2.777 N/A ASP 139.A N GLN 135.A O no hydrogen 2.798 N/A TYR 140.A N THR 136.A O no hydrogen 2.821 N/A TYR 140.A OH SER 76.A OG no hydrogen 2.891 N/A LEU 141.A N LEU 137.A O no hydrogen 3.009 N/A SER 142.A N LYS 138.A O no hydrogen 2.894 N/A SER 142.A OG LYS 138.A O no hydrogen 3.042 N/A TRP 143.A N ASP 139.A O no hydrogen 2.788 N/A ARG 144.A N TYR 140.A O no hydrogen 3.042 N/A ARG 144.A NE GLU 74.A OE2 no hydrogen 3.081 N/A ARG 144.A NH2 GLU 74.A OE1 no hydrogen 3.089 N/A ARG 144.A NH2 GLU 74.A OE2 no hydrogen 3.395 N/A GLN 145.A N LEU 141.A O no hydrogen 2.828 N/A GLN 145.A NE2 LYS 205.A O no hydrogen 2.894 N/A GLN 145.A NE2 CYS 220.A O no hydrogen 3.249 N/A ALA 146.A N SER 142.A O no hydrogen 2.757 N/A ASP 147.A N TRP 143.A O no hydrogen 2.991 N/A CYS 148.A N ARG 144.A O no hydrogen 2.808 N/A CYS 148.A SG TYR 203.A O no hydrogen 3.899 N/A HIS 149.A N GLN 145.A O no hydrogen 2.780 N/A ILE 150.A N ALA 146.A O no hydrogen 2.999 N/A ASN 151.A N ASP 147.A O no hydrogen 3.024 N/A ASN 151.A N CYS 148.A O no hydrogen 2.974 N/A ASN 151.A ND2 ASP 147.A OD1 no hydrogen 2.828 N/A ASN 152.A N CYS 148.A O no hydrogen 2.860 N/A ASN 152.A ND2 TYR 196.A OH no hydrogen 3.392 N/A LEU 153.A N HIS 149.A O no hydrogen 3.259 N/A TYR 154.A N ASN 151.A O no hydrogen 3.140 N/A ASN 155.A N ASN 151.A O no hydrogen 2.722 N/A THR 156.A N ASN 152.A O no hydrogen 2.827 N/A THR 156.A OG1 ASN 152.A O no hydrogen 2.620 N/A PHE 158.A N ASN 155.A O no hydrogen 2.970 N/A TRP 159.A N ASN 155.A O no hydrogen 2.766 N/A ALA 160.A N THR 156.A O no hydrogen 3.228 N/A GLN 163.A N TRP 159.A O no hydrogen 2.860 N/A GLY 166.A N GLN 163.A O no hydrogen 3.286 N/A LEU 167.A N LEU 161.A O no hydrogen 2.805 N/A THR 168.A N GLN 171.A OE1 no hydrogen 2.822 N/A GLN 171.A N THR 168.A O no hydrogen 2.949 N/A ALA 172.A N THR 168.A O no hydrogen 3.282 N/A GLN 173.A N PRO 169.A O no hydrogen 3.109 N/A GLY 174.A N VAL 170.A O no hydrogen 3.401 N/A ARG 175.A N GLN 171.A O no hydrogen 2.735 N/A LEU 176.A N ALA 172.A O no hydrogen 3.062 N/A GLN 177.A N GLN 173.A O no hydrogen 2.984 N/A GLN 177.A NE2 GLN 173.A O no hydrogen 3.050 N/A THR 179.A N LEU 176.A O no hydrogen 3.037 N/A THR 179.A OG1 LEU 176.A O no hydrogen 2.627 N/A LYS 184.A N LEU 180.A O no hydrogen 3.236 N/A LYS 184.A NZ THR 179.A O no hydrogen 3.062 N/A LYS 184.A NZ THR 179.A OG1 no hydrogen 2.874 N/A LYS 184.A NZ LEU 180.A O no hydrogen 3.556 N/A ASN 185.A N ALA 181.A O no hydrogen 3.067 N/A GLU 186.A N ALA 182.A O no hydrogen 3.040 N/A ILE 187.A N ASP 183.A O no hydrogen 3.112 N/A LEU 188.A N LYS 184.A O no hydrogen 3.085 N/A PHE 189.A N ASN 185.A O no hydrogen 3.404 N/A SER 190.A N GLU 186.A O no hydrogen 2.873 N/A SER 190.A OG GLU 186.A OE1 no hydrogen 3.198 N/A GLU 191.A N ILE 187.A O no hydrogen 3.202 N/A PHE 192.A N LEU 188.A O no hydrogen 2.902 N/A ILE 194.A N LEU 188.A O no hydrogen 3.234 N/A ASN 197.A ND2 ASN 195.A OD1 no hydrogen 3.631 N/A ASN 198.A N ASN 195.A O no hydrogen 2.824 N/A GLU 199.A N TYR 196.A O no hydrogen 2.586 N/A TYR 203.A N LEU 200.A O no hydrogen 2.771 N/A TYR 203.A OH SER 45.A OG no hydrogen 2.992 N/A LYS 205.A NZ ASP 221.A OD1 no hydrogen 3.395 N/A THR 207.A N GLY 70.A O no hydrogen 3.008 N/A VAL 208.A N LEU 218.A O no hydrogen 2.891 N/A LEU 209.A N ALA 68.A O no hydrogen 3.110 N/A ILE 210.A N VAL 216.A O no hydrogen 3.363 N/A TRP 211.A NE1 ILE 65.A O no hydrogen 2.910 N/A GLN 212.A N LYS 214.A O no hydrogen 2.911 N/A VAL 216.A N ILE 210.A O no hydrogen 2.748 N/A LEU 218.A N VAL 208.A O no hydrogen 3.058 N/A ILE 222.A N GLN 145.A OE1 no hydrogen 2.867 N/A GLY 224.A N ASP 221.A OD2 no hydrogen 2.746 N/A TRP 228.A NE1 ILE 222.A O no hydrogen 2.508 N/A LYS 229.A N ASP 225.A O no hydrogen 2.802 N/A GLU 230.A N ALA 226.A O no hydrogen 2.782 N/A HIS 231.A N TRP 228.A O no hydrogen 2.957 N/A