Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kio_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 6.A N SER 3.A O no hydrogen 2.956 N/A ASP 8.A N LEU 5.A O no hydrogen 3.394 N/A ASN 9.A N GLU 6.A O no hydrogen 3.067 N/A ARG 12.A NH1 ASP 90.A OD2 no hydrogen 2.611 N/A ARG 14.A NE ASP 90.A OD1 no hydrogen 3.158 N/A LEU 15.A N LEU 89.A O no hydrogen 3.038 N/A SER 16.A OG TYR 122.A OH no hydrogen 2.878 N/A SER 17.A N TRP 87.A O no hydrogen 2.965 N/A SER 17.A OG PRO 18.A O no hydrogen 2.908 N/A SER 17.A OG TRP 87.A O no hydrogen 3.438 N/A CYS 23.A N PRO 20.A O no hydrogen 2.927 N/A LEU 24.A N ALA 21.A O no hydrogen 2.847 N/A LYS 25.A N VAL 22.A O no hydrogen 3.044 N/A GLU 26.A N VAL 22.A O no hydrogen 2.998 N/A CYS 28.A N ASN 129.A O no hydrogen 2.824 N/A CYS 28.A SG GLU 26.A O no hydrogen 3.583 N/A VAL 29.A N CYS 50.A O no hydrogen 3.162 N/A LEU 30.A N GLN 132.A O no hydrogen 2.849 N/A GLY 31.A N CYS 48.A O no hydrogen 2.960 N/A VAL 32.A N PHE 134.A O no hydrogen 2.879 N/A ASP 33.A N ALA 46.A O no hydrogen 3.188 N/A GLU 34.A N ASP 33.A OD1 no hydrogen 2.865 N/A ALA 35.A N VAL 44.A O no hydrogen 2.770 N/A VAL 40.A N GLY 203.A O no hydrogen 3.042 N/A GLY 42.A N PHE 227.A O no hydrogen 3.165 N/A VAL 44.A N ALA 35.A O no hydrogen 2.572 N/A TYR 45.A N ASP 90.A O no hydrogen 3.161 N/A ALA 46.A N ASP 33.A O no hydrogen 2.902 N/A ILE 47.A N ALA 88.A O no hydrogen 2.954 N/A CYS 48.A N GLY 31.A O no hydrogen 3.076 N/A CYS 48.A SG GLY 86.A O no hydrogen 3.803 N/A TYR 49.A N GLY 86.A O no hydrogen 3.039 N/A CYS 50.A N VAL 29.A O no hydrogen 3.287 N/A CYS 50.A SG PRO 51.A O no hydrogen 3.725 N/A LEU 52.A N PRO 27.A O no hydrogen 2.807 N/A ARG 54.A N PRO 51.A O no hydrogen 2.791 N/A LEU 55.A N LEU 52.A O no hydrogen 3.264 N/A ASP 57.A N ARG 54.A O no hydrogen 3.203 N/A LEU 58.A N LEU 55.A O no hydrogen 2.570 N/A GLU 59.A N LEU 55.A O no hydrogen 3.136 N/A LEU 61.A N ALA 56.A O no hydrogen 2.978 N/A VAL 63.A N LEU 58.A O no hydrogen 3.269 N/A ASN 70.A N THR 68.A OG1 no hydrogen 3.230 N/A GLU 71.A N THR 68.A OG1 no hydrogen 3.169 N/A ARG 72.A N THR 68.A O no hydrogen 3.047 N/A ARG 74.A N ASN 70.A O no hydrogen 3.410 N/A ARG 74.A N GLU 71.A O no hydrogen 3.146 N/A LEU 75.A N GLU 71.A O no hydrogen 3.291 N/A PHE 76.A N ARG 72.A O no hydrogen 3.455 N/A ALA 77.A N ARG 74.A O no hydrogen 2.740 N/A LYS 78.A N ARG 74.A O no hydrogen 3.313 N/A LYS 78.A N LEU 75.A O no hydrogen 3.185 N/A GLU 80.A N LYS 78.A O no hydrogen 3.070 N/A ASP 81.A N LYS 78.A O no hydrogen 3.117 N/A PHE 84.A N ASP 81.A O no hydrogen 3.261 N/A VAL 85.A N ASP 81.A O no hydrogen 3.445 N/A GLY 86.A N TYR 49.A O no hydrogen 3.161 N/A TRP 87.A N SER 17.A OG no hydrogen 3.232 N/A ALA 88.A N ILE 47.A O no hydrogen 3.271 N/A LEU 89.A N LEU 15.A O no hydrogen 2.758 N/A ASP 90.A N TYR 45.A O no hydrogen 2.873 N/A VAL 91.A N CYS 13.A O no hydrogen 2.699 N/A SER 93.A OG ASP 8.A OD2 no hydrogen 2.421 N/A SER 93.A OG GLY 11.A O no hydrogen 2.673 N/A ASN 95.A ND2 ASP 8.A OD1 no hydrogen 2.822 N/A ASN 95.A ND2 ASP 8.A OD2 no hydrogen 3.524 N/A ILE 97.A N SER 93.A O no hydrogen 3.123 N/A SER 98.A N PRO 94.A O no hydrogen 3.021 N/A SER 98.A OG PRO 94.A O no hydrogen 2.501 N/A THR 99.A N ASN 95.A O no hydrogen 2.775 N/A THR 99.A OG1 ASN 95.A O no hydrogen 2.813 N/A THR 99.A OG1 LEU 96.A O no hydrogen 3.080 N/A SER 100.A N LEU 96.A O no hydrogen 2.722 N/A SER 100.A OG LEU 96.A O no hydrogen 2.618 N/A TYR 106.A OH ASP 114.A OD2 no hydrogen 2.680 N/A LEU 111.A N ASN 107.A O no hydrogen 2.900 N/A SER 112.A N LEU 108.A O no hydrogen 2.957 N/A SER 112.A OG LEU 108.A O no hydrogen 2.691 N/A HIS 113.A N ASN 109.A O no hydrogen 3.013 N/A ASP 114.A N SER 110.A O no hydrogen 2.933 N/A THR 115.A N LEU 111.A O no hydrogen 3.244 N/A THR 115.A OG1 LEU 111.A O no hydrogen 2.964 N/A ALA 116.A N SER 112.A O no hydrogen 2.949 N/A ALA 117.A N HIS 113.A O no hydrogen 2.564 N/A GLY 118.A N ASP 114.A O no hydrogen 2.657 N/A LEU 119.A N THR 115.A O no hydrogen 2.861 N/A ILE 120.A N ALA 116.A O no hydrogen 3.365 N/A ILE 120.A N ALA 117.A O no hydrogen 3.092 N/A GLN 121.A N ALA 117.A O no hydrogen 2.827 N/A GLN 121.A NE2 GLN 121.A O no hydrogen 3.209 N/A GLN 121.A NE2 ASP 125.A OD1 no hydrogen 3.429 N/A TYR 122.A N GLY 118.A O no hydrogen 3.009 N/A LEU 124.A N ILE 120.A O no hydrogen 3.357 N/A LEU 124.A N GLN 121.A O no hydrogen 3.242 N/A ASP 125.A N GLN 121.A O no hydrogen 3.090 N/A ASN 127.A N LEU 124.A O no hydrogen 2.760 N/A VAL 128.A N ALA 123.A O no hydrogen 3.049 N/A ASN 129.A N CYS 23.A O no hydrogen 3.010 N/A THR 131.A N CYS 28.A O no hydrogen 3.020 N/A THR 131.A OG1 CYS 28.A O no hydrogen 3.429 N/A VAL 133.A N GLU 155.A O no hydrogen 2.876 N/A VAL 135.A N THR 157.A O no hydrogen 2.872 N/A ASP 136.A N VAL 32.A O no hydrogen 3.002 N/A THR 137.A N ASP 136.A OD1 no hydrogen 2.943 N/A THR 137.A N LYS 159.A O no hydrogen 3.273 N/A GLN 144.A N PRO 140.A O no hydrogen 2.910 N/A ALA 145.A N GLU 141.A O no hydrogen 2.796 N/A LEU 147.A N TYR 143.A O no hydrogen 3.225 N/A GLN 148.A N GLN 144.A O no hydrogen 2.752 N/A GLN 148.A NE2 GLN 148.A O no hydrogen 3.288 N/A GLN 148.A NE2 ILE 154.A O no hydrogen 2.874 N/A GLN 149.A N ALA 145.A O no hydrogen 3.104 N/A HIS 150.A N ARG 146.A O no hydrogen 3.272 N/A GLU 155.A N THR 131.A O no hydrogen 3.098 N/A VAL 156.A N GLN 148.A OE1 no hydrogen 3.000 N/A THR 157.A N VAL 133.A O no hydrogen 2.848 N/A VAL 158.A N GLN 144.A OE1 no hydrogen 2.944 N/A LYS 159.A N VAL 135.A O no hydrogen 3.041 N/A ALA 162.A N ASP 136.A OD1 no hydrogen 3.172 N/A SER 164.A N LYS 161.A O no hydrogen 3.480 N/A SER 164.A OG LYS 161.A O no hydrogen 2.956 N/A LEU 165.A N ALA 162.A O no hydrogen 3.277 N/A PHE 166.A N ALA 162.A O no hydrogen 3.191 N/A VAL 169.A N PHE 166.A O no hydrogen 3.169 N/A SER 170.A N PHE 166.A O no hydrogen 3.228 N/A SER 170.A OG ASP 163.A O no hydrogen 3.392 N/A ALA 171.A N PRO 167.A O no hydrogen 3.054 N/A ALA 172.A N VAL 168.A O no hydrogen 3.237 N/A SER 173.A N VAL 169.A O no hydrogen 2.934 N/A SER 173.A OG ASP 33.A OD2 no hydrogen 3.470 N/A ILE 174.A N SER 170.A O no hydrogen 3.338 N/A ILE 174.A N ALA 171.A O no hydrogen 2.736 N/A PHE 175.A N ALA 171.A O no hydrogen 2.928 N/A ALA 176.A N ALA 172.A O no hydrogen 2.986 N/A LYS 177.A N SER 173.A O no hydrogen 3.050 N/A VAL 178.A N ILE 174.A O no hydrogen 2.900 N/A ALA 179.A N PHE 175.A O no hydrogen 2.870 N/A ARG 180.A N ALA 176.A O no hydrogen 3.024 N/A ASP 181.A N LYS 177.A O no hydrogen 3.188 N/A LYS 182.A N VAL 178.A O no hydrogen 3.068 N/A ALA 183.A N ALA 179.A O no hydrogen 2.881 N/A VAL 184.A N ARG 180.A O no hydrogen 2.993 N/A LYS 185.A N ASP 181.A O no hydrogen 2.940 N/A ASN 186.A N LYS 182.A O no hydrogen 3.043 N/A TRP 187.A N ALA 183.A O no hydrogen 3.383 N/A GLN 188.A N VAL 184.A O no hydrogen 2.921 N/A GLN 188.A NE2 TYR 200.A OH no hydrogen 3.001 N/A PHE 189.A N LYS 185.A O no hydrogen 2.845 N/A VAL 190.A N ASN 186.A O no hydrogen 3.051 N/A GLU 191.A N TRP 187.A O no hydrogen 2.840 N/A ASN 192.A N GLN 188.A O no hydrogen 2.750 N/A LEU 193.A N PHE 189.A O no hydrogen 2.655 N/A GLN 194.A N VAL 190.A O no hydrogen 3.232 N/A ASP 195.A N ASN 192.A O no hydrogen 2.985 N/A LEU 196.A N GLU 191.A O no hydrogen 2.908 N/A SER 198.A OG ASN 192.A OD1 no hydrogen 3.009 N/A ASP 199.A N ASP 197.A OD2 no hydrogen 3.266 N/A GLY 203.A N THR 210.A OG1 no hydrogen 2.955 N/A TYR 204.A N SER 202.A OG no hydrogen 3.199 N/A ASN 206.A ND2 PRO 205.A O no hydrogen 2.328 N/A ASN 206.A ND2 ASP 207.A OD1 no hydrogen 3.112 N/A ASP 207.A N TYR 204.A O no hydrogen 3.350 N/A LYS 209.A NZ ASP 199.A OD1 no hydrogen 2.986 N/A THR 210.A N ASP 207.A O no hydrogen 2.566 N/A THR 210.A OG1 TYR 200.A O no hydrogen 2.868 N/A THR 210.A OG1 TYR 204.A O no hydrogen 3.499 N/A LYS 211.A N ASP 207.A O no hydrogen 3.424 N/A ALA 212.A N LYS 209.A O no hydrogen 3.096 N/A TRP 213.A N LYS 209.A O no hydrogen 2.869 N/A LEU 214.A N THR 210.A O no hydrogen 3.109 N/A ARG 215.A N LYS 211.A O no hydrogen 3.297 N/A LYS 216.A N ALA 212.A O no hydrogen 3.025 N/A HIS 217.A N LEU 214.A O no hydrogen 3.016 N/A ASP 219.A N GLY 223.A O no hydrogen 2.863 N/A VAL 221.A N ASP 219.A OD2 no hydrogen 2.938 N/A PHE 222.A N ASP 219.A OD2 no hydrogen 2.956 N/A GLY 223.A N ASP 219.A O no hydrogen 2.762 N/A VAL 228.A N PRO 225.A O no hydrogen 2.902 N/A ARG 229.A N VAL 40.A O no hydrogen 2.966 N/A ARG 229.A NE GLY 42.A O no hydrogen 3.165 N/A ARG 229.A NH1 GLY 36.A O no hydrogen 2.669 N/A ARG 229.A NH2 GLY 36.A O no hydrogen 3.376 N/A ARG 229.A NH2 GLY 42.A O no hydrogen 2.424 N/A PHE 230.A N SER 98.A OG no hydrogen 3.255 N/A TRP 232.A N ARG 229.A O no hydrogen 2.909 N/A TRP 232.A NE1 GLY 38.A O no hydrogen 3.071 N/A GLN 236.A N TRP 232.A O no hydrogen 3.026 N/A GLN 236.A NE2 PHE 230.A O no hydrogen 2.564 N/A ALA 237.A N SER 233.A O no hydrogen 3.318 N/A ILE 238.A N THR 234.A O no hydrogen 3.121 N/A LEU 239.A N ALA 235.A O no hydrogen 3.159 N/A GLU 240.A N GLN 236.A O no hydrogen 2.988 N/A GLU 240.A N ALA 237.A O no hydrogen 3.077 N/A LYS 241.A N ILE 238.A O no hydrogen 3.042 N/A GLU 242.A N ILE 238.A O no hydrogen 2.905 N/A GLU 244.A N PRO 220.A O no hydrogen 2.653 N/A