Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i4a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N ALA 2.A O no hydrogen 3.255 N/A THR 7.A N ILE 272.A O no hydrogen 2.626 N/A THR 7.A OG1 HIS 8.A ND1 no hydrogen 2.784 N/A THR 7.A OG1 ILE 272.A O no hydrogen 3.225 N/A THR 7.A OG1 LYS 274.A O no hydrogen 3.471 N/A HIS 8.A N ILE 272.A O no hydrogen 3.033 N/A HIS 8.A ND1 THR 7.A OG1 no hydrogen 2.784 N/A ALA 9.A N GLN 54.A O no hydrogen 2.879 N/A VAL 10.A N VAL 270.A O no hydrogen 2.830 N/A VAL 11.A N VAL 56.A O no hydrogen 2.706 N/A ARG 12.A NE PRO 59.A O no hydrogen 2.581 N/A ARG 12.A NH2 PRO 59.A O no hydrogen 2.898 N/A ALA 13.A N LEU 58.A O no hydrogen 3.005 N/A GLU 16.A N GLU 62.A OE2 no hydrogen 2.878 N/A SER 17.A N GLU 62.A OE1 no hydrogen 2.929 N/A SER 17.A OG GLU 62.A O no hydrogen 2.570 N/A LEU 18.A N PRO 15.A O no hydrogen 3.189 N/A GLY 19.A N GLU 16.A O no hydrogen 3.206 N/A HIS 21.A N SER 17.A O no hydrogen 2.864 N/A ALA 22.A N LEU 18.A O no hydrogen 3.304 N/A LEU 23.A N ASP 66.A OD1 no hydrogen 3.001 N/A ARG 24.A NE ALA 22.A O no hydrogen 2.656 N/A ARG 24.A NH1 GLY 19.A O no hydrogen 3.373 N/A ARG 24.A NH2 LEU 18.A O no hydrogen 3.286 N/A ARG 24.A NH2 ALA 22.A O no hydrogen 2.627 N/A SER 25.A N ASP 262.A OD2 no hydrogen 2.715 N/A SER 25.A OG ASP 262.A OD1 no hydrogen 3.288 N/A SER 25.A OG ASP 262.A OD2 no hydrogen 3.146 N/A ASP 32.A N GLU 257.A OE1 no hydrogen 3.219 N/A ARG 35.A N ASP 32.A OD1 no hydrogen 2.794 N/A ALA 36.A N ASP 32.A O no hydrogen 2.799 N/A GLU 37.A N VAL 33.A O no hydrogen 2.833 N/A GLU 37.A N ALA 34.A O no hydrogen 2.948 N/A ARG 38.A N ALA 34.A O no hydrogen 2.939 N/A GLN 39.A N ARG 35.A O no hydrogen 2.876 N/A HIS 40.A N ALA 36.A O no hydrogen 3.106 N/A GLN 41.A N GLU 37.A O no hydrogen 2.970 N/A LEU 42.A N ARG 38.A O no hydrogen 2.891 N/A TYR 43.A N GLN 39.A O no hydrogen 3.102 N/A TYR 43.A OH LEU 265.A O no hydrogen 2.466 N/A TYR 43.A OH SER 269.A OG no hydrogen 2.822 N/A VAL 44.A N HIS 40.A O no hydrogen 3.047 N/A GLY 45.A N GLN 41.A O no hydrogen 2.972 N/A VAL 46.A N LEU 42.A O no hydrogen 3.105 N/A LEU 47.A N TYR 43.A O no hydrogen 3.440 N/A GLY 48.A N VAL 44.A O no hydrogen 3.009 N/A LYS 50.A N GLY 45.A O no hydrogen 3.204 N/A LEU 51.A N VAL 46.A O no hydrogen 2.962 N/A GLY 52.A N GLY 48.A O no hydrogen 3.271 N/A LEU 53.A N LEU 47.A O no hydrogen 3.131 N/A GLN 54.A N THR 7.A O no hydrogen 2.755 N/A VAL 56.A N ALA 9.A O no hydrogen 2.710 N/A LEU 58.A N VAL 11.A O no hydrogen 2.686 N/A SER 63.A N ASP 61.A OD2 no hydrogen 2.745 N/A SER 63.A OG ASP 61.A OD2 no hydrogen 2.720 N/A CYS 67.A N LEU 64.A O no hydrogen 2.987 N/A CYS 67.A SG ALA 13.A O no hydrogen 3.353 N/A CYS 67.A SG ASP 61.A O no hydrogen 3.794 N/A PHE 69.A N ASP 66.A O no hydrogen 3.139 N/A GLU 71.A N CYS 267.A O no hydrogen 2.949 N/A ASP 72.A N PHE 69.A O no hydrogen 3.314 N/A VAL 73.A N VAL 70.A O no hydrogen 2.928 N/A ALA 74.A N GLU 71.A O no hydrogen 3.321 N/A VAL 75.A N LEU 82.A O no hydrogen 2.792 N/A CYS 77.A N THR 80.A O no hydrogen 2.851 N/A THR 80.A N CYS 77.A O no hydrogen 2.833 N/A ALA 81.A N ASN 108.A O no hydrogen 2.600 N/A LEU 82.A N VAL 75.A O no hydrogen 2.736 N/A ILE 83.A N VAL 110.A O no hydrogen 2.899 N/A THR 84.A N VAL 73.A O no hydrogen 3.129 N/A THR 84.A OG1 ASP 72.A O no hydrogen 2.807 N/A THR 84.A OG1 LEU 119.A O no hydrogen 2.951 N/A ARG 85.A NH1 ALA 117.A O no hydrogen 3.227 N/A GLY 87.A N ASP 120.A OD1 no hydrogen 3.068 N/A ARG 91.A N ALA 88.A O no hydrogen 2.791 N/A ARG 91.A NE GLU 94.A OE2 no hydrogen 3.045 N/A ARG 91.A NH1 ASP 72.A OD2 no hydrogen 3.260 N/A ARG 91.A NH2 PHE 69.A O no hydrogen 2.862 N/A ARG 91.A NH2 GLU 94.A OE1 no hydrogen 3.002 N/A ARG 92.A N PRO 89.A O no hydrogen 3.387 N/A ARG 92.A NE PRO 86.A O no hydrogen 3.152 N/A ARG 92.A NH2 PRO 86.A O no hydrogen 3.100 N/A GLU 94.A N ARG 91.A O no hydrogen 3.365 N/A VAL 95.A N ARG 92.A O no hydrogen 3.278 N/A MET 98.A N GLU 94.A O no hydrogen 3.459 N/A LYS 99.A N VAL 95.A O no hydrogen 2.811 N/A LYS 99.A NZ GLU 103.A OE1 no hydrogen 3.269 N/A GLU 100.A N ASP 96.A O no hydrogen 3.192 N/A ALA 101.A N MET 98.A O no hydrogen 3.047 N/A LEU 102.A N MET 98.A O no hydrogen 2.919 N/A GLU 103.A N LYS 99.A O no hydrogen 3.099 N/A LEU 105.A N LEU 102.A O no hydrogen 3.326 N/A GLN 106.A N GLU 103.A O no hydrogen 3.272 N/A GLN 106.A NE2 LYS 104.A O no hydrogen 3.527 N/A LEU 107.A N LEU 102.A O no hydrogen 3.331 N/A ASN 108.A N GLU 79.A O no hydrogen 2.833 N/A VAL 110.A N ALA 81.A O no hydrogen 2.987 N/A MET 112.A N ILE 83.A O no hydrogen 2.966 N/A ASN 116.A N ASP 114.A OD1 no hydrogen 3.120 N/A ALA 117.A N ASP 114.A O no hydrogen 2.776 N/A THR 118.A N ASN 140.A OD1 no hydrogen 2.912 N/A THR 118.A OG1 ARG 138.A O no hydrogen 2.882 N/A LEU 119.A N ARG 85.A O no hydrogen 3.038 N/A ASP 120.A N THR 139.A OG1 no hydrogen 3.008 N/A GLY 121.A N ASP 72.A O no hydrogen 3.098 N/A GLY 122.A N ASP 72.A OD1 no hydrogen 2.728 N/A ASP 123.A N ASP 120.A O no hydrogen 3.026 N/A VAL 124.A N GLY 121.A O no hydrogen 2.859 N/A LEU 125.A N PHE 132.A O no hydrogen 2.712 N/A THR 127.A N GLU 130.A O no hydrogen 3.199 N/A THR 127.A OG1 TYR 202.A OH no hydrogen 2.522 N/A ARG 129.A N THR 127.A OG1 no hydrogen 3.376 N/A ARG 129.A NE TYR 202.A OH no hydrogen 3.014 N/A GLU 130.A N THR 127.A OG1 no hydrogen 3.284 N/A PHE 131.A N ALA 155.A O no hydrogen 2.835 N/A PHE 132.A N LEU 125.A O no hydrogen 2.694 N/A VAL 133.A N SER 157.A O no hydrogen 2.876 N/A GLY 134.A N ASP 123.A O no hydrogen 2.617 N/A LEU 135.A N VAL 159.A O no hydrogen 2.957 N/A SER 136.A N THR 139.A O no hydrogen 2.974 N/A SER 136.A OG ASP 123.A OD2 no hydrogen 2.817 N/A ARG 138.A N SER 136.A OG no hydrogen 2.902 N/A ARG 138.A NH1 ASP 120.A OD2 no hydrogen 3.123 N/A THR 139.A N SER 136.A OG no hydrogen 3.369 N/A THR 139.A OG1 ASP 123.A OD2 no hydrogen 2.633 N/A ASN 140.A N THR 118.A O no hydrogen 3.041 N/A ASN 140.A ND2 ASN 116.A O no hydrogen 2.675 N/A ARG 142.A NE ASP 114.A OD2 no hydrogen 3.145 N/A ARG 142.A NH1 ASP 114.A OD2 no hydrogen 3.184 N/A ARG 142.A NH2 GLU 145.A OE1 no hydrogen 2.855 N/A GLY 143.A N ASN 140.A OD1 no hydrogen 2.795 N/A ALA 144.A N ASN 140.A O no hydrogen 2.954 N/A GLU 145.A N GLN 141.A O no hydrogen 3.138 N/A ILE 146.A N ARG 142.A O no hydrogen 3.321 N/A LEU 147.A N GLY 143.A O no hydrogen 3.247 N/A ALA 148.A N ALA 144.A O no hydrogen 2.851 N/A ASP 149.A N GLU 145.A O no hydrogen 3.038 N/A ASP 149.A N ILE 146.A O no hydrogen 3.298 N/A THR 150.A N ILE 146.A O no hydrogen 3.050 N/A THR 150.A OG1 ILE 146.A O no hydrogen 2.734 N/A PHE 151.A N LEU 147.A O no hydrogen 3.237 N/A TYR 154.A N PHE 151.A O no hydrogen 2.944 N/A SER 157.A N PHE 131.A O no hydrogen 2.929 N/A VAL 159.A N VAL 133.A O no hydrogen 3.150 N/A VAL 161.A N LEU 135.A O no hydrogen 2.805 N/A HIS 166.A N SER 169.A OG no hydrogen 2.843 N/A HIS 166.A NE2 ASP 120.A OD2 no hydrogen 2.701 N/A LEU 167.A N ASP 123.A OD1 no hydrogen 2.984 N/A LYS 168.A N GLY 122.A O no hydrogen 3.198 N/A LYS 168.A NZ GLU 71.A OE1 no hydrogen 2.743 N/A LYS 168.A NZ VAL 124.A O no hydrogen 2.828 N/A SER 169.A N HIS 166.A O no hydrogen 2.956 N/A SER 169.A OG HIS 166.A O no hydrogen 3.082 N/A CYS 171.A SG LEU 167.A O no hydrogen 3.557 N/A SER 172.A N ALA 180.A O no hydrogen 3.176 N/A SER 172.A OG ALA 213.A O no hydrogen 3.115 N/A SER 172.A OG CYS 215.A O no hydrogen 3.132 N/A ALA 174.A N LEU 178.A O no hydrogen 2.725 N/A LEU 178.A N GLY 175.A O no hydrogen 2.862 N/A ILE 179.A N ASP 203.A O no hydrogen 2.940 N/A ALA 180.A N SER 172.A O no hydrogen 2.479 N/A ILE 181.A N LEU 205.A O no hydrogen 2.783 N/A GLY 182.A N PHE 170.A O no hydrogen 3.083 N/A SER 183.A OG VAL 207.A O no hydrogen 2.994 N/A SER 184.A N ASP 210.A OD1 no hydrogen 3.130 N/A SER 184.A OG ASP 210.A OD1 no hydrogen 3.465 N/A SER 184.A OG ASP 210.A OD2 no hydrogen 2.557 N/A ALA 187.A N SER 184.A OG no hydrogen 3.029 N/A GLN 188.A N SER 184.A O no hydrogen 3.038 N/A LYS 189.A N GLU 185.A O no hydrogen 2.918 N/A ALA 190.A N SER 186.A O no hydrogen 3.155 N/A LEU 191.A N ALA 187.A O no hydrogen 2.935 N/A LYS 192.A N GLN 188.A O no hydrogen 2.962 N/A ILE 193.A N LYS 189.A O no hydrogen 3.077 N/A MET 194.A N ALA 190.A O no hydrogen 3.046 N/A GLN 195.A N LEU 191.A O no hydrogen 2.831 N/A GLN 196.A N LYS 192.A O no hydrogen 3.268 N/A MET 197.A N MET 194.A O no hydrogen 3.294 N/A SER 198.A N GLN 195.A O no hydrogen 3.414 N/A SER 198.A OG GLN 195.A O no hydrogen 3.321 N/A SER 198.A OG HIS 200.A O no hydrogen 2.946 N/A TYR 202.A OH THR 127.A OG1 no hydrogen 2.522 N/A TYR 202.A OH GLU 130.A OE2 no hydrogen 2.740 N/A ASP 203.A N ASN 177.A O no hydrogen 2.791 N/A LEU 205.A N ILE 179.A O no hydrogen 2.918 N/A VAL 207.A N ILE 181.A O no hydrogen 2.817 N/A ASP 209.A N SER 238.A OG no hydrogen 3.333 N/A ALA 212.A N ASP 209.A O no hydrogen 3.202 N/A ALA 213.A N ASP 210.A O no hydrogen 3.069 N/A ASN 214.A N ILE 211.A O no hydrogen 3.237 N/A ASN 214.A ND2 LYS 168.A O no hydrogen 2.924 N/A ASN 214.A ND2 THR 266.A OG1 no hydrogen 2.904 N/A CYS 215.A N SER 172.A OG no hydrogen 3.105 N/A CYS 215.A SG SER 172.A OG no hydrogen 3.537 N/A CYS 215.A SG MET 173.A O no hydrogen 3.514 N/A ILE 216.A N LEU 228.A O no hydrogen 2.972 N/A TYR 217.A OH HIS 225.A ND1 no hydrogen 2.564 N/A LEU 218.A N VAL 226.A O no hydrogen 2.901 N/A ASN 219.A N GLY 4.A O no hydrogen 2.873 N/A LYS 223.A N ILE 220.A O no hydrogen 3.211 N/A LYS 223.A NZ LEU 51.A O no hydrogen 3.567 N/A GLY 224.A N ILE 220.A O no hydrogen 3.019 N/A VAL 226.A N LEU 218.A O no hydrogen 2.829 N/A LEU 227.A N MET 249.A O no hydrogen 3.409 N/A LEU 228.A N ILE 216.A O no hydrogen 2.797 N/A HIS 229.A N ILE 251.A O no hydrogen 2.879 N/A ARG 230.A NE GLU 234.A OE1 no hydrogen 2.777 N/A ARG 230.A NE GLU 234.A OE2 no hydrogen 3.428 N/A ARG 230.A NH2 GLU 234.A OE2 no hydrogen 2.774 N/A ARG 230.A NH2 GLU 259.A OE1 no hydrogen 2.991 N/A THR 231.A N GLU 234.A OE1 no hydrogen 3.217 N/A GLU 234.A N THR 231.A O no hydrogen 3.007 N/A GLU 234.A N THR 231.A OG1 no hydrogen 3.279 N/A TYR 235.A N THR 231.A O no hydrogen 2.983 N/A TYR 235.A OH GLU 259.A OE1 no hydrogen 2.961 N/A SER 238.A N TYR 235.A O no hydrogen 3.230 N/A SER 238.A OG ASP 209.A OD1 no hydrogen 2.581 N/A ALA 239.A N TYR 235.A O no hydrogen 3.067 N/A LYS 240.A N PRO 236.A O no hydrogen 3.097 N/A LYS 240.A NZ GLU 237.A OE2 no hydrogen 2.888 N/A VAL 241.A N SER 238.A O no hydrogen 3.238 N/A TYR 242.A N SER 238.A O no hydrogen 3.430 N/A TYR 242.A OH ALA 212.A O no hydrogen 2.675 N/A GLU 243.A N ALA 239.A O no hydrogen 2.968 N/A LYS 244.A N VAL 241.A O no hydrogen 3.193 N/A LEU 245.A N TYR 242.A O no hydrogen 2.815 N/A HIS 248.A NE2 ALA 174.A O no hydrogen 2.850 N/A MET 249.A N HIS 225.A O no hydrogen 2.767 N/A LEU 250.A N HIS 248.A O no hydrogen 3.010 N/A ILE 251.A N LEU 227.A O no hydrogen 2.836 N/A VAL 253.A N HIS 229.A O no hydrogen 2.687 N/A SER 254.A OG GLU 234.A OE2 no hydrogen 3.001 N/A MET 255.A N GLU 234.A OE2 no hydrogen 2.780 N/A SER 256.A OG GLU 234.A OE2 no hydrogen 2.583 N/A GLU 257.A N GLN 39.A OE1 no hydrogen 3.044 N/A GLU 259.A N MET 255.A O no hydrogen 2.890 N/A LYS 260.A N GLU 257.A O no hydrogen 2.912 N/A LYS 260.A NZ GLU 30.A O no hydrogen 2.695 N/A LYS 260.A NZ GLU 257.A OE1 no hydrogen 2.524 N/A LYS 260.A NZ GLU 257.A OE2 no hydrogen 3.446 N/A VAL 261.A N LEU 258.A O no hydrogen 2.854 N/A ASP 262.A N GLU 259.A O no hydrogen 2.640 N/A GLY 263.A N LEU 258.A O no hydrogen 2.920 N/A THR 266.A N ASN 214.A OD1 no hydrogen 3.053 N/A THR 266.A OG1 GLU 71.A OE2 no hydrogen 2.883 N/A CYS 268.A N LEU 265.A O no hydrogen 3.502 N/A CYS 268.A SG LEU 264.A O no hydrogen 3.707 N/A SER 269.A N THR 266.A O no hydrogen 3.495 N/A SER 269.A OG TYR 43.A OH no hydrogen 2.822 N/A VAL 270.A N VAL 10.A O no hydrogen 3.073 N/A ILE 272.A N HIS 8.A O no hydrogen 2.946 N/A LYS 274.A N THR 7.A OG1 no hydrogen 2.589 N/A LYS 274.A NZ LEU 105.A O no hydrogen 2.706 N/A