Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1b54_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 2.A N GLN 49.A OE1 no hydrogen 3.235 N/A TYR 4.A OH ASP 53.A OD2 no hydrogen 2.624 N/A ARG 8.A N ASP 5.A OD2 no hydrogen 3.021 N/A ARG 8.A NE ASP 47.A OD1 no hydrogen 3.221 N/A ARG 8.A NH2 ASP 47.A OD2 no hydrogen 2.786 N/A ARG 8.A NH2 PHE 229.A O no hydrogen 3.076 N/A LYS 9.A N ASP 5.A O no hydrogen 3.157 N/A THR 10.A N GLU 6.A O no hydrogen 3.197 N/A THR 10.A OG1 GLU 6.A O no hydrogen 3.076 N/A GLN 11.A N ASP 7.A O no hydrogen 3.230 N/A GLN 11.A NE2 GLN 15.A OE1 no hydrogen 2.889 N/A LEU 12.A N ARG 8.A O no hydrogen 2.833 N/A ILE 13.A N LYS 9.A O no hydrogen 3.052 N/A ALA 14.A N THR 10.A O no hydrogen 3.266 N/A GLN 15.A N GLN 11.A O no hydrogen 3.057 N/A GLN 15.A NE2 ILE 228.A O no hydrogen 3.124 N/A TYR 16.A N LEU 12.A O no hydrogen 2.936 N/A GLU 17.A N ILE 13.A O no hydrogen 2.937 N/A SER 18.A N ALA 14.A O no hydrogen 3.091 N/A SER 18.A OG ALA 14.A O no hydrogen 3.429 N/A SER 18.A OG GLN 15.A O no hydrogen 2.653 N/A VAL 19.A N GLN 15.A O no hydrogen 3.219 N/A ARG 20.A N TYR 16.A O no hydrogen 2.899 N/A ARG 20.A NE GLU 17.A OE1 no hydrogen 3.204 N/A ARG 20.A NH2 GLU 17.A OE1 no hydrogen 3.124 N/A GLU 21.A N GLU 17.A O no hydrogen 2.835 N/A VAL 22.A N SER 18.A O no hydrogen 3.339 N/A VAL 23.A N VAL 19.A O no hydrogen 3.062 N/A ASN 24.A N ARG 20.A O no hydrogen 3.117 N/A ALA 25.A N GLU 21.A O no hydrogen 2.917 N/A GLU 26.A N VAL 22.A O no hydrogen 2.902 N/A ALA 27.A N VAL 23.A O no hydrogen 3.018 N/A LYS 28.A N ASN 24.A O no hydrogen 2.920 N/A ASN 29.A N GLU 26.A O no hydrogen 3.131 N/A VAL 30.A N ALA 27.A O no hydrogen 3.084 N/A LEU 35.A N ALA 220.A O no hydrogen 3.033 N/A LEU 37.A N VAL 222.A O no hydrogen 2.905 N/A VAL 38.A N GLU 58.A O no hydrogen 3.269 N/A VAL 39.A N ILE 224.A O no hydrogen 3.137 N/A SER 40.A N GLY 60.A O no hydrogen 3.015 N/A SER 40.A OG GLU 61.A OE2 no hydrogen 2.658 N/A LYS 41.A NZ ASN 62.A OD1 no hydrogen 3.335 N/A LEU 42.A N GLU 66.A OE2 no hydrogen 2.897 N/A LYS 43.A N SER 40.A O no hydrogen 2.791 N/A ASP 47.A N PRO 44.A O no hydrogen 3.060 N/A GLN 49.A N ALA 45.A O no hydrogen 3.011 N/A GLN 49.A NE2 ASP 53.A OD1 no hydrogen 2.837 N/A ILE 50.A N SER 46.A O no hydrogen 2.911 N/A LEU 51.A N ASP 47.A O no hydrogen 3.127 N/A TYR 52.A N ILE 48.A O no hydrogen 2.573 N/A TYR 52.A OH ASP 77.A OD1 no hydrogen 2.719 N/A TYR 52.A OH ASP 77.A OD2 no hydrogen 2.979 N/A ASP 53.A N GLN 49.A O no hydrogen 2.818 N/A HIS 54.A N ILE 50.A O no hydrogen 3.146 N/A HIS 54.A NE2 GLU 17.A OE2 no hydrogen 2.535 N/A GLY 55.A N TYR 52.A O no hydrogen 2.608 N/A VAL 56.A N LEU 51.A O no hydrogen 3.128 N/A ARG 57.A NH1 TYR 52.A O no hydrogen 2.928 N/A ARG 57.A NH1 VAL 56.A O no hydrogen 2.803 N/A GLY 60.A N VAL 38.A O no hydrogen 2.667 N/A GLU 61.A N HIS 81.A O no hydrogen 2.960 N/A LEU 67.A N TYR 63.A O no hydrogen 2.923 N/A ILE 68.A N VAL 64.A O no hydrogen 3.071 N/A GLU 69.A N GLN 65.A O no hydrogen 2.936 N/A LYS 70.A N GLU 66.A O no hydrogen 2.842 N/A LYS 70.A NZ SER 40.A O no hydrogen 3.176 N/A LYS 70.A NZ LYS 43.A O no hydrogen 2.724 N/A LYS 70.A NZ GLU 61.A OE1 no hydrogen 3.424 N/A LYS 70.A NZ GLU 61.A OE2 no hydrogen 2.891 N/A LYS 70.A NZ GLU 66.A OE2 no hydrogen 2.623 N/A ALA 71.A N LEU 67.A O no hydrogen 2.771 N/A LYS 72.A N ILE 68.A O no hydrogen 3.274 N/A LYS 72.A NZ GLU 69.A OE2 no hydrogen 3.031 N/A LEU 73.A N LYS 70.A O no hydrogen 3.197 N/A LEU 74.A N LYS 70.A O no hydrogen 3.193 N/A ILE 78.A N PRO 75.A O no hydrogen 3.460 N/A LYS 79.A N ARG 57.A O no hydrogen 2.645 N/A TRP 80.A N ASN 99.A O no hydrogen 3.356 N/A HIS 81.A N PHE 59.A O no hydrogen 3.062 N/A HIS 81.A ND1 GLU 104.A OE2 no hydrogen 2.891 N/A HIS 81.A NE2 GLU 58.A OE1 no hydrogen 2.479 N/A PHE 82.A N SER 102.A O no hydrogen 2.823 N/A ILE 83.A N GLU 61.A O no hydrogen 2.857 N/A LYS 90.A N GLN 87.A O no hydrogen 3.056 N/A CYS 91.A SG GLN 87.A O no hydrogen 3.999 N/A CYS 91.A SG LYS 111.A O no hydrogen 3.879 N/A LEU 94.A N LYS 90.A O no hydrogen 2.994 N/A ALA 95.A N CYS 91.A O no hydrogen 2.840 N/A LYS 96.A N ASP 93.A O no hydrogen 3.334 N/A VAL 97.A N LEU 94.A O no hydrogen 3.058 N/A ASN 99.A ND2 ILE 78.A O no hydrogen 3.302 N/A LEU 100.A N VAL 97.A O no hydrogen 3.279 N/A SER 102.A N TRP 80.A O no hydrogen 2.977 N/A VAL 103.A N LEU 130.A O no hydrogen 2.918 N/A GLU 104.A N PHE 82.A O no hydrogen 3.089 N/A THR 105.A OG1 GLY 84.A O no hydrogen 2.650 N/A ILE 106.A N ASN 132.A O no hydrogen 3.343 N/A LYS 111.A N SER 108.A OG no hydrogen 3.019 N/A LYS 111.A NZ LEU 86.A O no hydrogen 2.638 N/A LYS 111.A NZ ASP 107.A OD1 no hydrogen 2.865 N/A ALA 112.A N SER 108.A O no hydrogen 3.274 N/A LYS 113.A N LEU 109.A O no hydrogen 2.962 N/A LYS 114.A N LYS 110.A O no hydrogen 3.078 N/A LEU 115.A N LYS 111.A O no hydrogen 2.940 N/A ASN 116.A N ALA 112.A O no hydrogen 3.047 N/A ASN 116.A ND2 GLU 163.A O no hydrogen 3.208 N/A GLU 117.A N LYS 113.A O no hydrogen 2.825 N/A SER 118.A N LYS 114.A O no hydrogen 2.780 N/A SER 118.A OG LYS 114.A O no hydrogen 2.867 N/A ARG 119.A N LEU 115.A O no hydrogen 2.825 N/A ARG 119.A NH1 ALA 95.A O no hydrogen 2.765 N/A ARG 119.A NH1 VAL 97.A O no hydrogen 2.787 N/A ARG 119.A NH2 PRO 98.A O no hydrogen 2.965 N/A ARG 119.A NH2 ASN 127.A O no hydrogen 3.394 N/A ALA 120.A N ASN 116.A O no hydrogen 3.132 N/A ALA 120.A N GLU 117.A O no hydrogen 3.239 N/A LYS 121.A N GLU 117.A O no hydrogen 3.305 N/A LYS 121.A NZ SER 118.A OG no hydrogen 2.877 N/A PHE 122.A N SER 118.A O no hydrogen 2.974 N/A GLN 123.A N ARG 119.A O no hydrogen 2.808 N/A GLN 123.A NE2 LYS 96.A O no hydrogen 2.988 N/A CYS 126.A SG PRO 98.A O no hydrogen 3.941 N/A CYS 126.A SG GLN 123.A OE1 no hydrogen 3.041 N/A ILE 129.A N TYR 166.A O no hydrogen 2.983 N/A LEU 130.A N TYR 101.A O no hydrogen 3.029 N/A CYS 131.A N LYS 168.A O no hydrogen 2.591 N/A CYS 131.A SG ILE 129.A O no hydrogen 3.826 N/A ASN 132.A N VAL 103.A O no hydrogen 2.987 N/A ASN 132.A ND2 ASN 170.A OD1 no hydrogen 3.331 N/A VAL 133.A N GLY 171.A O no hydrogen 2.829 N/A GLN 134.A N ILE 106.A O no hydrogen 2.886 N/A ILE 135.A N MET 173.A O no hydrogen 2.808 N/A ASN 136.A N LEU 146.A O no hydrogen 2.828 N/A ASN 136.A ND2 GLU 140.A O no hydrogen 3.296 N/A THR 137.A OG1 THR 174.A OG1 no hydrogen 2.571 N/A THR 137.A OG1 ASP 182.A OD1 no hydrogen 3.090 N/A SER 138.A N ASN 136.A OD1 no hydrogen 3.095 N/A SER 138.A OG ASN 136.A OD1 no hydrogen 2.578 N/A SER 138.A OG GLU 140.A O no hydrogen 3.335 N/A GLU 140.A N SER 138.A OG no hydrogen 3.368 N/A GLY 145.A N ASP 107.A OD2 no hydrogen 3.232 N/A LEU 146.A N GLN 134.A O no hydrogen 3.032 N/A ILE 152.A N ASN 148.A O no hydrogen 2.839 N/A PHE 153.A N GLU 149.A O no hydrogen 2.741 N/A GLU 154.A N ALA 150.A O no hydrogen 2.972 N/A VAL 155.A N GLU 151.A O no hydrogen 3.136 N/A VAL 155.A N ILE 152.A O no hydrogen 3.081 N/A ILE 156.A N ILE 152.A O no hydrogen 3.104 N/A ASP 157.A N PHE 153.A O no hydrogen 2.915 N/A PHE 158.A N GLU 154.A O no hydrogen 3.346 N/A PHE 159.A N VAL 155.A O no hydrogen 3.267 N/A LEU 160.A N ILE 156.A O no hydrogen 3.154 N/A SER 161.A N PHE 158.A O no hydrogen 2.944 N/A SER 161.A OG PHE 158.A O no hydrogen 2.735 N/A CYS 164.A N SER 161.A O no hydrogen 3.333 N/A CYS 164.A SG PHE 159.A O no hydrogen 3.934 N/A CYS 164.A SG ILE 167.A O no hydrogen 3.375 N/A LYS 165.A N GLU 163.A O no hydrogen 3.079 N/A TYR 166.A N ASN 116.A OD1 no hydrogen 2.751 N/A LYS 168.A N ILE 129.A O no hydrogen 2.703 N/A ASN 170.A N CYS 131.A O no hydrogen 2.602 N/A GLY 171.A N CYS 131.A O no hydrogen 3.337 N/A LEU 172.A N LYS 202.A O no hydrogen 2.759 N/A MET 173.A N VAL 133.A O no hydrogen 2.824 N/A THR 174.A N SER 204.A O no hydrogen 3.334 N/A THR 174.A OG1 ILE 135.A O no hydrogen 3.218 N/A THR 174.A OG1 THR 137.A OG1 no hydrogen 2.571 N/A GLY 176.A N THR 174.A OG1 no hydrogen 3.130 N/A ASN 180.A N GLU 213.A OE1 no hydrogen 2.942 N/A ALA 184.A N ASN 180.A O no hydrogen 3.114 N/A THR 185.A N ARG 181.A O no hydrogen 2.935 N/A THR 185.A OG1 ARG 181.A O no hydrogen 2.903 N/A LEU 186.A N ASP 182.A O no hydrogen 3.093 N/A VAL 187.A N PHE 183.A O no hydrogen 2.927 N/A GLU 188.A N ALA 184.A O no hydrogen 3.086 N/A TRP 189.A N THR 185.A O no hydrogen 3.075 N/A LYS 190.A N LEU 186.A O no hydrogen 3.043 N/A LYS 190.A NZ ASP 194.A OD2 no hydrogen 2.884 N/A LYS 190.A NZ LEU 201.A O no hydrogen 2.562 N/A LYS 191.A N VAL 187.A O no hydrogen 3.369 N/A LYS 192.A N GLU 188.A O no hydrogen 3.120 N/A LYS 192.A NZ GLU 149.A OE1 no hydrogen 2.488 N/A ILE 193.A N TRP 189.A O no hydrogen 3.067 N/A ASP 194.A N LYS 190.A O no hydrogen 2.831 N/A ALA 195.A N LYS 191.A O no hydrogen 2.964 N/A LYS 196.A N LYS 192.A O no hydrogen 3.196 N/A PHE 197.A N ILE 193.A O no hydrogen 2.804 N/A GLY 198.A N ASP 194.A O no hydrogen 2.870 N/A THR 199.A OG1 ASP 194.A OD1 no hydrogen 2.684 N/A LEU 201.A N ASP 194.A OD1 no hydrogen 3.014 N/A LYS 202.A N ASN 170.A O no hydrogen 3.036 N/A SER 204.A N LEU 172.A O no hydrogen 2.863 N/A SER 204.A OG GLU 104.A OE1 no hydrogen 2.598 N/A MET 205.A N THR 219.A OG1 no hydrogen 3.238 N/A MET 205.A N GLU 221.A O no hydrogen 2.994 N/A MET 207.A N ASP 210.A OD1 no hydrogen 2.886 N/A SER 208.A OG ASP 227.A OD1 no hydrogen 2.746 N/A ASP 210.A N MET 207.A O no hydrogen 3.186 N/A ALA 214.A N ASP 210.A O no hydrogen 3.111 N/A ILE 215.A N PHE 211.A O no hydrogen 2.893 N/A ARG 216.A N ARG 212.A O no hydrogen 3.080 N/A ARG 216.A NE GLU 26.A OE1 no hydrogen 3.247 N/A ARG 216.A NH2 GLU 26.A OE2 no hydrogen 2.994 N/A GLN 217.A N GLU 213.A O no hydrogen 2.823 N/A GLN 217.A N ALA 214.A O no hydrogen 3.108 N/A THR 219.A N ALA 214.A O no hydrogen 3.065 N/A THR 219.A OG1 LEU 203.A O no hydrogen 3.477 N/A THR 219.A OG1 MET 205.A O no hydrogen 2.847 N/A THR 219.A OG1 GLU 221.A O no hydrogen 2.948 N/A ALA 220.A N LEU 203.A O no hydrogen 2.900 N/A GLU 221.A N THR 219.A OG1 no hydrogen 3.355 N/A VAL 222.A N LEU 35.A O no hydrogen 2.963 N/A ARG 223.A N GLY 206.A O no hydrogen 2.768 N/A ARG 223.A NH1 SER 204.A O no hydrogen 3.033 N/A ARG 223.A NH1 SER 204.A OG no hydrogen 3.026 N/A ARG 223.A NH2 THR 174.A O no hydrogen 3.031 N/A ILE 224.A N LEU 37.A O no hydrogen 3.094 N/A ILE 228.A N GLY 225.A O no hydrogen 2.835 N/A PHE 229.A N GLY 225.A O no hydrogen 2.976 N/A GLY 230.A N THR 226.A O no hydrogen 3.237 N/A