Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hcc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N VAL 1.A O no hydrogen 2.992 N/A TYR 5.A OH ALA 164.A O no hydrogen 2.549 N/A TYR 5.A OH TYR 200.A OH no hydrogen 2.968 N/A GLN 6.A N SER 3.A O no hydrogen 3.247 N/A ARG 7.A N ALA 4.A O no hydrogen 3.127 N/A GLU 9.A N ALA 202.A O no hydrogen 3.017 N/A ARG 11.A NH1 GLY 97.A O no hydrogen 2.913 N/A ARG 11.A NH2 GLY 97.A O no hydrogen 3.336 N/A TYR 13.A N GLU 9.A O no hydrogen 2.959 N/A LEU 14.A N PRO 10.A O no hydrogen 2.837 N/A ARG 15.A N ARG 11.A O no hydrogen 2.978 N/A ASN 16.A N ALA 12.A O no hydrogen 2.951 N/A ASN 16.A ND2 LEU 201.A O no hydrogen 3.287 N/A ASN 17.A N TYR 13.A O no hydrogen 3.159 N/A ASN 17.A ND2 TYR 13.A O no hydrogen 3.188 N/A TYR 18.A N LEU 14.A O no hydrogen 2.826 N/A TYR 18.A OH TYR 63.A OH no hydrogen 3.105 N/A ARG 22.A NE LEU 240.A O no hydrogen 3.126 N/A ARG 22.A NH1 ASN 17.A OD1 no hydrogen 3.080 N/A ARG 22.A NH1 ASP 245.A OD2 no hydrogen 2.878 N/A ARG 22.A NH2 LEU 240.A O no hydrogen 2.958 N/A ARG 22.A NH2 ASP 245.A OD1 no hydrogen 3.149 N/A ARG 22.A NH2 ASP 245.A OD2 no hydrogen 3.404 N/A GLY 23.A N ALA 19.A O no hydrogen 2.833 N/A ASP 24.A N PRO 21.A O no hydrogen 3.139 N/A CYS 26.A N ASP 24.A OD2 no hydrogen 3.204 N/A GLY 30.A N ASN 27.A O no hydrogen 3.098 N/A TRP 34.A N GLY 30.A O no hydrogen 3.312 N/A LYS 35.A N VAL 31.A O no hydrogen 3.066 N/A LYS 35.A NZ TYR 63.A OH no hydrogen 3.111 N/A LEU 36.A N GLY 32.A O no hydrogen 3.110 N/A ARG 37.A N PRO 33.A O no hydrogen 2.834 N/A ARG 37.A NH1 PRO 28.A O no hydrogen 3.330 N/A ARG 37.A NH2 PRO 28.A O no hydrogen 3.434 N/A CYS 38.A N TRP 34.A O no hydrogen 2.980 N/A CYS 38.A SG TRP 34.A O no hydrogen 3.439 N/A LEU 39.A N LYS 35.A O no hydrogen 3.101 N/A ALA 40.A N LEU 36.A O no hydrogen 2.823 N/A GLN 41.A N ARG 37.A O no hydrogen 2.882 N/A THR 42.A N CYS 38.A O no hydrogen 3.082 N/A THR 42.A OG1 CYS 38.A O no hydrogen 2.854 N/A PHE 43.A N LEU 39.A O no hydrogen 3.199 N/A ALA 44.A N ALA 40.A O no hydrogen 2.975 N/A THR 45.A N THR 42.A O no hydrogen 3.123 N/A THR 45.A OG1 THR 42.A O no hydrogen 2.803 N/A GLY 46.A N PHE 43.A O no hydrogen 3.144 N/A GLU 47.A N THR 45.A OG1 no hydrogen 2.971 N/A ARG 51.A N ASP 154.A OD1 no hydrogen 2.864 N/A ARG 51.A NH1 GLU 73.A OE2 no hydrogen 3.331 N/A THR 52.A N ASP 154.A OD1 no hydrogen 3.422 N/A LEU 53.A N ASP 74.A O no hydrogen 2.870 N/A ILE 54.A N ALA 155.A O no hydrogen 3.055 N/A ASP 55.A N THR 76.A O no hydrogen 2.848 N/A ILE 56.A N VAL 157.A O no hydrogen 2.698 N/A GLY 57.A N THR 78.A OG1 no hydrogen 3.129 N/A SER 58.A N THR 78.A O no hydrogen 2.682 N/A SER 58.A OG ASP 55.A O no hydrogen 3.396 N/A SER 58.A OG ASP 55.A OD2 no hydrogen 2.658 N/A SER 58.A OG THR 78.A O no hydrogen 3.167 N/A GLY 59.A N ASP 79.A OD1 no hydrogen 3.074 N/A THR 61.A N SER 58.A O no hydrogen 3.400 N/A THR 61.A OG1 SER 58.A O no hydrogen 3.185 N/A THR 61.A OG1 GLN 64.A OE1 no hydrogen 2.728 N/A TYR 63.A OH TYR 18.A OH no hydrogen 3.105 N/A GLN 64.A N GLN 64.A OE1 no hydrogen 2.676 N/A GLN 64.A NE2 ASP 55.A OD2 no hydrogen 2.813 N/A GLN 64.A NE2 SER 58.A O no hydrogen 3.406 N/A GLN 64.A NE2 THR 61.A O no hydrogen 3.002 N/A LEU 65.A N VAL 62.A O no hydrogen 2.983 N/A LEU 66.A N TYR 63.A O no hydrogen 3.343 N/A SER 67.A OG GLU 112.A OE2 no hydrogen 2.629 N/A CYS 69.A N LEU 65.A O no hydrogen 2.814 N/A CYS 69.A SG LEU 66.A O no hydrogen 3.401 N/A CYS 69.A SG GLN 124.A OE1 no hydrogen 3.981 N/A SER 70.A OG HIS 71.A ND1 no hydrogen 3.113 N/A HIS 71.A N ALA 68.A O no hydrogen 2.843 N/A ASP 74.A N ARG 51.A O no hydrogen 2.907 N/A ILE 75.A N ARG 128.A O no hydrogen 2.871 N/A THR 76.A N LEU 53.A O no hydrogen 2.916 N/A MET 77.A N ARG 131.A O no hydrogen 3.023 N/A THR 78.A N SER 58.A OG no hydrogen 3.196 N/A THR 78.A OG1 ASP 55.A O no hydrogen 2.704 N/A ASP 79.A N LEU 133.A O no hydrogen 3.093 N/A LEU 81.A N ASP 79.A OD2 no hydrogen 3.183 N/A ASN 84.A N LEU 81.A O no hydrogen 3.212 N/A ASN 84.A ND2 ASP 79.A OD2 no hydrogen 2.665 N/A ARG 85.A N LEU 81.A O no hydrogen 3.205 N/A ARG 85.A NH1 ASP 79.A O no hydrogen 2.755 N/A ARG 85.A NH2 GLU 82.A OE1 no hydrogen 3.366 N/A GLN 86.A N GLU 82.A O no hydrogen 2.839 N/A GLU 87.A N VAL 83.A O no hydrogen 3.104 N/A LEU 88.A N ASN 84.A O no hydrogen 2.878 N/A GLY 89.A N ARG 85.A O no hydrogen 2.987 N/A ARG 90.A N GLN 86.A O no hydrogen 3.009 N/A ARG 90.A NH2 GLU 87.A OE1 no hydrogen 3.133 N/A TRP 91.A N LEU 88.A O no hydrogen 3.201 N/A LEU 92.A N LEU 88.A O no hydrogen 3.024 N/A GLN 93.A N GLY 89.A O no hydrogen 3.089 N/A GLU 94.A N TRP 91.A O no hydrogen 3.186 N/A GLU 95.A N ARG 90.A O no hydrogen 2.798 N/A SER 102.A N ASN 100.A OD1 no hydrogen 3.087 N/A SER 102.A OG ASN 100.A OD1 no hydrogen 2.897 N/A SER 105.A N TRP 101.A O no hydrogen 2.951 N/A SER 105.A OG TRP 101.A O no hydrogen 3.315 N/A SER 105.A OG GLU 122.A OE2 no hydrogen 2.857 N/A GLN 106.A N SER 102.A O no hydrogen 2.785 N/A HIS 107.A N MET 103.A O no hydrogen 2.879 N/A ALA 108.A N TYR 104.A O no hydrogen 2.859 N/A CYS 109.A N SER 105.A O no hydrogen 3.118 N/A CYS 109.A SG SER 105.A O no hydrogen 3.434 N/A LEU 110.A N GLN 106.A O no hydrogen 2.947 N/A ILE 111.A N HIS 107.A O no hydrogen 2.708 N/A GLU 112.A N ALA 108.A O no hydrogen 2.760 N/A GLY 113.A N CYS 109.A O no hydrogen 3.006 N/A GLY 113.A N LEU 110.A O no hydrogen 3.215 N/A CYS 117.A SG GLN 119.A OE1 no hydrogen 3.649 N/A GLN 119.A N GLN 119.A OE1 no hydrogen 2.814 N/A ASP 120.A N CYS 117.A O no hydrogen 3.239 N/A LYS 121.A N CYS 117.A O no hydrogen 3.305 N/A LYS 121.A NZ LEU 66.A O no hydrogen 3.071 N/A LYS 121.A NZ GLU 112.A OE1 no hydrogen 2.697 N/A LYS 121.A NZ GLU 112.A OE2 no hydrogen 3.041 N/A GLU 122.A N TRP 118.A O no hydrogen 2.998 N/A ARG 123.A N GLN 119.A O no hydrogen 2.968 N/A ARG 123.A NH2 ASP 120.A OD1 no hydrogen 3.119 N/A GLN 124.A N ASP 120.A O no hydrogen 2.948 N/A LEU 125.A N LYS 121.A O no hydrogen 3.095 N/A ARG 126.A N GLU 122.A O no hydrogen 3.029 N/A ARG 126.A NE TRP 91.A O no hydrogen 2.667 N/A ARG 126.A NH1 GLU 122.A OE1 no hydrogen 3.243 N/A ARG 126.A NH2 TRP 91.A O no hydrogen 2.926 N/A ALA 127.A N ARG 123.A O no hydrogen 3.078 N/A ARG 128.A N GLN 124.A O no hydrogen 2.919 N/A ARG 128.A NH1 CYS 69.A O no hydrogen 3.191 N/A VAL 129.A N LEU 125.A O no hydrogen 2.967 N/A LYS 130.A N ILE 75.A O no hydrogen 2.906 N/A LYS 130.A NZ ALA 127.A O no hydrogen 2.805 N/A ARG 131.A NH1 ASP 74.A OD2 no hydrogen 2.954 N/A ARG 131.A NH1 THR 76.A OG1 no hydrogen 2.658 N/A ARG 131.A NH2 ASP 74.A OD1 no hydrogen 3.001 N/A LEU 133.A N MET 77.A O no hydrogen 2.776 N/A ILE 135.A N ASP 79.A O no hydrogen 3.292 N/A ASP 136.A N PRO 142.A O no hydrogen 2.995 N/A HIS 138.A N ASP 136.A OD1 no hydrogen 2.711 N/A GLN 139.A N ASP 136.A O no hydrogen 3.136 N/A ALA 153.A N LEU 182.A O no hydrogen 2.862 N/A ASP 154.A N THR 52.A O no hydrogen 3.130 N/A LEU 156.A N HIS 188.A O no hydrogen 2.661 N/A VAL 157.A N ILE 54.A O no hydrogen 2.935 N/A SER 158.A N LEU 190.A O no hydrogen 3.053 N/A SER 158.A OG ILE 56.A O no hydrogen 2.694 N/A PHE 160.A N ILE 192.A O no hydrogen 2.683 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.832 N/A ALA 164.A N CYS 161.A O no hydrogen 3.033 N/A VAL 165.A N LEU 162.A O no hydrogen 2.943 N/A SER 166.A OG LEU 162.A O no hydrogen 3.195 N/A SER 171.A N ASP 168.A O no hydrogen 3.223 N/A SER 171.A N ASP 168.A OD1 no hydrogen 2.963 N/A SER 171.A OG ASP 168.A OD1 no hydrogen 2.548 N/A PHE 172.A N ASP 168.A O no hydrogen 3.125 N/A GLN 173.A N LEU 169.A O no hydrogen 2.954 N/A GLN 173.A NE2 GLN 173.A O no hydrogen 3.599 N/A GLN 173.A NE2 ALA 220.A O no hydrogen 3.035 N/A ARG 174.A N ALA 170.A O no hydrogen 3.196 N/A ALA 175.A N SER 171.A O no hydrogen 2.864 N/A LEU 176.A N PHE 172.A O no hydrogen 2.959 N/A ASP 177.A N GLN 173.A O no hydrogen 2.818 N/A HIS 178.A N ARG 174.A O no hydrogen 2.696 N/A HIS 178.A ND1 VAL 137.A O no hydrogen 2.515 N/A ILE 179.A N ALA 175.A O no hydrogen 3.060 N/A THR 180.A N LEU 176.A O no hydrogen 2.935 N/A THR 180.A OG1 LEU 176.A O no hydrogen 2.581 N/A THR 180.A OG1 TYR 226.A OH no hydrogen 2.912 N/A THR 181.A N HIS 178.A O no hydrogen 2.910 N/A THR 181.A OG1 HIS 178.A O no hydrogen 2.619 N/A LEU 182.A N ILE 179.A O no hydrogen 2.979 N/A LEU 183.A N THR 180.A O no hydrogen 2.966 N/A ARG 184.A N ALA 153.A O no hydrogen 3.072 N/A ARG 184.A NE PRO 185.A O no hydrogen 2.673 N/A ARG 184.A NH2 PRO 185.A O no hydrogen 3.546 N/A GLY 186.A N LYS 257.A O no hydrogen 2.759 N/A GLY 187.A N ARG 184.A O no hydrogen 2.797 N/A HIS 188.A N ASP 154.A O no hydrogen 3.392 N/A LEU 189.A N ALA 255.A O no hydrogen 2.739 N/A LEU 190.A N LEU 156.A O no hydrogen 2.815 N/A LEU 191.A N ALA 253.A O no hydrogen 2.924 N/A ILE 192.A N SER 158.A O no hydrogen 2.849 N/A GLY 193.A N PHE 251.A O no hydrogen 3.251 N/A ALA 194.A N GLU 163.A OE2 no hydrogen 2.775 N/A LEU 195.A N GLY 249.A O no hydrogen 2.793 N/A GLU 196.A N VAL 212.A O no hydrogen 2.787 N/A SER 198.A N ASP 246.A OD2 no hydrogen 3.000 N/A SER 198.A OG ASP 246.A OD1 no hydrogen 2.749 N/A TRP 199.A N ASP 246.A OD2 no hydrogen 3.360 N/A TYR 200.A N LEU 207.A O no hydrogen 3.133 N/A TYR 200.A OH TYR 5.A OH no hydrogen 2.968 N/A LEU 201.A N VAL 244.A O no hydrogen 2.761 N/A ALA 202.A N ALA 205.A O no hydrogen 3.113 N/A GLU 204.A N GLU 9.A OE2 no hydrogen 2.906 N/A LEU 207.A N TYR 200.A O no hydrogen 2.985 N/A VAL 209.A N SER 198.A O no hydrogen 2.501 N/A VAL 210.A N GLU 163.A O no hydrogen 3.053 N/A SER 213.A N GLU 216.A OE2 no hydrogen 2.931 N/A SER 213.A OG GLU 216.A OE2 no hydrogen 3.434 N/A GLU 216.A N SER 213.A OG no hydrogen 3.151 N/A VAL 217.A N SER 213.A O no hydrogen 2.857 N/A ARG 218.A N GLU 214.A O no hydrogen 2.899 N/A GLU 219.A N GLU 215.A O no hydrogen 2.945 N/A ALA 220.A N GLU 216.A O no hydrogen 2.971 N/A LEU 221.A N VAL 217.A O no hydrogen 3.052 N/A VAL 222.A N ARG 218.A O no hydrogen 3.002 N/A ARG 223.A N GLU 219.A O no hydrogen 3.023 N/A SER 224.A N ALA 220.A O no hydrogen 3.143 N/A SER 224.A OG ASP 177.A OD1 no hydrogen 3.068 N/A SER 224.A OG ALA 220.A O no hydrogen 3.454 N/A GLY 225.A N VAL 222.A O no hydrogen 2.824 N/A TYR 226.A N LEU 221.A O no hydrogen 3.000 N/A TYR 226.A OH THR 180.A OG1 no hydrogen 2.912 N/A LYS 227.A N GLN 256.A O no hydrogen 2.750 N/A ARG 229.A N TRP 254.A O no hydrogen 2.807 N/A ARG 229.A NH1 GLN 256.A OE1 no hydrogen 3.538 N/A ARG 229.A NH2 GLU 47.A OE1 no hydrogen 2.764 N/A ASP 230.A N TRP 254.A O no hydrogen 3.144 N/A ARG 232.A N PHE 252.A O no hydrogen 2.804 N/A ARG 232.A NE ASP 230.A OD2 no hydrogen 2.731 N/A ARG 232.A NH1 GLN 41.A OE1 no hydrogen 2.765 N/A ARG 232.A NH2 GLN 41.A OE1 no hydrogen 2.913 N/A ARG 232.A NH2 ASP 230.A OD2 no hydrogen 3.477 N/A THR 233.A OG1 GLU 214.A OE2 no hydrogen 2.825 N/A TYR 234.A N VAL 250.A O no hydrogen 2.704 N/A TYR 234.A OH ASN 29.A O no hydrogen 2.752 N/A MET 236.A N LYS 248.A O no hydrogen 3.126 N/A LEU 240.A N PRO 237.A O no hydrogen 3.051 N/A GLN 241.A N ALA 238.A O no hydrogen 2.758 N/A GLN 241.A NE2.A MET 236.A O no hydrogen 3.358 N/A VAL 247.A N ASP 245.A OD1 no hydrogen 3.428 N/A LYS 248.A N LEU 195.A O no hydrogen 3.071 N/A LYS 248.A NZ GLU 196.A O no hydrogen 3.461 N/A LYS 248.A NZ ASP 246.A O no hydrogen 2.727 N/A VAL 250.A N TYR 234.A O no hydrogen 2.732 N/A PHE 251.A N GLY 193.A O no hydrogen 2.949 N/A PHE 252.A N ARG 232.A O no hydrogen 2.883 N/A ALA 253.A N LEU 191.A O no hydrogen 2.813 N/A TRP 254.A N ASP 230.A O no hydrogen 2.732 N/A TRP 254.A NE1 HIS 188.A ND1 no hydrogen 3.078 N/A ALA 255.A N LEU 189.A O no hydrogen 2.893 N/A GLN 256.A N LYS 227.A O no hydrogen 2.839 N/A GLN 256.A NE2 GLY 186.A O no hydrogen 3.317 N/A LYS 257.A N GLY 187.A O no hydrogen 3.102 N/A LYS 257.A NZ THR 180.A O no hydrogen 2.957 N/A LYS 257.A NZ LEU 183.A O no hydrogen 2.819 N/A VAL 258.A N GLY 225.A O no hydrogen 3.159 N/A