Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cld_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N PRO 1.A O no hydrogen 2.980 N/A THR 6.A OG1 SER 9.A OG no hydrogen 3.334 N/A SER 9.A OG THR 6.A O no hydrogen 2.612 N/A SER 9.A OG THR 6.A OG1 no hydrogen 3.334 N/A LEU 10.A N THR 6.A O no hydrogen 3.238 N/A LEU 11.A N LEU 7.A O no hydrogen 3.146 N/A GLU 12.A N VAL 8.A O no hydrogen 2.833 N/A VAL 13.A N SER 9.A O no hydrogen 3.305 N/A VAL 13.A N LEU 10.A O no hydrogen 3.025 N/A ILE 14.A N LEU 10.A O no hydrogen 3.020 N/A ALA 21.A N ASP 98.A OD1 no hydrogen 2.572 N/A GLY 22.A N ASP 98.A OD2 no hydrogen 2.699 N/A TYR 23.A N ASP 98.A OD2 no hydrogen 3.065 N/A TYR 23.A OH ASP 29.A OD1 no hydrogen 2.984 N/A SER 26.A N ASP 24.A OD1 no hydrogen 3.067 N/A SER 26.A OG ASP 24.A OD1 no hydrogen 2.893 N/A THR 31.A OG1 PRO 109.A O no hydrogen 2.650 N/A ARG 33.A NE PRO 28.A O no hydrogen 3.113 N/A ARG 33.A NH1 ASP 24.A O no hydrogen 3.527 N/A ARG 33.A NH2 ASP 24.A O no hydrogen 3.447 N/A ARG 33.A NH2 PRO 28.A O no hydrogen 2.697 N/A ILE 34.A N SER 30.A O no hydrogen 2.944 N/A MET 35.A N THR 31.A O no hydrogen 3.054 N/A THR 36.A N TRP 32.A O no hydrogen 3.234 N/A THR 36.A OG1 TRP 32.A O no hydrogen 3.316 N/A THR 37.A N ARG 33.A O no hydrogen 2.992 N/A THR 37.A OG1 ARG 33.A O no hydrogen 2.638 N/A LEU 38.A N ILE 34.A O no hydrogen 2.757 N/A ASN 39.A N MET 35.A O no hydrogen 2.786 N/A ASN 39.A ND2 GLU 215.A O no hydrogen 3.078 N/A MET 40.A N THR 36.A O no hydrogen 2.940 N/A LEU 41.A N THR 37.A O no hydrogen 3.061 N/A GLY 42.A N LEU 38.A O no hydrogen 2.766 N/A GLY 43.A N ASN 39.A O no hydrogen 2.979 N/A ARG 44.A N MET 40.A O no hydrogen 3.272 N/A ARG 44.A NH2 TYR 20.A O no hydrogen 2.458 N/A GLN 45.A N LEU 41.A O no hydrogen 2.848 N/A VAL 46.A N GLY 42.A O no hydrogen 2.987 N/A ILE 47.A N GLY 43.A O no hydrogen 3.205 N/A ALA 48.A N ARG 44.A O no hydrogen 3.140 N/A ALA 49.A N GLN 45.A O no hydrogen 3.036 N/A VAL 50.A N VAL 46.A O no hydrogen 2.954 N/A LYS 51.A N ILE 47.A O no hydrogen 3.356 N/A TRP 52.A N ALA 48.A O no hydrogen 2.923 N/A ALA 53.A N ALA 49.A O no hydrogen 2.886 N/A LYS 54.A N VAL 50.A O no hydrogen 3.085 N/A ALA 55.A N TRP 52.A O no hydrogen 2.957 N/A ILE 56.A N ALA 53.A O no hydrogen 2.933 N/A PHE 59.A N ILE 56.A O no hydrogen 3.005 N/A ASN 61.A N GLY 58.A O no hydrogen 2.799 N/A LEU 62.A N PHE 59.A O no hydrogen 2.867 N/A HIS 63.A N SER 154.A OG no hydrogen 3.081 N/A ASP 65.A N HIS 63.A ND1 no hydrogen 3.047 N/A GLN 67.A N HIS 63.A O no hydrogen 2.851 N/A GLN 67.A NE2 LEU 62.A O no hydrogen 2.787 N/A MET 68.A N LEU 64.A O no hydrogen 2.987 N/A THR 69.A N ASP 65.A O no hydrogen 2.936 N/A THR 69.A OG1 ASP 65.A O no hydrogen 2.920 N/A LEU 70.A N ASP 66.A O no hydrogen 2.849 N/A LEU 71.A N GLN 67.A O no hydrogen 3.297 N/A GLN 72.A N MET 68.A O no hydrogen 2.852 N/A TYR 73.A N THR 69.A O no hydrogen 2.776 N/A SER 74.A N LEU 70.A O no hydrogen 2.977 N/A SER 74.A OG LEU 70.A O no hydrogen 2.622 N/A TRP 75.A N LEU 71.A O no hydrogen 3.060 N/A TYR 77.A OH HIS 193.A ND1 no hydrogen 2.681 N/A LEU 78.A N SER 74.A O no hydrogen 3.032 N/A MET 79.A N TRP 75.A O no hydrogen 2.995 N/A ALA 80.A N MET 76.A O no hydrogen 2.905 N/A PHE 81.A N TYR 77.A O no hydrogen 2.861 N/A ALA 82.A N LEU 78.A O no hydrogen 3.056 N/A LEU 83.A N MET 79.A O no hydrogen 2.914 N/A GLY 84.A N ALA 80.A O no hydrogen 2.904 N/A TRP 85.A N PHE 81.A O no hydrogen 2.907 N/A ARG 86.A N ALA 82.A O no hydrogen 2.853 N/A ARG 86.A NE CYS 94.A O no hydrogen 2.892 N/A SER 87.A N LEU 83.A O no hydrogen 2.844 N/A SER 87.A OG LEU 83.A O no hydrogen 2.871 N/A TYR 88.A N GLY 84.A O no hydrogen 3.003 N/A TYR 88.A OH VAL 130.A O no hydrogen 3.166 N/A ARG 89.A N TRP 85.A O no hydrogen 2.804 N/A GLN 90.A N ARG 86.A O no hydrogen 3.157 N/A LEU 93.A N ILE 101.A O no hydrogen 3.314 N/A CYS 94.A N SER 87.A OG no hydrogen 3.113 N/A ALA 96.A N LEU 99.A O no hydrogen 3.325 N/A LEU 99.A N ALA 96.A O no hydrogen 2.862 N/A ILE 101.A N LEU 93.A O no hydrogen 2.913 N/A ARG 105.A N ASN 102.A OD1 no hydrogen 2.982 N/A ARG 105.A NE ASP 29.A OD2 no hydrogen 2.731 N/A ARG 105.A NH1 ILE 100.A O no hydrogen 2.730 N/A ARG 105.A NH2 ASP 29.A OD2 no hydrogen 3.518 N/A MET 106.A N ASN 102.A O no hydrogen 3.098 N/A THR 107.A N GLN 104.A O no hydrogen 3.054 N/A THR 107.A OG1 GLN 104.A O no hydrogen 2.454 N/A LEU 108.A N ARG 105.A O no hydrogen 3.031 N/A MET 111.A N LEU 108.A O no hydrogen 3.104 N/A GLN 114.A N MET 111.A O no hydrogen 3.267 N/A CYS 115.A N MET 111.A O no hydrogen 3.131 N/A CYS 115.A SG MET 111.A O no hydrogen 3.229 N/A LYS 116.A N TYR 112.A O no hydrogen 2.779 N/A LYS 116.A NZ ASP 113.A O no hydrogen 3.392 N/A HIS 117.A N GLN 114.A O no hydrogen 3.162 N/A LEU 119.A N CYS 115.A O no hydrogen 2.814 N/A TYR 120.A N LYS 116.A O no hydrogen 3.002 N/A TYR 120.A OH SER 191.A OG no hydrogen 3.098 N/A SER 122.A N MET 118.A O no hydrogen 3.445 N/A SER 122.A OG GLY 84.A O no hydrogen 3.328 N/A SER 123.A N LEU 119.A O no hydrogen 2.894 N/A SER 123.A OG TYR 120.A O no hydrogen 3.293 N/A GLU 124.A N TYR 120.A O no hydrogen 3.009 N/A LEU 125.A N VAL 121.A O no hydrogen 3.164 N/A HIS 126.A N SER 122.A O no hydrogen 3.227 N/A ARG 127.A N SER 123.A O no hydrogen 2.861 N/A ARG 127.A NE GLU 124.A OE1 no hydrogen 2.840 N/A LEU 128.A N GLU 124.A O no hydrogen 2.826 N/A GLN 129.A NE2 HIS 126.A O no hydrogen 2.907 N/A VAL 130.A N LEU 125.A O no hydrogen 3.068 N/A SER 131.A N GLU 134.A OE1 no hydrogen 2.871 N/A SER 131.A OG GLU 134.A OE1 no hydrogen 3.006 N/A TYR 135.A N SER 131.A O no hydrogen 2.989 N/A LEU 136.A N TYR 132.A O no hydrogen 3.001 N/A CYS 137.A N GLU 133.A O no hydrogen 3.275 N/A CYS 137.A SG GLU 133.A O no hydrogen 3.309 N/A MET 138.A N GLU 134.A O no hydrogen 2.936 N/A LYS 139.A N TYR 135.A O no hydrogen 2.886 N/A LYS 139.A NZ GLU 15.A OE1 no hydrogen 2.711 N/A LYS 139.A NZ GLU 15.A OE2 no hydrogen 3.069 N/A THR 140.A N LEU 136.A O no hydrogen 3.265 N/A THR 140.A OG1 LEU 136.A O no hydrogen 2.767 N/A LEU 141.A N CYS 137.A O no hydrogen 3.014 N/A LEU 142.A N MET 138.A O no hydrogen 2.952 N/A LEU 143.A N LYS 139.A O no hydrogen 3.203 N/A LEU 144.A N LEU 141.A O no hydrogen 2.778 N/A SER 145.A OG LEU 142.A O no hydrogen 2.813 N/A VAL 147.A N LYS 237.A O no hydrogen 3.041 N/A LYS 149.A N ASN 235.A O no hydrogen 2.485 N/A GLY 151.A N PRO 148.A O no hydrogen 3.085 N/A LEU 152.A N GLN 155.A OE1 no hydrogen 2.761 N/A LYS 153.A N ASP 66.A OD1 no hydrogen 3.063 N/A LYS 153.A NZ ASP 65.A OD2 no hydrogen 3.218 N/A SER 154.A N ASP 66.A OD2 no hydrogen 2.661 N/A SER 154.A OG ASP 66.A OD2 no hydrogen 3.246 N/A GLN 155.A NE2 ASP 159.A OD1 no hydrogen 3.042 N/A PHE 158.A N SER 154.A O no hydrogen 2.978 N/A ASP 159.A N GLN 155.A O no hydrogen 2.748 N/A GLU 160.A N GLU 156.A O no hydrogen 2.957 N/A ILE 161.A N LEU 157.A O no hydrogen 2.874 N/A ARG 162.A N PHE 158.A O no hydrogen 2.989 N/A ARG 162.A NE LEU 144.A O no hydrogen 3.164 N/A MET 163.A N ASP 159.A O no hydrogen 2.981 N/A THR 164.A N GLU 160.A O no hydrogen 2.966 N/A THR 164.A OG1 GLU 160.A O no hydrogen 2.790 N/A TYR 165.A N ILE 161.A O no hydrogen 3.173 N/A ILE 166.A N ARG 162.A O no hydrogen 3.025 N/A LYS 167.A N MET 163.A O no hydrogen 3.336 N/A GLU 168.A N THR 164.A O no hydrogen 2.902 N/A LEU 169.A N TYR 165.A O no hydrogen 2.991 N/A GLY 170.A N ILE 166.A O no hydrogen 3.221 N/A LYS 171.A N LYS 167.A O no hydrogen 3.144 N/A ALA 172.A N GLU 168.A O no hydrogen 3.130 N/A ILE 173.A N LEU 169.A O no hydrogen 2.992 N/A VAL 174.A N GLY 170.A O no hydrogen 3.285 N/A LYS 175.A N LYS 171.A O no hydrogen 2.838 N/A LYS 175.A NZ GLU 133.A OE1 no hydrogen 2.926 N/A LYS 175.A NZ GLU 133.A OE2 no hydrogen 3.211 N/A ARG 176.A NH2 GLN 129.A O no hydrogen 2.853 N/A ARG 181.A NE GLU 134.A OE2 no hydrogen 2.722 N/A ARG 181.A NH1 LEU 128.A O no hydrogen 2.898 N/A ARG 181.A NH2 LEU 128.A O no hydrogen 3.124 N/A ARG 181.A NH2 GLN 129.A O no hydrogen 3.486 N/A ARG 181.A NH2 GLU 134.A OE1 no hydrogen 2.904 N/A ARG 181.A NH2 GLU 134.A OE2 no hydrogen 3.443 N/A PHE 182.A N ASN 178.A O no hydrogen 2.988 N/A TYR 183.A N TRP 179.A O no hydrogen 3.056 N/A GLN 184.A N GLN 180.A O no hydrogen 2.864 N/A LEU 185.A N ARG 181.A O no hydrogen 2.800 N/A THR 186.A N PHE 182.A O no hydrogen 2.822 N/A THR 186.A OG1 PHE 182.A O no hydrogen 2.746 N/A THR 186.A OG1 TYR 183.A O no hydrogen 3.097 N/A THR 186.A OG1 HIS 242.A NE2 no hydrogen 2.796 N/A LYS 187.A N TYR 183.A O no hydrogen 2.772 N/A LEU 188.A N GLN 184.A O no hydrogen 3.116 N/A LEU 189.A N LEU 185.A O no hydrogen 3.218 N/A ASP 190.A N THR 186.A O no hydrogen 2.950 N/A SER 191.A N LYS 187.A O no hydrogen 3.003 N/A SER 191.A OG TYR 120.A OH no hydrogen 3.098 N/A SER 191.A OG LEU 188.A O no hydrogen 2.883 N/A MET 192.A N LEU 189.A O no hydrogen 3.028 N/A HIS 193.A N ASP 190.A O no hydrogen 3.287 N/A HIS 193.A ND1 TYR 77.A OH no hydrogen 2.681 N/A HIS 193.A NE2 LEU 239.A O no hydrogen 3.227 N/A VAL 195.A N SER 191.A O no hydrogen 3.433 N/A VAL 196.A N MET 192.A O no hydrogen 2.833 N/A GLU 197.A N HIS 193.A O no hydrogen 3.039 N/A ASN 198.A N GLU 194.A O no hydrogen 3.472 N/A LEU 199.A N VAL 195.A O no hydrogen 3.097 N/A LEU 200.A N VAL 196.A O no hydrogen 2.751 N/A ASN 201.A N GLU 197.A O no hydrogen 2.796 N/A TYR 202.A N ASN 198.A O no hydrogen 3.156 N/A CYS 203.A N LEU 199.A O no hydrogen 3.053 N/A PHE 204.A N LEU 200.A O no hydrogen 2.904 N/A GLN 205.A N ASN 201.A O no hydrogen 3.127 N/A THR 206.A N TYR 202.A O no hydrogen 3.005 N/A THR 206.A OG1 TYR 202.A O no hydrogen 2.625 N/A PHE 207.A N CYS 203.A O no hydrogen 2.875 N/A LEU 208.A N PHE 204.A O no hydrogen 2.908 N/A ASP 209.A N THR 206.A O no hydrogen 3.193 N/A MET 212.A N LYS 210.A O no hydrogen 2.930 N/A LEU 220.A N PRO 217.A O no hydrogen 3.245 N/A ALA 221.A N PRO 217.A O no hydrogen 3.043 N/A GLU 222.A N GLU 218.A O no hydrogen 2.970 N/A ILE 224.A N LEU 220.A O no hydrogen 2.815 N/A THR 225.A N ALA 221.A O no hydrogen 3.034 N/A THR 225.A OG1 ALA 221.A O no hydrogen 2.591 N/A ASN 226.A N GLU 222.A O no hydrogen 2.815 N/A GLN 227.A NE2 ASN 226.A O no hydrogen 3.182 N/A ILE 228.A N ILE 224.A O no hydrogen 3.131 N/A TYR 231.A N GLN 227.A O no hydrogen 2.974 N/A SER 232.A N ILE 228.A O no hydrogen 3.077 N/A GLY 234.A N LYS 230.A O no hydrogen 3.016 N/A ASN 235.A N LYS 230.A O no hydrogen 3.289 N/A LYS 237.A N VAL 147.A O no hydrogen 2.555 N/A LEU 239.A N SER 145.A O no hydrogen 2.880 N/A PHE 241.A N ASP 190.A OD1 no hydrogen 2.712 N/A HIS 242.A N ASP 190.A OD2 no hydrogen 2.892 N/A HIS 242.A NE2 THR 186.A OG1 no hydrogen 2.796 N/A