Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gaf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N HIS 4.A ND1 no hydrogen 2.908 N/A LEU 5.A N ALA 30.A O no hydrogen 2.821 N/A ALA 8.A N LEU 5.A O no hydrogen 3.134 N/A VAL 9.A N THR 86.A OG1 no hydrogen 3.089 N/A ALA 10.A N SER 33.A O no hydrogen 2.900 N/A ILE 11.A N VAL 87.A O no hydrogen 2.836 N/A VAL 12.A N VAL 35.A O no hydrogen 2.954 N/A THR 13.A N VAL 89.A O no hydrogen 3.244 N/A THR 13.A OG1 VAL 89.A O no hydrogen 3.385 N/A ALA 15.A N THR 37.A O no hydrogen 2.704 N/A ARG 21.A N ALA 17.A O no hydrogen 3.210 N/A ARG 21.A NE ALA 16.A O no hydrogen 3.221 N/A ALA 22.A N GLY 18.A O no hydrogen 3.115 N/A ILE 23.A N ILE 19.A O no hydrogen 2.959 N/A ALA 24.A N GLY 20.A O no hydrogen 2.975 N/A GLY 25.A N ARG 21.A O no hydrogen 3.083 N/A THR 26.A N ALA 22.A O no hydrogen 3.003 N/A THR 26.A OG1 ALA 22.A O no hydrogen 2.584 N/A PHE 27.A N ILE 23.A O no hydrogen 2.832 N/A ALA 28.A N ALA 24.A O no hydrogen 3.088 N/A LYS 29.A N GLY 25.A O no hydrogen 2.968 N/A ALA 30.A N THR 26.A O no hydrogen 2.891 N/A GLY 31.A N ALA 28.A O no hydrogen 3.151 N/A ALA 32.A N PHE 27.A O no hydrogen 2.890 N/A SER 33.A N ALA 8.A O no hydrogen 2.846 N/A VAL 34.A N LYS 57.A O no hydrogen 2.946 N/A VAL 35.A N ALA 10.A O no hydrogen 2.768 N/A VAL 36.A N ILE 59.A O no hydrogen 2.840 N/A THR 37.A N VAL 12.A O no hydrogen 2.969 N/A ASP 38.A N LEU 61.A O no hydrogen 3.121 N/A LYS 40.A N ASP 38.A OD1 no hydrogen 2.822 N/A GLY 43.A N LYS 40.A O no hydrogen 3.010 N/A ALA 44.A N LYS 40.A O no hydrogen 3.356 N/A GLU 45.A N SER 41.A O no hydrogen 2.768 N/A ALA 46.A N GLU 42.A O no hydrogen 3.041 N/A VAL 47.A N GLY 43.A O no hydrogen 3.374 N/A ALA 48.A N ALA 44.A O no hydrogen 3.023 N/A ALA 49.A N GLU 45.A O no hydrogen 2.887 N/A ALA 50.A N ALA 46.A O no hydrogen 3.107 N/A ILE 51.A N VAL 47.A O no hydrogen 2.924 N/A ARG 52.A N ALA 48.A O no hydrogen 2.936 N/A ARG 52.A NE ALA 58.A O no hydrogen 2.937 N/A ARG 52.A NH2 ALA 58.A O no hydrogen 3.349 N/A GLN 53.A N ALA 49.A O no hydrogen 2.844 N/A ALA 54.A N ALA 50.A O no hydrogen 2.961 N/A GLY 55.A N ARG 52.A O no hydrogen 3.069 N/A ILE 59.A N VAL 34.A O no hydrogen 2.969 N/A LEU 61.A N VAL 36.A O no hydrogen 2.968 N/A CYS 63.A N ASP 38.A O no hydrogen 2.883 N/A ASN 64.A N HIS 70.A ND1 no hydrogen 2.898 N/A THR 66.A N ASN 64.A OD1 no hydrogen 3.156 N/A THR 66.A OG1 ASN 64.A OD1 no hydrogen 2.569 N/A ASP 67.A N ASN 64.A O no hydrogen 2.813 N/A GLN 69.A N ASP 67.A OD1 no hydrogen 3.005 N/A HIS 70.A N ASP 67.A OD1 no hydrogen 3.168 N/A ARG 71.A N ASP 67.A O no hydrogen 3.036 N/A ARG 71.A NE GLU 68.A OE1 no hydrogen 3.214 N/A ARG 71.A NH1 VAL 65.A O no hydrogen 2.530 N/A ARG 71.A NH2 GLU 68.A OE1 no hydrogen 2.923 N/A GLU 72.A N GLU 68.A O no hydrogen 3.209 N/A ALA 73.A N GLN 69.A O no hydrogen 2.879 N/A VAL 74.A N HIS 70.A O no hydrogen 2.798 N/A ILE 75.A N ARG 71.A O no hydrogen 3.041 N/A LYS 76.A N GLU 72.A O no hydrogen 2.914 N/A ALA 77.A N ALA 73.A O no hydrogen 2.865 N/A ALA 78.A N VAL 74.A O no hydrogen 2.941 N/A LEU 79.A N ILE 75.A O no hydrogen 3.125 N/A ASP 80.A N LYS 76.A O no hydrogen 2.795 N/A GLN 81.A N ALA 77.A O no hydrogen 2.987 N/A PHE 82.A N ALA 78.A O no hydrogen 2.994 N/A GLY 83.A N LEU 79.A O no hydrogen 2.774 N/A LYS 84.A NZ ASP 7.A O no hydrogen 2.510 N/A THR 86.A N VAL 9.A O no hydrogen 3.016 N/A VAL 87.A N VAL 9.A O no hydrogen 2.874 N/A LEU 88.A N ALA 136.A O no hydrogen 3.030 N/A VAL 89.A N ILE 11.A O no hydrogen 2.868 N/A ASN 90.A N LEU 138.A O no hydrogen 2.804 N/A ASN 91.A N THR 13.A OG1 no hydrogen 3.175 N/A ASN 91.A ND2 THR 13.A O no hydrogen 3.282 N/A ASN 91.A ND2 GLY 14.A O no hydrogen 3.041 N/A ALA 92.A N THR 13.A OG1 no hydrogen 3.112 N/A GLY 94.A N ASN 114.A OD1 no hydrogen 2.989 N/A LYS 98.A N ARG 151.A O no hydrogen 2.943 N/A MET 102.A N PRO 99.A O no hydrogen 3.213 N/A ASP 106.A N PRO 103.A O no hydrogen 2.853 N/A PHE 107.A N PRO 103.A O no hydrogen 3.495 N/A GLU 108.A N MET 104.A O no hydrogen 2.854 N/A TRP 109.A N SER 105.A O no hydrogen 3.035 N/A ALA 110.A N ASP 106.A O no hydrogen 3.257 N/A LYS 112.A N GLU 108.A O no hydrogen 2.895 N/A LEU 113.A N TRP 109.A O no hydrogen 3.031 N/A ASN 114.A N ALA 110.A O no hydrogen 2.824 N/A ASN 114.A ND2 GLY 94.A O no hydrogen 2.873 N/A ASN 114.A ND2 SER 158.A OG no hydrogen 3.223 N/A LEU 115.A N PHE 111.A O no hydrogen 2.738 N/A PHE 116.A N PHE 111.A O no hydrogen 2.818 N/A SER 117.A N LYS 112.A O no hydrogen 3.156 N/A SER 117.A OG LEU 113.A O no hydrogen 2.843 N/A PHE 119.A N LEU 115.A O no hydrogen 2.887 N/A ARG 120.A N PHE 116.A O no hydrogen 2.878 N/A ARG 120.A NE GLU 68.A OE1 no hydrogen 3.200 N/A ARG 120.A NE GLU 68.A OE2 no hydrogen 3.274 N/A ARG 120.A NH1 GLU 68.A OE2 no hydrogen 3.037 N/A ARG 120.A NH2 GLN 123.A OE1 no hydrogen 3.158 N/A LEU 121.A N SER 117.A O no hydrogen 3.087 N/A SER 122.A N LEU 118.A O no hydrogen 3.128 N/A SER 122.A OG LEU 118.A O no hydrogen 2.702 N/A GLN 123.A N PHE 119.A O no hydrogen 3.065 N/A LEU 124.A N ARG 120.A O no hydrogen 3.072 N/A ALA 125.A N LEU 121.A O no hydrogen 2.902 N/A ALA 126.A N SER 122.A O no hydrogen 2.893 N/A HIS 128.A ND1 LEU 124.A O no hydrogen 3.145 N/A MET 129.A N ALA 125.A O no hydrogen 3.103 N/A GLN 130.A N ALA 126.A O no hydrogen 3.040 N/A LYS 131.A N PRO 127.A O no hydrogen 3.040 N/A ALA 132.A N HIS 128.A O no hydrogen 3.127 N/A ALA 132.A N MET 129.A O no hydrogen 3.251 N/A GLY 133.A N GLN 130.A O no hydrogen 2.871 N/A GLY 134.A N MET 129.A O no hydrogen 2.924 N/A GLY 135.A N GLY 177.A O no hydrogen 3.088 N/A ALA 136.A N THR 86.A O no hydrogen 2.985 N/A ILE 137.A N ARG 179.A O no hydrogen 2.783 N/A LEU 138.A N LEU 88.A O no hydrogen 2.910 N/A ASN 139.A N ASN 181.A O no hydrogen 2.789 N/A ASN 139.A ND2 THR 166.A OG1 no hydrogen 2.770 N/A ILE 140.A N ASN 90.A O no hydrogen 3.186 N/A SER 141.A N ILE 183.A O no hydrogen 2.695 N/A SER 141.A OG LYS 159.A O no hydrogen 3.364 N/A SER 141.A OG ASN 163.A OD1 no hydrogen 2.801 N/A ALA 144.A N SER 142.A OG no hydrogen 3.024 N/A GLY 145.A N SER 142.A O no hydrogen 3.079 N/A GLU 146.A N MET 143.A O no hydrogen 2.979 N/A ASN 147.A N MET 143.A O no hydrogen 2.901 N/A VAL 150.A N ASN 149.A OD1 no hydrogen 2.857 N/A GLY 156.A N MET 152.A O no hydrogen 2.804 N/A SER 157.A OG ALA 153.A O no hydrogen 2.649 N/A SER 158.A N SER 154.A O no hydrogen 3.086 N/A SER 158.A OG SER 154.A O no hydrogen 3.156 N/A SER 158.A OG TYR 155.A O no hydrogen 3.176 N/A LYS 159.A N TYR 155.A O no hydrogen 3.095 N/A LYS 159.A NZ ASN 114.A OD1 no hydrogen 3.412 N/A LYS 159.A NZ ILE 140.A O no hydrogen 3.551 N/A ALA 160.A N GLY 156.A O no hydrogen 2.974 N/A ALA 161.A N SER 157.A O no hydrogen 2.880 N/A VAL 162.A N SER 158.A O no hydrogen 3.092 N/A ASN 163.A N LYS 159.A O no hydrogen 3.073 N/A HIS 164.A N ALA 160.A O no hydrogen 3.087 N/A LEU 165.A N ALA 161.A O no hydrogen 2.807 N/A THR 166.A N VAL 162.A O no hydrogen 3.042 N/A THR 166.A OG1 VAL 162.A O no hydrogen 2.762 N/A ARG 167.A N ASN 163.A O no hydrogen 3.140 N/A ARG 167.A NH1 HIS 164.A ND1 no hydrogen 3.219 N/A ASN 168.A N HIS 164.A O no hydrogen 3.011 N/A ASN 168.A ND2 HIS 164.A O no hydrogen 2.810 N/A ILE 169.A N LEU 165.A O no hydrogen 2.828 N/A ALA 170.A N THR 166.A O no hydrogen 3.300 N/A PHE 171.A N ASN 168.A O no hydrogen 2.889 N/A VAL 173.A N ILE 169.A O no hydrogen 3.028 N/A GLY 174.A N ALA 170.A O no hydrogen 3.030 N/A MET 176.A N VAL 173.A O no hydrogen 3.054 N/A GLY 177.A N GLY 174.A O no hydrogen 2.883 N/A ILE 178.A N VAL 173.A O no hydrogen 3.053 N/A ARG 179.A N GLY 135.A O no hydrogen 3.107 N/A ARG 179.A NE ILE 235.A O no hydrogen 3.581 N/A ARG 179.A NH1 SER 229.A O no hydrogen 3.432 N/A ARG 179.A NH2 SER 229.A O no hydrogen 3.334 N/A VAL 180.A N SER 236.A OG no hydrogen 3.145 N/A ASN 181.A N ILE 137.A O no hydrogen 3.102 N/A ASN 181.A ND2 ILE 235.A O no hydrogen 2.971 N/A ALA 182.A N GLN 238.A O no hydrogen 2.865 N/A ILE 183.A N ASN 139.A O no hydrogen 2.990 N/A ALA 184.A N LEU 240.A O no hydrogen 2.841 N/A GLY 186.A N VAL 242.A O no hydrogen 2.758 N/A ALA 187.A N GLN 248.A OE1 no hydrogen 2.771 N/A LYS 189.A N GLY 215.A O no hydrogen 2.722 N/A THR 190.A N ILE 188.A O no hydrogen 2.962 N/A LEU 193.A N THR 190.A OG1 no hydrogen 3.370 N/A ALA 194.A N THR 190.A O no hydrogen 2.529 N/A LEU 197.A N LEU 193.A O no hydrogen 2.767 N/A THR 198.A OG1 GLU 200.A OE2 no hydrogen 2.947 N/A ILE 201.A N THR 198.A OG1 no hydrogen 3.217 N/A GLU 202.A N THR 198.A O no hydrogen 2.824 N/A ARG 203.A N PRO 199.A O no hydrogen 3.207 N/A ALA 204.A N GLU 200.A O no hydrogen 3.434 N/A MET 205.A N ILE 201.A O no hydrogen 3.061 N/A LEU 206.A N GLU 202.A O no hydrogen 2.985 N/A LYS 207.A N ALA 204.A O no hydrogen 3.325 N/A THR 209.A N LEU 206.A O no hydrogen 3.155 N/A THR 209.A OG1 MET 205.A O no hydrogen 2.979 N/A THR 209.A OG1 VAL 247.A O no hydrogen 3.336 N/A LEU 211.A N GLY 244.A O no hydrogen 3.169 N/A GLY 212.A N THR 209.A O no hydrogen 2.888 N/A ARG 213.A NH1 LEU 214.A O no hydrogen 3.329 N/A ARG 213.A NH1 ASP 219.A OD2 no hydrogen 2.899 N/A ARG 213.A NH2 ASP 219.A OD1 no hydrogen 3.296 N/A ARG 213.A NH2 ASP 219.A OD2 no hydrogen 3.297 N/A GLY 215.A N ALA 187.A O no hydrogen 3.056 N/A GLU 216.A N ASP 219.A OD2 no hydrogen 2.777 N/A GLN 218.A NE2 THR 26.A OG1 no hydrogen 2.844 N/A GLN 218.A NE2 ASN 222.A OD1 no hydrogen 3.224 N/A ASP 219.A N GLU 216.A O no hydrogen 2.942 N/A ALA 221.A N ALA 217.A O no hydrogen 3.059 N/A ASN 222.A N GLN 218.A O no hydrogen 2.820 N/A ALA 223.A N ASP 219.A O no hydrogen 3.244 N/A ALA 224.A N ILE 220.A O no hydrogen 2.819 N/A LEU 225.A N ALA 221.A O no hydrogen 2.780 N/A PHE 226.A N ASN 222.A O no hydrogen 3.022 N/A LEU 227.A N ALA 223.A O no hydrogen 2.999 N/A CYS 228.A N ALA 224.A O no hydrogen 3.130 N/A CYS 228.A N LEU 225.A O no hydrogen 3.232 N/A CYS 228.A SG ALA 224.A O no hydrogen 3.596 N/A SER 229.A N PHE 226.A O no hydrogen 3.194 N/A SER 229.A OG PRO 2.A O no hydrogen 3.310 N/A SER 229.A OG LEU 225.A O no hydrogen 3.387 N/A SER 229.A OG PHE 226.A O no hydrogen 2.745 N/A ALA 231.A N PRO 2.A O no hydrogen 2.988 N/A ALA 231.A N SER 229.A OG no hydrogen 3.186 N/A ALA 232.A N SER 229.A O no hydrogen 2.977 N/A ALA 233.A N PRO 230.A O no hydrogen 3.084 N/A ILE 235.A N ALA 232.A O no hydrogen 2.994 N/A SER 236.A OG VAL 180.A O no hydrogen 3.471 N/A GLY 237.A N VAL 180.A O no hydrogen 2.770 N/A GLN 238.A N ASN 181.A OD1 no hydrogen 3.090 N/A LEU 240.A N ALA 182.A O no hydrogen 2.830 N/A VAL 242.A N ALA 184.A O no hydrogen 3.051 N/A SER 243.A OG GLY 246.A O no hydrogen 3.230 N/A GLY 246.A N SER 243.A O no hydrogen 3.304 N/A VAL 247.A N HIS 208.A O no hydrogen 3.104 N/A GLN 248.A NE2 THR 209.A OG1 no hydrogen 2.965 N/A GLN 248.A NE2 SER 243.A O no hydrogen 2.874 N/A