Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3t8a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A ND2 GLY 75.A O no hydrogen 2.780 N/A PHE 4.A N ASN 2.A OD1 no hydrogen 2.995 N/A LYS 7.A N ASP 5.A OD1 no hydrogen 3.075 N/A ALA 8.A N ASP 5.A O no hydrogen 2.792 N/A ARG 10.A N ARG 25.A O no hydrogen 2.969 N/A VAL 12.A N TYR 23.A O no hydrogen 3.159 N/A PHE 15.A N VAL 12.A O no hydrogen 3.335 N/A LEU 18.A N PHE 15.A O no hydrogen 3.295 N/A THR 19.A N GLU 52.A OE1 no hydrogen 3.204 N/A THR 19.A N GLU 52.A OE2 no hydrogen 3.025 N/A THR 19.A OG1 ASP 20.A OD1 no hydrogen 2.828 N/A THR 19.A OG1 HIS 48.A NE2 no hydrogen 2.911 N/A THR 19.A OG1 GLU 52.A OE2 no hydrogen 3.521 N/A ASP 20.A N GLU 52.A OE1 no hydrogen 2.717 N/A THR 22.A N ALA 35.A O no hydrogen 3.043 N/A TYR 23.A OH HIS 59.A ND1 no hydrogen 2.821 N/A HIS 24.A N ARG 33.A O no hydrogen 2.953 N/A ARG 25.A N ARG 10.A O no hydrogen 2.898 N/A ARG 25.A NE ASP 29.A O no hydrogen 2.717 N/A ARG 25.A NH1 ASP 65.A OD2 no hydrogen 2.866 N/A HIS 26.A N THR 31.A O no hydrogen 2.877 N/A VAL 27.A N ALA 8.A O no hydrogen 2.990 N/A ASP 28.A N HIS 26.A ND1 no hydrogen 3.201 N/A ASP 29.A N HIS 26.A ND1 no hydrogen 2.977 N/A VAL 32.A N VAL 68.A O no hydrogen 3.086 N/A ARG 33.A N HIS 24.A O no hydrogen 2.771 N/A ARG 33.A NE GLU 198.A OE1 no hydrogen 2.903 N/A ARG 33.A NE GLU 198.A OE2 no hydrogen 3.094 N/A ARG 33.A NH1 ASN 74.A OD1 no hydrogen 2.676 N/A ARG 33.A NH2 ASN 74.A OD1 no hydrogen 2.765 N/A ARG 33.A NH2 GLU 198.A OE2 no hydrogen 2.685 N/A VAL 34.A N LEU 70.A O no hydrogen 2.761 N/A ALA 35.A N THR 22.A O no hydrogen 3.202 N/A PHE 36.A N THR 72.A O no hydrogen 2.868 N/A ASN 37.A N ASP 20.A O no hydrogen 2.747 N/A ARG 38.A N ASN 43.A OD1 no hydrogen 2.808 N/A ARG 38.A NH1 ALA 44.A O no hydrogen 2.857 N/A ARG 38.A NH1 ASP 90.A OD2 no hydrogen 3.173 N/A ARG 38.A NH2 ASP 90.A OD2 no hydrogen 3.218 N/A VAL 41.A N ARG 38.A O no hydrogen 2.822 N/A ARG 42.A N PRO 39.A O no hydrogen 3.081 N/A ASN 43.A N ARG 38.A O no hydrogen 2.968 N/A ASN 43.A ND2 ASN 74.A O no hydrogen 3.063 N/A ASN 43.A ND2 ALA 84.A O no hydrogen 2.627 N/A ASN 43.A ND2 PHE 85.A O no hydrogen 3.456 N/A ALA 44.A N VAL 41.A O no hydrogen 3.028 N/A PHE 45.A N GLY 88.A O no hydrogen 2.768 N/A ARG 46.A N THR 49.A OG1 no hydrogen 3.034 N/A ARG 46.A NE ASP 20.A OD2 no hydrogen 2.997 N/A ARG 46.A NH2 ASP 20.A OD1 no hydrogen 3.309 N/A HIS 48.A NE2 THR 19.A OG1 no hydrogen 2.911 N/A THR 49.A OG1 ASP 20.A OD2 no hydrogen 2.571 N/A THR 49.A OG1 ARG 46.A O no hydrogen 3.259 N/A VAL 50.A N ARG 46.A O no hydrogen 3.227 N/A ASP 51.A N PRO 47.A O no hydrogen 3.133 N/A GLU 52.A N HIS 48.A O no hydrogen 3.088 N/A LEU 53.A N THR 49.A O no hydrogen 2.778 N/A TYR 54.A N VAL 50.A O no hydrogen 2.822 N/A ARG 55.A N ASP 51.A O no hydrogen 2.935 N/A ARG 55.A NH1.B ASP 17.A OD1 no hydrogen 3.528 N/A ARG 55.A NH1.B ASP 17.A OD2 no hydrogen 2.818 N/A ARG 55.A NH2.B ASP 17.A OD1 no hydrogen 3.258 N/A VAL 56.A N GLU 52.A O no hydrogen 2.921 N/A LEU 57.A N LEU 53.A O no hydrogen 2.913 N/A ASP 58.A N TYR 54.A O no hydrogen 2.753 N/A HIS 59.A N ARG 55.A O no hydrogen 2.962 N/A HIS 59.A ND1 TYR 23.A OH no hydrogen 2.821 N/A ALA 60.A N VAL 56.A O no hydrogen 2.924 N/A ARG 61.A N LEU 57.A O no hydrogen 2.837 N/A ARG 61.A NE ASP 58.A OD1 no hydrogen 3.091 N/A ARG 61.A NH2 ASP 58.A OD1 no hydrogen 2.878 N/A MET 62.A N ASP 58.A O no hydrogen 3.134 N/A MET 62.A N HIS 59.A O no hydrogen 3.187 N/A SER 63.A N ALA 60.A O no hydrogen 3.157 N/A SER 63.A OG HIS 59.A O no hydrogen 2.765 N/A VAL 66.A N SER 63.A O no hydrogen 2.939 N/A GLY 67.A N ALA 30.A O no hydrogen 2.780 N/A VAL 68.A N ALA 30.A O no hydrogen 3.255 N/A VAL 69.A N VAL 107.A O no hydrogen 3.010 N/A LEU 70.A N VAL 32.A O no hydrogen 2.972 N/A LEU 71.A N ILE 109.A O no hydrogen 2.835 N/A THR 72.A N VAL 34.A O no hydrogen 2.792 N/A THR 72.A OG1 LEU 111.A O no hydrogen 2.696 N/A THR 72.A OG1 ASN 113.A OD1 no hydrogen 3.303 N/A GLY 73.A N ASN 113.A OD1 no hydrogen 3.279 N/A ASN 74.A N PHE 36.A O no hydrogen 2.855 N/A ASN 74.A ND2 THR 22.A OG1 no hydrogen 2.708 N/A ASN 74.A ND2 ASN 37.A OD1 no hydrogen 2.894 N/A SER 77.A N GLY 82.A O no hydrogen 2.876 N/A SER 77.A OG PRO 39.A O no hydrogen 3.515 N/A SER 77.A OG ASP 80.A OD1 no hydrogen 3.138 N/A LYS 79.A N SER 77.A OG no hydrogen 3.118 N/A GLY 81.A N SER 77.A O no hydrogen 2.888 N/A GLY 82.A N ASP 80.A OD1 no hydrogen 2.969 N/A CYS 86.A N TRP 115.A O no hydrogen 3.009 N/A CYS 86.A SG ASN 43.A O no hydrogen 3.329 N/A SER 87.A OG ARG 42.A O no hydrogen 2.893 N/A ASP 90.A N PHE 45.A O no hydrogen 2.618 N/A LEU 92.A N ARG 91.A O no hydrogen 2.254 N/A GLU 96.A N HIS 93.A O no hydrogen 3.055 N/A GLN 98.A N ILE 94.A O no hydrogen 2.910 N/A GLN 98.A NE2 ASP 150.A OD2 no hydrogen 2.924 N/A ARG 99.A N LEU 95.A O no hydrogen 3.232 N/A LEU 100.A N GLU 96.A O no hydrogen 3.056 N/A ILE 101.A N VAL 97.A O no hydrogen 2.909 N/A ARG 102.A N GLN 98.A O no hydrogen 2.753 N/A ARG 102.A NE ASP 228.A OD2 no hydrogen 2.760 N/A ARG 102.A NH2 ASP 228.A OD1 no hydrogen 2.968 N/A ARG 102.A NH2 ASP 228.A OD2 no hydrogen 3.248 N/A PHE 103.A N ARG 99.A O no hydrogen 2.664 N/A MET 104.A N LEU 100.A O no hydrogen 3.023 N/A LYS 106.A NZ ALA 60.A O no hydrogen 2.983 N/A LYS 106.A NZ ARG 61.A O no hydrogen 3.211 N/A LYS 106.A NZ VAL 66.A O no hydrogen 2.744 N/A VAL 108.A N ASP 128.A OD2 no hydrogen 2.915 N/A ILE 109.A N VAL 69.A O no hydrogen 2.755 N/A CYS 110.A N LEU 129.A O no hydrogen 2.774 N/A CYS 110.A SG LEU 71.A O no hydrogen 3.940 N/A LEU 111.A N LEU 71.A O no hydrogen 2.809 N/A VAL 112.A N LEU 131.A O no hydrogen 2.806 N/A ASN 113.A ND2 ALA 84.A O no hydrogen 3.483 N/A TRP 115.A N TRP 83.A O no hydrogen 3.095 N/A ALA 116.A N ARG 138.A O no hydrogen 2.658 N/A ALA 117.A N CYS 86.A O no hydrogen 3.018 N/A GLY 118.A N LYS 140.A O no hydrogen 3.212 N/A GLY 120.A N ALA 117.A O no hydrogen 2.799 N/A HIS 121.A N ALA 117.A O no hydrogen 3.254 N/A SER 122.A N GLY 118.A O no hydrogen 3.070 N/A SER 122.A OG ASP 150.A OD2 no hydrogen 3.258 N/A LEU 123.A N GLY 119.A O no hydrogen 2.971 N/A HIS 124.A N GLY 120.A O no hydrogen 3.417 N/A HIS 124.A ND1 THR 130.A OG1 no hydrogen 2.919 N/A VAL 125.A N HIS 121.A O no hydrogen 3.084 N/A VAL 126.A N SER 122.A O no hydrogen 3.192 N/A CYS 127.A N LEU 123.A O no hydrogen 3.365 N/A CYS 127.A SG LEU 123.A O no hydrogen 3.477 N/A LEU 129.A N VAL 108.A O no hydrogen 3.291 N/A THR 130.A N ASN 189.A OD1 no hydrogen 2.826 N/A THR 130.A OG1 HIS 124.A ND1 no hydrogen 2.919 N/A LEU 131.A N CYS 110.A O no hydrogen 2.793 N/A ALA 132.A N ALA 190.A O no hydrogen 3.030 N/A SER 133.A N VAL 112.A O no hydrogen 2.858 N/A SER 133.A OG HIS 194.A ND1 no hydrogen 2.719 N/A ARG 134.A N ALA 192.A O no hydrogen 2.786 N/A GLU 135.A N GLU 135.A OE1 no hydrogen 2.847 N/A TYR 136.A N SER 133.A OG no hydrogen 2.992 N/A ALA 137.A N SER 133.A O no hydrogen 2.996 N/A ARG 138.A N GLY 114.A O no hydrogen 3.097 N/A ARG 138.A NH1 GLU 135.A O no hydrogen 3.397 N/A ARG 138.A NH1 ALA 137.A O no hydrogen 2.799 N/A ARG 138.A NH2 GLU 135.A O no hydrogen 3.261 N/A PHE 139.A N TYR 177.A O no hydrogen 2.880 N/A LYS 140.A N ALA 116.A O no hydrogen 3.066 N/A LYS 140.A NZ GLY 174.A O no hydrogen 3.017 N/A LYS 140.A NZ THR 176.A OG1 no hydrogen 2.973 N/A GLN 141.A NE2 GLY 118.A O no hydrogen 3.637 N/A ASP 143.A N GLN 141.A OE1 no hydrogen 2.873 N/A ASP 145.A N THR 142.A O no hydrogen 2.885 N/A VAL 146.A N THR 142.A O no hydrogen 3.322 N/A VAL 146.A N ASP 143.A O no hydrogen 3.131 N/A GLY 147.A N ALA 144.A O no hydrogen 3.435 N/A SER 148.A N ASP 143.A O no hydrogen 2.871 N/A ASP 150.A N ASP 143.A OD2 no hydrogen 3.161 N/A GLY 152.A N ASP 150.A OD1 no hydrogen 2.988 N/A TYR 153.A OH ASP 228.A OD1 no hydrogen 2.765 N/A GLY 154.A N ASP 150.A OD1 no hydrogen 3.065 N/A SER 155.A N GLY 152.A O no hydrogen 3.235 N/A SER 155.A OG ASP 150.A O no hydrogen 2.598 N/A TYR 157.A N GLY 152.A O no hydrogen 3.439 N/A ALA 159.A N SER 155.A O no hydrogen 3.191 N/A ALA 159.A N ALA 156.A O no hydrogen 3.089 N/A ARG 160.A N TYR 157.A O no hydrogen 2.937 N/A ARG 160.A NE ASP 227.A OD1 no hydrogen 3.041 N/A GLN 161.A N LEU 158.A O no hydrogen 2.935 N/A GLN 161.A NE2 VAL 125.A O no hydrogen 2.787 N/A VAL 162.A N LEU 158.A O no hydrogen 2.996 N/A GLY 163.A N ALA 159.A O no hydrogen 3.097 N/A ALA 167.A N GLY 163.A O no hydrogen 3.118 N/A ARG 168.A N GLN 164.A O no hydrogen 3.134 N/A ARG 168.A NE GLN 164.A OE1 no hydrogen 2.942 N/A ARG 168.A NH1 GLN 164.A OE1 no hydrogen 3.020 N/A GLU 169.A N LYS 165.A O no hydrogen 3.047 N/A ILE 170.A N PHE 166.A O no hydrogen 2.897 N/A PHE 171.A N ALA 167.A O no hydrogen 3.243 N/A PHE 172.A N ARG 168.A O no hydrogen 2.790 N/A LEU 173.A N GLU 169.A O no hydrogen 3.036 N/A GLY 174.A N ILE 170.A O no hydrogen 3.056 N/A TYR 177.A N PHE 139.A O no hydrogen 2.874 N/A TYR 177.A OH GLU 169.A OE1 no hydrogen 2.491 N/A THR 178.A N GLN 181.A OE1 no hydrogen 2.925 N/A THR 178.A OG1 GLN 181.A OE1 no hydrogen 3.504 N/A GLN 181.A N THR 178.A OG1 no hydrogen 3.226 N/A MET 182.A N THR 178.A O no hydrogen 3.072 N/A HIS 183.A N ALA 179.A O no hydrogen 2.904 N/A HIS 183.A ND1 VAL 188.A O no hydrogen 2.747 N/A GLN 184.A N GLU 180.A O no hydrogen 3.004 N/A GLN 184.A NE2 GLU 180.A OE1 no hydrogen 2.566 N/A MET 185.A N GLN 181.A O no hydrogen 3.028 N/A GLY 186.A N MET 182.A O no hydrogen 3.010 N/A ALA 187.A N MET 182.A O no hydrogen 3.012 N/A VAL 188.A N MET 182.A O no hydrogen 3.199 N/A ASN 189.A N THR 130.A O no hydrogen 2.843 N/A ALA 192.A N ALA 132.A O no hydrogen 2.867 N/A HIS 194.A N GLU 135.A OE1 no hydrogen 2.893 N/A HIS 194.A ND1 SER 133.A OG no hydrogen 2.719 N/A GLU 196.A N GLU 193.A O no hydrogen 2.904 N/A LEU 197.A N HIS 194.A O no hydrogen 3.088 N/A VAL 200.A N GLU 196.A O no hydrogen 2.846 N/A GLY 201.A N LEU 197.A O no hydrogen 3.073 N/A LEU 202.A N GLU 198.A O no hydrogen 2.925 N/A GLN 203.A N THR 199.A O no hydrogen 3.070 N/A GLN 203.A NE2 GLU 207.A OE2 no hydrogen 2.924 N/A TRP 204.A N VAL 200.A O no hydrogen 2.847 N/A ALA 205.A N GLY 201.A O no hydrogen 2.824 N/A ALA 206.A N LEU 202.A O no hydrogen 2.899 N/A GLU 207.A N GLN 203.A O no hydrogen 3.118 N/A ILE 208.A N TRP 204.A O no hydrogen 3.019 N/A ASN 209.A N ALA 205.A O no hydrogen 2.763 N/A ASN 209.A ND2 ALA 30.A O no hydrogen 2.985 N/A LYS 211.A N ILE 208.A O no hydrogen 3.138 N/A ALA 215.A N SER 212.A OG no hydrogen 3.327 N/A GLN 216.A N SER 212.A O no hydrogen 3.100 N/A GLN 216.A NE2 ILE 208.A O no hydrogen 3.220 N/A ARG 217.A N PRO 213.A O no hydrogen 2.998 N/A ARG 217.A NE GLU 239.A OE1 no hydrogen 2.966 N/A MET 218.A N GLN 214.A O no hydrogen 3.102 N/A LEU 219.A N ALA 215.A O no hydrogen 2.872 N/A LYS 220.A N GLN 216.A O no hydrogen 3.026 N/A LYS 220.A NZ ILE 101.A O no hydrogen 2.915 N/A LYS 220.A NZ MET 104.A O no hydrogen 2.936 N/A LYS 220.A NZ LYS 106.A O no hydrogen 2.907 N/A LYS 220.A NZ ASP 128.A OD2 no hydrogen 2.894 N/A PHE 221.A N ARG 217.A O no hydrogen 3.182 N/A ALA 222.A N MET 218.A O no hydrogen 2.804 N/A PHE 223.A N LEU 219.A O no hydrogen 2.864 N/A ASN 224.A N LYS 220.A O no hydrogen 2.947 N/A ASN 224.A ND2 ARG 102.A O no hydrogen 2.935 N/A LEU 225.A N PHE 221.A O no hydrogen 2.837 N/A ASP 227.A N ASN 224.A O no hydrogen 2.940 N/A ASP 228.A N ASN 224.A O no hydrogen 2.890 N/A GLY 232.A N ASP 228.A O no hydrogen 3.019 N/A GLN 233.A N GLY 229.A O no hydrogen 2.928 N/A GLN 234.A N LEU 230.A O no hydrogen 2.840 N/A LEU 235.A N VAL 231.A O no hydrogen 3.046 N/A PHE 236.A N GLY 232.A O no hydrogen 2.989 N/A ALA 237.A N GLN 233.A O no hydrogen 2.745 N/A GLY 238.A N GLN 234.A O no hydrogen 2.718 N/A GLU 239.A N LEU 235.A O no hydrogen 3.178 N/A ALA 240.A N PHE 236.A O no hydrogen 3.067 N/A THR 241.A N ALA 237.A O no hydrogen 2.745 N/A THR 241.A OG1 ALA 237.A O no hydrogen 3.136 N/A ARG 242.A N GLY 238.A O no hydrogen 3.198 N/A ARG 242.A NE GLU 239.A OE1 no hydrogen 3.343 N/A ARG 242.A NH2 GLU 239.A OE2 no hydrogen 2.880 N/A LEU 243.A N GLU 239.A O no hydrogen 2.993 N/A ALA 244.A N ALA 240.A O no hydrogen 2.895 N/A TYR 245.A N THR 241.A O no hydrogen 2.930 N/A MET 246.A N ARG 242.A O no hydrogen 3.280 N/A MET 246.A N LEU 243.A O no hydrogen 3.311 N/A THR 247.A N ALA 244.A O no hydrogen 2.824 N/A VAL 251.A N THR 247.A O no hydrogen 2.909 N/A GLU 252.A N ASP 248.A O no hydrogen 3.148 N/A GLY 253.A N GLU 249.A O no hydrogen 3.232 N/A