Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xa9_a.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 2.A N GLN 120.A OE1 no hydrogen 2.611 N/A ALA 3.A N GLN 6.A OE1 no hydrogen 2.625 N/A GLN 5.A NE2 GLN 8.A OE1 no hydrogen 3.156 N/A ILE 7.A N ALA 3.A O no hydrogen 2.933 N/A GLN 8.A N PRO 4.A O no hydrogen 2.860 N/A GLN 8.A NE2 LEU 181.A O no hydrogen 2.946 N/A GLU 9.A N GLN 5.A O no hydrogen 2.774 N/A ARG 10.A N GLN 6.A O no hydrogen 3.121 N/A ARG 10.A NH1 ARG 10.A O no hydrogen 2.930 N/A ARG 10.A NH1 GLU 14.A OE2 no hydrogen 2.691 N/A ARG 10.A NH2 GLU 14.A OE2 no hydrogen 3.535 N/A LEU 11.A N ILE 7.A O no hydrogen 3.080 N/A LYS 12.A N GLN 8.A O no hydrogen 2.759 N/A LYS 12.A NZ GLU 9.A OE2 no hydrogen 3.174 N/A GLN 13.A N GLU 9.A O no hydrogen 3.167 N/A GLN 13.A N ARG 10.A O no hydrogen 3.290 N/A GLU 14.A N LEU 11.A O no hydrogen 3.109 N/A GLN 15.A N LYS 12.A O no hydrogen 3.101 N/A GLN 15.A NE2 THR 221.A OG1 no hydrogen 2.913 N/A TYR 16.A OH HIS 106.A ND1 no hydrogen 2.833 N/A TYR 16.A OH SER 107.A OG.A no hydrogen 2.910 N/A GLN 17.A N GLN 17.A OE1 no hydrogen 2.655 N/A GLN 17.A NE2 GLN 15.A OE1 no hydrogen 2.732 N/A LYS 18.A N GLN 15.A O no hydrogen 2.877 N/A PHE 19.A N TYR 16.A O no hydrogen 3.149 N/A VAL 20.A N ARG 96.A O no hydrogen 2.680 N/A ALA 22.A N SER 98.A O no hydrogen 2.859 N/A ILE 24.A N VAL 21.A O no hydrogen 3.170 N/A ASN 26.A N ASP 23.A O no hydrogen 2.998 N/A PHE 27.A N ASP 23.A O no hydrogen 2.845 N/A CYS 30.A N PHE 27.A O no hydrogen 3.004 N/A CYS 30.A SG TYR 190.A OH no hydrogen 3.603 N/A LEU 31.A N PRO 28.A O no hydrogen 3.300 N/A THR 34.A OG1 GLY 174.A O no hydrogen 2.607 N/A GLU 36.A N GLU 36.A OE1 no hydrogen 2.721 N/A GLY 37.A N THR 34.A OG1 no hydrogen 2.939 N/A ILE 38.A N THR 34.A O no hydrogen 3.004 N/A ALA 39.A N PRO 35.A O no hydrogen 3.043 N/A SER 40.A N GLU 36.A O no hydrogen 2.988 N/A SER 40.A OG GLN 17.A O no hydrogen 3.320 N/A SER 40.A OG GLU 36.A O no hydrogen 3.075 N/A SER 40.A OG GLY 173.A O no hydrogen 2.778 N/A GLY 41.A N GLY 37.A O no hydrogen 3.031 N/A GLN 42.A N ILE 38.A O no hydrogen 3.187 N/A ARG 43.A N ALA 39.A O no hydrogen 2.865 N/A ARG 43.A NH1 GLN 17.A O no hydrogen 2.947 N/A ARG 43.A NH1 PHE 19.A O no hydrogen 2.787 N/A ARG 43.A NH1 SER 40.A OG no hydrogen 3.345 N/A ARG 43.A NH2 GLN 17.A O no hydrogen 3.197 N/A TYR 44.A N SER 40.A O no hydrogen 3.045 N/A GLN 45.A N GLY 41.A O no hydrogen 3.133 N/A LYS 46.A N GLN 42.A O no hydrogen 3.167 N/A LYS 46.A NZ ASP 91.A OD2 no hydrogen 2.300 N/A TYR 47.A N ARG 43.A O no hydrogen 2.976 N/A SER 48.A N TYR 44.A O no hydrogen 2.655 N/A THR 49.A N GLN 45.A O no hydrogen 3.113 N/A THR 49.A OG1 GLN 45.A O no hydrogen 3.190 N/A THR 49.A OG1 LYS 46.A O no hydrogen 3.210 N/A ASN 50.A N TYR 47.A O no hydrogen 3.050 N/A LEU 52.A N ASN 50.A OD1 no hydrogen 3.000 N/A SER 53.A N ASN 50.A O no hydrogen 2.965 N/A SER 53.A OG TYR 47.A O no hydrogen 3.082 N/A SER 53.A OG ASN 50.A O no hydrogen 2.550 N/A ARG 54.A N SER 51.A O no hydrogen 3.087 N/A ARG 54.A NH2 SER 48.A O no hydrogen 2.651 N/A THR 55.A N LEU 52.A O no hydrogen 3.150 N/A THR 55.A OG1 LEU 52.A O no hydrogen 2.620 N/A SER 59.A N THR 55.A O no hydrogen 3.123 N/A TRP 61.A N PRO 57.A O no hydrogen 2.945 N/A GLY 62.A N PHE 58.A O no hydrogen 3.208 N/A ALA 63.A N GLN 60.A O no hydrogen 2.864 N/A LYS 70.A NZ THR 68.A O no hydrogen 3.143 N/A SER 71.A N GLU 74.A OE1 no hydrogen 3.122 N/A ALA 72.A N ASP 206.A OD2 no hydrogen 2.889 N/A GLN 73.A NE2 GLN 216.A OE1 no hydrogen 3.194 N/A GLU 74.A N SER 71.A O no hydrogen 3.170 N/A TYR 75.A N ALA 72.A O no hydrogen 3.047 N/A TYR 75.A OH PRO 69.A O no hydrogen 2.607 N/A ILE 76.A N ALA 72.A O no hydrogen 3.210 N/A LYS 77.A N GLN 73.A O no hydrogen 2.769 N/A PHE 78.A N GLU 74.A O no hydrogen 2.812 N/A ALA 79.A N TYR 75.A O no hydrogen 3.040 N/A GLN 80.A N ILE 76.A O no hydrogen 2.970 N/A GLN 80.A NE2 GLN 216.A O no hydrogen 3.274 N/A GLN 81.A N LYS 77.A O no hydrogen 2.910 N/A ARG 82.A N PHE 78.A O no hydrogen 3.112 N/A ARG 82.A NE VAL 97.A O no hydrogen 2.767 N/A ARG 82.A NH2 VAL 97.A O no hydrogen 3.306 N/A ASN 83.A N ALA 79.A O no hydrogen 3.254 N/A ASN 83.A N GLN 80.A O no hydrogen 3.357 N/A ASN 83.A ND2 GLU 14.A OE1 no hydrogen 2.743 N/A LYS 84.A NZ GLN 81.A OE1 no hydrogen 2.924 N/A ILE 90.A N GLU 93.A O no hydrogen 2.853 N/A GLU 93.A N ILE 90.A O no hydrogen 3.034 N/A ARG 96.A NH1 GLU 14.A O no hydrogen 2.961 N/A ARG 96.A NH1 ASN 83.A OD1 no hydrogen 3.110 N/A ARG 96.A NH2 GLU 14.A O no hydrogen 2.759 N/A SER 98.A N VAL 20.A O no hydrogen 3.127 N/A SER 98.A OG ASN 102.A OD1 no hydrogen 2.143 N/A GLU 99.A N ASN 102.A OD1 no hydrogen 2.819 N/A CYS 100.A N ASP 23.A OD2 no hydrogen 2.859 N/A CYS 100.A SG LEU 135.A O no hydrogen 3.402 N/A SER 101.A N GLU 99.A OE1 no hydrogen 3.342 N/A SER 101.A N GLU 99.A OE2 no hydrogen 3.467 N/A SER 101.A OG GLU 99.A OE1 no hydrogen 3.079 N/A SER 101.A OG GLU 99.A OE2 no hydrogen 2.969 N/A ASN 102.A N GLU 99.A OE1 no hydrogen 2.969 N/A ASN 102.A ND2 TRP 61.A O no hydrogen 3.317 N/A PHE 103.A N GLU 99.A O no hydrogen 3.039 N/A TYR 105.A N ASN 102.A O no hydrogen 2.981 N/A TYR 105.A OH GLN 65.A O no hydrogen 3.259 N/A HIS 106.A N PHE 103.A O no hydrogen 3.220 N/A HIS 106.A ND1 TYR 16.A OH no hydrogen 2.833 N/A HIS 106.A NE2 ASN 83.A OD1 no hydrogen 2.970 N/A SER 107.A OG.A TYR 16.A OH no hydrogen 2.910 N/A SER 107.A OG.B ALA 104.A O no hydrogen 2.811 N/A SER 107.A OG.B THR 139.A OG1 no hydrogen 3.277 N/A ALA 108.A N ALA 104.A O no hydrogen 3.020 N/A GLY 109.A N TYR 105.A O no hydrogen 2.977 N/A VAL 110.A N HIS 106.A O no hydrogen 3.000 N/A LEU 111.A N SER 107.A O no hydrogen 2.828 N/A LEU 112.A N ALA 108.A O no hydrogen 2.804 N/A ASP 113.A N VAL 110.A O no hydrogen 3.292 N/A ASP 114.A N LEU 111.A O no hydrogen 3.289 N/A GLN 116.A N ASP 114.A OD1 no hydrogen 3.074 N/A ILE 117.A N ASP 114.A OD1 no hydrogen 3.330 N/A ARG 118.A N ASP 114.A O no hydrogen 3.278 N/A ARG 118.A NH1 THR 212.A O no hydrogen 2.638 N/A ARG 118.A NH2 LEU 112.A O no hydrogen 2.655 N/A ARG 118.A NH2 ARG 213.A O no hydrogen 3.491 N/A THR 119.A OG1 GLN 116.A O no hydrogen 2.935 N/A GLN 120.A N GLN 116.A O no hydrogen 3.242 N/A GLN 120.A NE2 ILE 2.A O no hydrogen 3.329 N/A TYR 121.A N ILE 117.A O no hydrogen 2.619 N/A ASP 122.A N VAL 142.A O no hydrogen 2.627 N/A VAL 123.A N SER 203.A OG.B no hydrogen 2.671 N/A ALA 124.A N LEU 140.A O no hydrogen 2.973 N/A VAL 125.A N TYR 201.A O no hydrogen 2.939 N/A ILE 126.A N ILE 138.A O no hydrogen 2.746 N/A GLY 127.A N THR 198.A O no hydrogen 2.780 N/A SER 128.A N HIS 136.A O no hydrogen 2.539 N/A SER 128.A OG SER 193.A O no hydrogen 2.963 N/A SER 128.A OG LEU 194.A O no hydrogen 2.700 N/A SER 130.A N ARG 133.A O no hydrogen 2.670 N/A GLY 132.A N HIS 129.A NE2 no hydrogen 3.146 N/A ARG 133.A N SER 130.A O no hydrogen 3.051 N/A HIS 136.A N SER 128.A O no hydrogen 3.079 N/A HIS 136.A NE2 ASP 168.A OD1 no hydrogen 3.094 N/A ASN 137.A N CYS 100.A O no hydrogen 3.262 N/A ASN 137.A ND2 SER 101.A O no hydrogen 2.650 N/A ILE 138.A N ILE 126.A O no hydrogen 2.800 N/A THR 139.A N VAL 167.A O no hydrogen 3.140 N/A THR 139.A OG1 ALA 104.A O no hydrogen 2.612 N/A THR 139.A OG1 SER 107.A OG.B no hydrogen 3.277 N/A LEU 140.A N ALA 124.A O no hydrogen 2.676 N/A LEU 141.A N LEU 165.A O no hydrogen 2.852 N/A VAL 142.A N ASP 122.A O no hydrogen 2.851 N/A LYS 144.A N GLN 120.A O no hydrogen 3.166 N/A SER 146.A N PRO 143.A O no hydrogen 3.354 N/A GLN 153.A N GLN 150.A O no hydrogen 2.948 N/A GLN 154.A NE2 TYR 134.A OH no hydrogen 2.761 N/A LEU 155.A N ALA 197.A O no hydrogen 2.721 N/A VAL 159.A N THR 156.A O no hydrogen 3.122 N/A PHE 160.A N ALA 157.A O no hydrogen 3.286 N/A THR 164.A N PRO 161.A O no hydrogen 3.259 N/A THR 164.A OG1 PRO 161.A O no hydrogen 2.611 N/A LEU 165.A N LEU 141.A O no hydrogen 2.888 N/A ILE 166.A N ILE 183.A O no hydrogen 2.755 N/A VAL 167.A N THR 139.A O no hydrogen 2.855 N/A ASP 168.A N ALA 180.A O no hydrogen 2.699 N/A TRP 170.A NE1 ASP 23.A OD1 no hydrogen 3.079 N/A ALA 171.A N ASP 168.A OD1 no hydrogen 3.355 N/A GLY 173.A N PRO 169.A O no hydrogen 2.745 N/A HIS 175.A N ALA 171.A O no hydrogen 2.912 N/A HIS 175.A ND1 GLN 179.A OE1 no hydrogen 3.202 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.683 N/A GLN 179.A N PRO 176.A O no hydrogen 2.875 N/A ALA 180.A N PRO 177.A O no hydrogen 3.062 N/A LEU 181.A N PRO 177.A O no hydrogen 2.839 N/A ALA 182.A N ILE 166.A O no hydrogen 2.825 N/A ILE 183.A N ILE 166.A O no hydrogen 3.192 N/A LYS 185.A NZ GLU 186.A OE2 no hydrogen 2.997 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.824 N/A GLN 187.A N PRO 184.A O no hydrogen 2.985 N/A PHE 188.A N LYS 185.A O no hydrogen 3.067 N/A ALA 189.A N GLN 179.A O no hydrogen 2.829 N/A ASN 191.A N PHE 188.A O no hydrogen 3.062 N/A SER 193.A N TYR 190.A O no hydrogen 3.032 N/A SER 193.A OG TYR 190.A O no hydrogen 3.249 N/A LEU 194.A N ASN 191.A O no hydrogen 3.404 N/A ALA 197.A N LEU 155.A O no hydrogen 2.956 N/A THR 198.A N GLY 127.A O no hydrogen 2.943 N/A ASN 200.A N VAL 125.A O no hydrogen 3.003 N/A TYR 201.A N VAL 125.A O no hydrogen 3.191 N/A TYR 201.A OH ASP 206.A OD2 no hydrogen 2.892 N/A GLN 202.A NE2 LEU 148.A O no hydrogen 3.135 N/A SER 203.A N VAL 123.A O no hydrogen 2.731 N/A SER 203.A OG.B VAL 123.A O no hydrogen 3.248 N/A LEU 205.A N GLN 202.A O no hydrogen 2.931 N/A ASP 206.A N SER 203.A O no hydrogen 3.129 N/A SER 208.A N ASP 206.A OD1 no hydrogen 3.262 N/A SER 208.A OG ASP 206.A OD1 no hydrogen 2.740 N/A SER 208.A OG ASP 206.A OD2 no hydrogen 3.247 N/A LEU 209.A N ASP 206.A O no hydrogen 3.158 N/A SER 211.A OG SER 208.A O no hydrogen 2.949 N/A THR 212.A N LEU 209.A O no hydrogen 2.933 N/A THR 212.A OG1 SER 208.A O no hydrogen 2.625 N/A GLY 215.A N ASP 113.A O no hydrogen 2.745 N/A GLN 216.A N ASP 113.A OD1 no hydrogen 2.721 N/A GLN 216.A NE2 GLN 73.A OE1 no hydrogen 3.093 N/A GLN 216.A NE2 ARG 213.A O no hydrogen 3.207 N/A LEU 217.A N ASP 113.A OD2 no hydrogen 3.060 N/A TYR 220.A N GLU 14.A OE2 no hydrogen 3.069 N/A THR 221.A OG1 GLN 13.A O no hydrogen 2.672 N/A THR 223.A OG1 PRO 224.A O no hydrogen 3.405 N/A