Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2r9q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE THR 3.A O no hydrogen 2.949 N/A ARG 1.A NH2 THR 3.A O no hydrogen 3.077 N/A ARG 1.A NH2 THR 3.A OG1 no hydrogen 3.311 N/A GLY 4.A N ILE 162.A O no hydrogen 2.877 N/A ILE 5.A N HIS 321.A O no hydrogen 3.041 N/A LEU 6.A N PHE 160.A O no hydrogen 3.154 N/A ASP 8.A N PRO 33.A O no hydrogen 3.110 N/A GLY 9.A N ASP 8.A OD1 no hydrogen 3.008 N/A ILE 11.A N ALA 7.A O no hydrogen 2.946 N/A ARG 12.A N ASP 8.A O no hydrogen 2.897 N/A ARG 12.A NH2 GLU 327.A OE1 no hydrogen 2.768 N/A ALA 13.A N GLY 9.A O no hydrogen 2.804 N/A LEU 14.A N ALA 10.A O no hydrogen 2.941 N/A PHE 15.A N ILE 11.A O no hydrogen 3.219 N/A ALA 16.A N ARG 12.A O no hydrogen 3.104 N/A GLY 17.A N ALA 13.A O no hydrogen 2.972 N/A ASP 18.A N PHE 15.A O no hydrogen 3.392 N/A LYS 19.A N LEU 14.A O no hydrogen 2.887 N/A LEU 20.A N LEU 14.A O no hydrogen 3.293 N/A LYS 21.A N SER 91.A O no hydrogen 2.944 N/A LYS 21.A NZ ASP 18.A OD1 no hydrogen 3.249 N/A SER 22.A OG ALA 24.A O no hydrogen 3.290 N/A SER 22.A OG GLU 90.A OE2 no hydrogen 3.193 N/A GLU 23.A N MET 89.A O no hydrogen 3.016 N/A ASP 27.A N GLN 30.A OE1 no hydrogen 2.858 N/A GLN 30.A N ASP 27.A O no hydrogen 3.087 N/A GLN 30.A NE2 ASP 37.A O no hydrogen 2.810 N/A GLN 30.A NE2 GLU 90.A OE2 no hydrogen 2.815 N/A GLN 32.A N SER 35.A O no hydrogen 2.736 N/A GLN 32.A NE2 ASP 29.A O no hydrogen 2.937 N/A GLN 32.A NE2 GLN 30.A O no hydrogen 3.284 N/A LEU 36.A N ILE 158.A O no hydrogen 2.830 N/A ASP 37.A N GLN 30.A O no hydrogen 3.131 N/A LEU 38.A N SER 156.A O no hydrogen 2.839 N/A ARG 39.A N GLU 90.A OE1 no hydrogen 2.979 N/A ARG 39.A NE GLU 90.A OE2 no hydrogen 2.675 N/A ARG 39.A NH1 SER 22.A OG no hydrogen 2.883 N/A ARG 39.A NH1 ALA 24.A O no hydrogen 3.276 N/A ARG 39.A NH1 ASP 25.A O no hydrogen 3.489 N/A ARG 39.A NH1 GLU 90.A OE2 no hydrogen 3.143 N/A ARG 39.A NH2 ASP 25.A O no hydrogen 3.109 N/A ARG 39.A NH2 ASP 27.A OD1 no hydrogen 3.122 N/A LEU 40.A N SER 153.A O no hydrogen 2.936 N/A GLY 41.A N PRO 87.A O no hydrogen 3.189 N/A ALA 44.A N VAL 70.A O no hydrogen 2.946 N/A TYR 45.A N ILE 85.A O no hydrogen 2.849 N/A ARG 46.A N HIS 68.A O no hydrogen 2.767 N/A VAL 47.A N VAL 83.A O no hydrogen 2.958 N/A SER 50.A OG GLU 139.A OE1 no hydrogen 2.735 N/A SER 50.A OG GLU 139.A OE2 no hydrogen 2.871 N/A GLY 54.A N ALA 122.A O no hydrogen 3.020 N/A THR 57.A OG1 PRO 53.A O no hydrogen 3.461 N/A THR 57.A OG1 PRO 55.A O no hydrogen 3.285 N/A VAL 59.A N ASP 120.A OD1 no hydrogen 3.040 N/A ASP 61.A N ARG 58.A O no hydrogen 3.177 N/A LYS 62.A N ARG 58.A O no hydrogen 3.353 N/A LYS 62.A NZ MET 52.A O no hydrogen 2.791 N/A LYS 62.A NZ PRO 53.A O no hydrogen 2.925 N/A LEU 63.A N VAL 59.A O no hydrogen 2.912 N/A ASN 64.A N ILE 60.A O no hydrogen 3.150 N/A ARG 65.A N ASP 61.A O no hydrogen 3.346 N/A ARG 65.A N LYS 62.A O no hydrogen 2.981 N/A PHE 66.A N LYS 62.A O no hydrogen 3.426 N/A HIS 68.A N ARG 46.A O no hydrogen 3.223 N/A VAL 70.A N ALA 44.A O no hydrogen 2.713 N/A LEU 72.A N SER 42.A O no hydrogen 2.934 N/A SER 73.A N ASP 71.A OD1 no hydrogen 3.262 N/A SER 73.A OG ASP 71.A OD1 no hydrogen 2.653 N/A GLN 74.A NE2 SER 73.A O no hydrogen 3.589 N/A ALA 76.A N VAL 149.A O no hydrogen 2.973 N/A LEU 78.A N ILE 147.A O no hydrogen 2.685 N/A GLU 79.A N TYR 84.A OH no hydrogen 3.146 N/A GLY 81.A N PRO 142.A O no hydrogen 3.063 N/A CYS 82.A N GLU 79.A O no hydrogen 3.445 N/A CYS 82.A SG THR 80.A O no hydrogen 3.918 N/A TYR 84.A N ILE 140.A O no hydrogen 2.947 N/A ILE 85.A N TYR 45.A O no hydrogen 2.881 N/A VAL 86.A N LEU 138.A O no hydrogen 2.768 N/A LEU 88.A N LEU 136.A O no hydrogen 3.059 N/A MET 89.A N ARG 39.A O no hydrogen 2.962 N/A SER 91.A N LYS 21.A O no hydrogen 2.856 N/A LEU 92.A N GLY 134.A O no hydrogen 3.097 N/A ALA 93.A N LYS 19.A O no hydrogen 2.697 N/A LEU 94.A N TYR 132.A O no hydrogen 2.811 N/A MET 98.A N PRO 95.A O no hydrogen 2.875 N/A SER 99.A N ARG 161.A O no hydrogen 2.902 N/A ALA 100.A N ILE 128.A O no hydrogen 3.088 N/A SER 101.A N ARG 159.A O no hydrogen 3.104 N/A ALA 102.A N ASP 126.A O no hydrogen 3.019 N/A ASN 103.A N GLN 157.A O no hydrogen 3.128 N/A ASN 103.A ND2 GLU 265.A OE2 no hydrogen 3.115 N/A LYS 105.A N LEU 155.A O no hydrogen 3.007 N/A LYS 105.A NZ ASP 37.A OD2 no hydrogen 2.715 N/A THR 108.A OG1 LEU 155.A O no hydrogen 2.648 N/A GLY 109.A N LYS 105.A O no hydrogen 3.171 N/A ARG 110.A N SER 106.A O no hydrogen 3.044 N/A LEU 111.A N THR 108.A O no hydrogen 3.120 N/A ASP 112.A N GLY 109.A O no hydrogen 2.864 N/A ILE 113.A N THR 108.A O no hydrogen 3.284 N/A PHE 114.A N SER 141.A O no hydrogen 2.905 N/A ARG 116.A N GLU 139.A O no hydrogen 3.041 N/A ARG 116.A NH1 THR 115.A O no hydrogen 2.977 N/A VAL 117.A N ASP 126.A OD1 no hydrogen 2.615 N/A MET 118.A N TYR 137.A O no hydrogen 2.754 N/A THR 119.A OG1 ASP 120.A O no hydrogen 3.171 N/A ASP 120.A N TYR 132.A OH no hydrogen 3.013 N/A ASN 121.A N THR 57.A O no hydrogen 2.799 N/A ASP 126.A N VAL 117.A O no hydrogen 2.914 N/A ILE 128.A N ALA 100.A O no hydrogen 2.738 N/A GLY 131.A N MET 98.A O no hydrogen 2.796 N/A TYR 132.A N PRO 129.A O no hydrogen 3.079 N/A TYR 132.A OH PRO 135.A O no hydrogen 2.689 N/A GLY 134.A N LEU 92.A O no hydrogen 2.951 N/A TYR 137.A N MET 118.A O no hydrogen 2.998 N/A LEU 138.A N VAL 86.A O no hydrogen 2.877 N/A GLU 139.A N ARG 116.A O no hydrogen 2.721 N/A ILE 140.A N TYR 84.A O no hydrogen 2.843 N/A SER 141.A N PHE 114.A O no hydrogen 2.779 N/A SER 141.A OG CYS 82.A O no hydrogen 2.662 N/A ARG 143.A N ASP 112.A O no hydrogen 3.100 N/A THR 144.A OG1 ASP 112.A OD2 no hydrogen 2.248 N/A ILE 147.A N LEU 78.A O no hydrogen 2.971 N/A VAL 148.A N VAL 215.A O no hydrogen 2.913 N/A VAL 149.A N ALA 76.A O no hydrogen 3.039 N/A ARG 150.A N SER 153.A OG no hydrogen 2.890 N/A ARG 150.A NE GLN 74.A O no hydrogen 3.603 N/A ARG 150.A NH1 ASP 216.A OD1 no hydrogen 2.901 N/A ARG 150.A NH1 ASP 216.A OD2 no hydrogen 3.410 N/A ARG 150.A NH1 ASP 218.A OD2 no hydrogen 2.825 N/A ARG 150.A NH2 ASP 216.A OD2 no hydrogen 3.128 N/A ARG 151.A N LEU 72.A O no hydrogen 2.914 N/A ARG 151.A NH1 GLU 23.A OE2 no hydrogen 3.236 N/A ARG 151.A NH1 SER 42.A OG no hydrogen 2.958 N/A ARG 151.A NH2 GLU 23.A OE2 no hydrogen 3.516 N/A GLY 152.A N LEU 40.A O no hydrogen 2.831 N/A SER 153.A N ARG 150.A O no hydrogen 2.935 N/A SER 153.A OG ARG 150.A O no hydrogen 3.112 N/A SER 153.A OG ASP 218.A OD1 no hydrogen 2.906 N/A SER 153.A OG ASP 218.A OD2 no hydrogen 3.060 N/A ARG 154.A NE ASP 37.A OD2 no hydrogen 3.214 N/A ARG 154.A NH1 ASP 27.A OD2 no hydrogen 2.961 N/A ARG 154.A NH1 ASP 29.A OD1 no hydrogen 3.058 N/A ARG 154.A NH2 ASP 29.A O no hydrogen 3.194 N/A SER 156.A OG ASN 103.A O no hydrogen 3.215 N/A GLN 157.A N ASN 103.A O no hydrogen 3.109 N/A GLN 157.A NE2 ASP 37.A OD1 no hydrogen 2.934 N/A ILE 158.A N LEU 36.A O no hydrogen 2.759 N/A ARG 159.A N SER 101.A O no hydrogen 2.979 N/A ARG 159.A NE ALA 34.A O no hydrogen 2.931 N/A ARG 159.A NH1 ALA 264.A O no hydrogen 3.180 N/A ARG 159.A NH2 PHE 284.A O no hydrogen 3.142 N/A ARG 161.A N SER 99.A O no hydrogen 3.071 N/A ARG 161.A NE GLU 320.A OE1 no hydrogen 3.344 N/A ARG 161.A NE GLU 320.A OE2 no hydrogen 2.887 N/A ARG 161.A NH1 SER 101.A OG no hydrogen 3.107 N/A ARG 161.A NH2 GLU 320.A OE1 no hydrogen 3.156 N/A ILE 162.A N GLY 4.A O no hydrogen 2.896 N/A LEU 166.A N HIS 164.A O no hydrogen 3.073 N/A LEU 167.A N TYR 319.A O no hydrogen 3.067 N/A SER 170.A N ASN 168.A OD1 no hydrogen 2.737 N/A VAL 172.A N ASN 168.A O no hydrogen 3.282 N/A LEU 173.A N GLU 169.A O no hydrogen 3.418 N/A LYS 174.A N SER 170.A O no hydrogen 2.953 N/A LYS 174.A NZ SER 170.A OG no hydrogen 3.208 N/A LEU 175.A N GLU 171.A O no hydrogen 2.765 N/A HIS 176.A N VAL 172.A O no hydrogen 2.968 N/A GLU 177.A N LYS 174.A O no hydrogen 2.980 N/A THR 178.A N LYS 174.A O no hydrogen 3.340 N/A GLU 179.A N LEU 175.A O no hydrogen 2.930 N/A LEU 181.A N HIS 176.A ND1 no hydrogen 3.171 N/A ALA 183.A N ALA 255.A O no hydrogen 3.052 N/A ILE 189.A N LEU 317.A O no hydrogen 3.148 N/A ALA 190.A N ASN 185.A O no hydrogen 2.706 N/A LEU 191.A N GLY 315.A O no hydrogen 2.997 N/A SER 192.A N GLU 254.A OE1 no hydrogen 2.673 N/A SER 192.A OG GLU 254.A OE1 no hydrogen 3.307 N/A SER 192.A OG GLU 254.A OE2 no hydrogen 2.749 N/A ILE 193.A N GLN 312.A O no hydrogen 3.111 N/A ASP 194.A N VAL 251.A O no hydrogen 3.113 N/A LEU 195.A N HIS 310.A ND1 no hydrogen 3.201 N/A LYS 196.A N ASP 194.A OD1 no hydrogen 3.023 N/A LYS 196.A NZ HIS 310.A NE2 no hydrogen 3.197 N/A LEU 203.A N PHE 198.A O no hydrogen 3.110 N/A ILE 204.A N LEU 232.A O no hydrogen 2.599 N/A GLY 205.A N LEU 232.A O no hydrogen 3.484 N/A TYR 206.A N ILE 249.A O no hydrogen 2.977 N/A ARG 207.A N GLU 230.A O no hydrogen 2.833 N/A ARG 207.A NE GLU 230.A OE1 no hydrogen 3.011 N/A ARG 207.A NH2 GLU 230.A OE1 no hydrogen 2.908 N/A GLY 208.A N PHE 247.A O no hydrogen 3.088 N/A LYS 209.A N PHE 228.A O no hydrogen 3.001 N/A LYS 209.A NZ LEU 226.A O no hydrogen 2.617 N/A HIS 210.A NE2 ASP 245.A O no hydrogen 2.793 N/A THR 212.A OG1 ALA 213.A O no hydrogen 2.871 N/A VAL 215.A N PRO 146.A O no hydrogen 2.875 N/A ASP 216.A N HIS 223.A NE2 no hydrogen 3.308 N/A VAL 217.A N VAL 148.A O no hydrogen 3.106 N/A ASP 218.A N ASP 216.A OD1 no hydrogen 2.921 N/A LYS 219.A N ASP 216.A O no hydrogen 3.157 N/A LYS 220.A NZ SER 107.A OG no hydrogen 3.414 N/A LYS 220.A NZ VAL 217.A O no hydrogen 2.618 N/A GLN 222.A N LYS 219.A O no hydrogen 3.203 N/A HIS 223.A N LYS 220.A O no hydrogen 3.181 N/A ASP 227.A N ASP 224.A O no hydrogen 3.257 N/A PHE 228.A N VAL 225.A O no hydrogen 3.279 N/A TRP 229.A N VAL 225.A O no hydrogen 2.885 N/A GLU 230.A N ARG 207.A O no hydrogen 2.704 N/A LEU 232.A N GLY 205.A O no hydrogen 2.645 N/A ALA 234.A N GLY 202.A O no hydrogen 2.650 N/A LEU 240.A N LEU 308.A O no hydrogen 2.885 N/A LEU 242.A N PHE 306.A O no hydrogen 2.790 N/A ASP 243.A N GLU 246.A OE1 no hydrogen 3.321 N/A GLU 246.A N ASP 243.A O no hydrogen 3.268 N/A TYR 248.A N VAL 299.A O no hydrogen 3.147 N/A ILE 249.A N TYR 206.A O no hydrogen 2.872 N/A LEU 250.A N LEU 297.A O no hydrogen 2.907 N/A SER 252.A N ALA 295.A O no hydrogen 2.947 N/A SER 252.A OG GLU 254.A O no hydrogen 2.778 N/A SER 252.A OG ALA 295.A O no hydrogen 3.494 N/A ARG 253.A N SER 192.A O no hydrogen 2.934 N/A VAL 256.A N SER 293.A O no hydrogen 2.489 N/A HIS 257.A N LEU 181.A O no hydrogen 3.322 N/A HIS 257.A ND1 PHE 288.A O no hydrogen 2.909 N/A VAL 258.A N PHE 288.A O no hydrogen 2.937 N/A TYR 262.A N PRO 259.A O no hydrogen 2.669 N/A ALA 263.A N GLU 320.A O no hydrogen 2.787 N/A ALA 264.A N PHE 284.A O no hydrogen 3.201 N/A GLU 265.A N VAL 318.A O no hydrogen 3.014 N/A MET 266.A N GLY 282.A O no hydrogen 3.319 N/A THR 267.A N ARG 316.A O no hydrogen 2.763 N/A THR 267.A OG1 ARG 316.A O no hydrogen 3.251 N/A LEU 272.A N PHE 269.A O no hydrogen 3.192 N/A VAL 273.A N ASP 270.A O no hydrogen 3.090 N/A GLU 275.A N LEU 272.A O no hydrogen 2.918 N/A PHE 276.A N LEU 272.A O no hydrogen 2.963 N/A ARG 277.A N ARG 300.A O no hydrogen 2.948 N/A HIS 279.A N GLU 298.A O no hydrogen 2.920 N/A TYR 280.A OH ASP 112.A OD1 no hydrogen 2.433 N/A PHE 284.A N ALA 264.A O no hydrogen 2.884 N/A GLY 287.A N VAL 258.A O no hydrogen 2.901 N/A PHE 288.A N ASP 285.A O no hydrogen 3.188 N/A SER 293.A N VAL 256.A O no hydrogen 2.741 N/A ARG 294.A NH1 ASP 194.A OD2 no hydrogen 3.247 N/A ARG 294.A NH1 SER 252.A O no hydrogen 2.774 N/A ALA 295.A N SER 252.A OG no hydrogen 3.136 N/A LEU 297.A N LEU 250.A O no hydrogen 2.660 N/A VAL 299.A N TYR 248.A O no hydrogen 2.988 N/A ARG 300.A N ARG 277.A O no hydrogen 3.126 N/A ARG 300.A NH2 PRO 244.A O no hydrogen 3.376 N/A SER 301.A OG LEU 242.A O no hydrogen 3.112 N/A HIS 302.A N GLU 275.A O no hydrogen 3.323 N/A PHE 306.A N LEU 242.A O no hydrogen 3.029 N/A LEU 308.A N LEU 240.A O no hydrogen 2.917 N/A HIS 310.A N ALA 238.A O no hydrogen 2.973 N/A GLY 311.A N ILE 193.A O no hydrogen 2.949 N/A GLN 312.A N GLU 309.A O no hydrogen 2.855 N/A GLN 312.A NE2 ILE 313.A O no hydrogen 3.259 N/A VAL 314.A N LEU 191.A O no hydrogen 3.036 N/A GLY 315.A N LEU 191.A O no hydrogen 3.354 N/A ARG 316.A N THR 267.A O no hydrogen 2.890 N/A LEU 317.A N ILE 189.A O no hydrogen 2.931 N/A VAL 318.A N GLU 265.A O no hydrogen 3.010 N/A TYR 319.A OH HIS 257.A O no hydrogen 2.584 N/A GLU 320.A N ALA 263.A O no hydrogen 2.767 N/A HIS 321.A N ALA 165.A O no hydrogen 3.045 N/A MET 322.A N LEU 261.A O no hydrogen 2.990 N/A LEU 323.A N ILE 5.A O no hydrogen 3.024 N/A GLU 327.A N ASP 8.A OD1 no hydrogen 3.093 N/A