Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q31_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N GLU 69.A O no hydrogen 3.202 N/A LEU 4.A N PRO 71.A O no hydrogen 2.827 N/A VAL 5.A N GLY 16.A O no hydrogen 2.919 N/A CYS 6.A N LEU 73.A O no hydrogen 2.763 N/A CYS 6.A SG ASN 8.A OD1 no hydrogen 3.660 N/A ASP 7.A N LYS 14.A O no hydrogen 2.942 N/A ASN 8.A N THR 75.A OG1 no hydrogen 3.247 N/A GLY 9.A N LEU 12.A O no hydrogen 2.946 N/A VAL 13.A N PHE 27.A O no hydrogen 2.735 N/A LYS 14.A N ASP 7.A O no hydrogen 2.837 N/A LYS 14.A NZ LEU 12.A O no hydrogen 2.699 N/A ALA 15.A N ALA 25.A O no hydrogen 2.819 N/A GLY 16.A N VAL 5.A O no hydrogen 3.073 N/A ALA 18.A N ALA 3.A O no hydrogen 3.011 N/A GLY 19.A N SER 313.A OG no hydrogen 2.835 N/A ASP 20.A N PHE 17.A O no hydrogen 3.414 N/A ALA 25.A N ALA 15.A O no hydrogen 2.948 N/A PHE 27.A N VAL 13.A O no hydrogen 3.097 N/A SER 29.A N GLY 11.A O no hydrogen 2.966 N/A SER 29.A OG GLY 9.A O no hydrogen 2.881 N/A VAL 31.A N LYS 37.A O no hydrogen 2.908 N/A ARG 33.A N THR 35.A O no hydrogen 2.645 N/A ARG 33.A NH1 ASP 50.A OD2 no hydrogen 3.197 N/A GLU 41.A N ILE 44.A O no hydrogen 2.868 N/A HIS 42.A ND1 GLY 127.A O no hydrogen 2.932 N/A GLY 43.A N SER 10.A OG no hydrogen 2.617 N/A ILE 44.A N GLU 41.A O no hydrogen 2.910 N/A THR 46.A N PRO 39.A O no hydrogen 2.830 N/A THR 46.A OG1 PRO 39.A O no hydrogen 2.910 N/A ASP 50.A N ASN 47.A OD1 no hydrogen 3.275 N/A MET 51.A N ASN 47.A O no hydrogen 3.242 N/A GLU 52.A N TRP 48.A O no hydrogen 2.956 N/A LYS 53.A N ASP 49.A O no hydrogen 3.377 N/A ILE 54.A N ASP 50.A O no hydrogen 3.056 N/A TRP 55.A N MET 51.A O no hydrogen 3.016 N/A TRP 55.A NE1 ASN 8.A OD1 no hydrogen 2.915 N/A HIS 56.A N GLU 52.A O no hydrogen 2.711 N/A HIS 57.A N LYS 53.A O no hydrogen 3.074 N/A THR 58.A N ILE 54.A O no hydrogen 2.835 N/A THR 58.A OG1 ILE 54.A O no hydrogen 2.668 N/A PHE 59.A N TRP 55.A O no hydrogen 3.054 N/A TYR 60.A N HIS 56.A O no hydrogen 3.109 N/A ASN 61.A N HIS 57.A O no hydrogen 2.818 N/A GLU 62.A N HIS 57.A O no hydrogen 2.838 N/A LEU 63.A N THR 58.A O no hydrogen 2.700 N/A VAL 65.A N PHE 59.A O no hydrogen 2.759 N/A GLU 69.A N ALA 66.A O no hydrogen 3.240 N/A HIS 70.A ND1 THR 2.A O no hydrogen 2.462 N/A THR 72.A N ALA 100.A O no hydrogen 3.317 N/A LEU 73.A N LEU 4.A O no hydrogen 3.360 N/A LEU 74.A N TYR 102.A O no hydrogen 2.970 N/A THR 75.A OG1 ASP 7.A OD1 no hydrogen 2.757 N/A GLU 76.A N ALA 104.A O no hydrogen 2.945 N/A ASN 80.A ND2 GLU 76.A OE1 no hydrogen 2.942 N/A ASN 80.A ND2 ASN 84.A OD1 no hydrogen 3.136 N/A ASN 84.A N PRO 81.A O no hydrogen 3.170 N/A ASN 84.A ND2 ILE 45.A O no hydrogen 3.486 N/A ARG 85.A N PRO 81.A O no hydrogen 3.201 N/A ARG 85.A NH1 GLU 76.A OE1 no hydrogen 3.446 N/A ARG 85.A NH1 ASN 80.A O no hydrogen 3.538 N/A GLU 86.A N LYS 82.A O no hydrogen 2.914 N/A LYS 87.A N ALA 83.A O no hydrogen 3.346 N/A MET 88.A N ASN 84.A O no hydrogen 3.241 N/A THR 89.A N ARG 85.A O no hydrogen 3.075 N/A THR 89.A OG1 ARG 85.A O no hydrogen 3.131 N/A GLN 90.A N GLU 86.A O no hydrogen 3.199 N/A ILE 91.A N LYS 87.A O no hydrogen 3.243 N/A MET 92.A N MET 88.A O no hydrogen 3.028 N/A PHE 93.A N THR 89.A O no hydrogen 3.018 N/A GLU 94.A N GLN 90.A O no hydrogen 2.884 N/A THR 95.A N ILE 91.A O no hydrogen 2.964 N/A PHE 96.A N ILE 91.A O no hydrogen 3.161 N/A VAL 98.A N MET 92.A O no hydrogen 2.953 N/A MET 101.A N ILE 326.A O no hydrogen 3.149 N/A TYR 102.A N THR 72.A O no hydrogen 3.402 N/A ALA 104.A N LEU 74.A O no hydrogen 3.076 N/A GLN 106.A N GLU 76.A O no hydrogen 3.006 N/A GLN 106.A NE2 THR 75.A OG1 no hydrogen 3.387 N/A LEU 109.A N ILE 105.A O no hydrogen 3.191 N/A SER 110.A N GLN 106.A O no hydrogen 3.239 N/A SER 110.A OG GLN 106.A O no hydrogen 3.530 N/A SER 110.A OG SER 269.A OG no hydrogen 2.743 N/A LEU 111.A N ALA 107.A O no hydrogen 3.227 N/A TYR 112.A N VAL 108.A O no hydrogen 3.236 N/A ALA 113.A N LEU 109.A O no hydrogen 2.826 N/A SER 114.A N SER 110.A O no hydrogen 3.179 N/A SER 114.A OG LEU 111.A O no hydrogen 2.277 N/A GLY 115.A N LEU 111.A O no hydrogen 3.200 N/A GLY 115.A N TYR 112.A O no hydrogen 2.913 N/A ARG 116.A N LEU 111.A O no hydrogen 3.156 N/A GLY 119.A N ILE 134.A O no hydrogen 2.706 N/A ILE 120.A N ASN 265.A O no hydrogen 3.129 N/A VAL 121.A N VAL 132.A O no hydrogen 2.843 N/A LEU 122.A N VAL 267.A O no hydrogen 2.818 N/A ASP 123.A N HIS 130.A O no hydrogen 3.035 N/A SER 124.A N SER 269.A O no hydrogen 3.169 N/A SER 124.A OG THR 129.A OG1 no hydrogen 2.992 N/A GLY 125.A N VAL 128.A O no hydrogen 3.035 N/A THR 129.A N LEU 147.A O no hydrogen 2.855 N/A THR 129.A OG1 SER 124.A OG no hydrogen 2.992 N/A THR 129.A OG1 LEU 149.A O no hydrogen 2.362 N/A HIS 130.A N ASP 123.A O no hydrogen 3.005 N/A ASN 131.A N MET 145.A O no hydrogen 2.848 N/A VAL 132.A N VAL 121.A O no hydrogen 2.999 N/A ILE 134.A N GLY 119.A O no hydrogen 2.888 N/A TYR 135.A N TYR 138.A O no hydrogen 2.888 N/A GLU 136.A N THR 118.A OG1 no hydrogen 2.765 N/A GLY 137.A N THR 117.A O no hydrogen 2.690 N/A TYR 138.A N TYR 135.A O no hydrogen 2.899 N/A LEU 140.A N PRO 133.A O no hydrogen 2.745 N/A ALA 143.A N LEU 140.A O no hydrogen 3.363 N/A ILE 144.A N PRO 141.A O no hydrogen 3.270 N/A MET 145.A N ASN 131.A O no hydrogen 2.826 N/A ARG 146.A NE ASP 148.A OD1 no hydrogen 2.936 N/A LEU 147.A N THR 129.A O no hydrogen 2.741 N/A GLY 151.A N GLY 125.A O no hydrogen 3.183 N/A ARG 152.A N ASP 126.A O no hydrogen 3.086 N/A ARG 152.A NE ASP 126.A OD2 no hydrogen 3.374 N/A ARG 152.A NH2 SER 10.A O no hydrogen 3.178 N/A ARG 152.A NH2 ASP 126.A OD2 no hydrogen 3.438 N/A LEU 154.A N ALA 150.A O no hydrogen 2.902 N/A THR 155.A N GLY 151.A O no hydrogen 2.627 N/A THR 155.A OG1 GLY 151.A O no hydrogen 2.630 N/A ASP 156.A N ARG 152.A O no hydrogen 2.944 N/A TYR 157.A N ASP 153.A O no hydrogen 2.964 N/A LEU 158.A N LEU 154.A O no hydrogen 3.038 N/A MET 159.A N THR 155.A O no hydrogen 3.142 N/A LYS 160.A N ASP 156.A O no hydrogen 3.133 N/A ILE 161.A N TYR 157.A O no hydrogen 2.945 N/A LEU 162.A N LEU 158.A O no hydrogen 2.890 N/A LEU 162.A N MET 159.A O no hydrogen 3.223 N/A THR 163.A N MET 159.A O no hydrogen 3.141 N/A THR 163.A N LYS 160.A O no hydrogen 3.022 N/A THR 163.A OG1 MET 159.A O no hydrogen 2.889 N/A ARG 165.A N LEU 162.A O no hydrogen 3.243 N/A ARG 165.A NE GLU 222.A OE2 no hydrogen 2.846 N/A GLY 166.A N THR 163.A O no hydrogen 3.215 N/A TYR 167.A N LEU 162.A O no hydrogen 3.297 N/A TYR 167.A OH THR 218.A O no hydrogen 2.694 N/A VAL 170.A N GLU 174.A OE1 no hydrogen 3.171 N/A ARG 175.A N THR 171.A O no hydrogen 2.946 N/A ARG 175.A NH1 ASP 156.A OD1 no hydrogen 3.343 N/A VAL 178.A N GLU 174.A O no hydrogen 3.043 N/A ARG 179.A N ARG 175.A O no hydrogen 2.890 N/A ARG 179.A NE GLU 176.A OE1 no hydrogen 3.190 N/A ARG 179.A NH1 GLU 183.A OE2 no hydrogen 3.282 N/A ARG 179.A NH2 GLU 176.A OE1 no hydrogen 3.320 N/A ASP 180.A N GLU 176.A O no hydrogen 2.860 N/A ILE 181.A N ILE 177.A O no hydrogen 3.082 N/A LYS 182.A N VAL 178.A O no hydrogen 3.040 N/A LYS 182.A NZ GLY 151.A O no hydrogen 2.927 N/A LYS 182.A NZ THR 155.A OG1 no hydrogen 2.751 N/A GLU 183.A N ARG 179.A O no hydrogen 2.860 N/A LYS 184.A N ASP 180.A O no hydrogen 2.722 N/A LYS 184.A NZ ASP 180.A OD1 no hydrogen 3.170 N/A LYS 184.A NZ ASP 180.A OD2 no hydrogen 3.467 N/A LEU 185.A N ILE 181.A O no hydrogen 2.745 N/A TYR 187.A N ARG 223.A O no hydrogen 3.046 N/A TYR 187.A OH GLU 195.A OE2 no hydrogen 2.811 N/A VAL 188.A N PRO 276.A O no hydrogen 2.768 N/A GLU 195.A N ASP 191.A O no hydrogen 3.273 N/A MET 196.A N PHE 192.A O no hydrogen 2.874 N/A ALA 197.A N GLU 193.A O no hydrogen 2.852 N/A THR 198.A N ASN 194.A O no hydrogen 3.009 N/A THR 198.A OG1 ASN 194.A O no hydrogen 3.052 N/A ALA 199.A N GLU 195.A O no hydrogen 2.953 N/A ALA 200.A N MET 196.A O no hydrogen 2.868 N/A SER 201.A N ALA 197.A O no hydrogen 3.123 N/A SER 201.A OG ALA 197.A O no hydrogen 2.798 N/A SER 201.A OG THR 198.A O no hydrogen 3.356 N/A SER 202.A N THR 198.A O no hydrogen 2.866 N/A SER 202.A OG THR 198.A O no hydrogen 2.732 N/A SER 202.A OG SER 204.A OG no hydrogen 3.195 N/A SER 204.A OG SER 202.A OG no hydrogen 3.195 N/A LYS 207.A N ILE 219.A O no hydrogen 3.055 N/A TYR 209.A N ILE 217.A O no hydrogen 2.780 N/A TYR 209.A OH ASP 180.A OD2 no hydrogen 2.503 N/A LEU 211.A N GLN 215.A O no hydrogen 2.821 N/A ASP 213.A N ASP 213.A OD1 no hydrogen 2.620 N/A GLY 214.A N LEU 211.A O no hydrogen 2.814 N/A GLN 215.A NE2 ASP 213.A OD2 no hydrogen 2.839 N/A ILE 217.A N TYR 209.A O no hydrogen 3.020 N/A THR 218.A N TYR 167.A OH no hydrogen 3.144 N/A ILE 219.A N LYS 207.A O no hydrogen 3.087 N/A GLY 220.A N GLU 222.A OE1 no hydrogen 2.783 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.561 N/A ARG 223.A N GLY 220.A O no hydrogen 3.445 N/A ARG 223.A NE LEU 185.A O no hydrogen 3.450 N/A ARG 223.A NH1 LEU 205.A O no hydrogen 2.994 N/A ARG 223.A NH2 LEU 185.A O no hydrogen 3.440 N/A PHE 224.A N ASN 221.A O no hydrogen 3.082 N/A ARG 225.A N ASN 221.A O no hydrogen 2.987 N/A ARG 225.A NH1 GLU 164.A OE2 no hydrogen 3.144 N/A ARG 225.A NH1 ASN 221.A OD1 no hydrogen 3.266 N/A ARG 225.A NH2 GLU 164.A OE2 no hydrogen 3.240 N/A CYS 226.A N GLU 222.A O no hydrogen 3.287 N/A CYS 226.A SG LEU 154.A O no hydrogen 3.472 N/A GLU 228.A N PHE 224.A O no hydrogen 3.237 N/A THR 229.A N CYS 226.A O no hydrogen 3.217 N/A THR 229.A OG1 CYS 226.A O no hydrogen 2.728 N/A LEU 230.A N PRO 227.A O no hydrogen 3.196 N/A PHE 231.A N GLU 228.A O no hydrogen 2.805 N/A GLN 232.A N GLU 228.A O no hydrogen 2.978 N/A GLN 232.A NE2 SER 234.A OG no hydrogen 2.547 N/A PHE 235.A N GLN 232.A O no hydrogen 3.273 N/A ILE 236.A N PRO 233.A O no hydrogen 3.100 N/A GLY 237.A N SER 234.A O no hydrogen 2.998 N/A MET 238.A N PRO 233.A O no hydrogen 3.145 N/A GLY 242.A N GLU 245.A OE2 no hydrogen 2.984 N/A ILE 243.A N LEU 230.A O no hydrogen 3.063 N/A THR 246.A N GLY 242.A O no hydrogen 2.961 N/A THR 246.A OG1 ASN 131.A OD1 no hydrogen 3.050 N/A THR 246.A OG1 GLY 242.A O no hydrogen 2.697 N/A THR 246.A OG1 ILE 243.A O no hydrogen 3.416 N/A THR 247.A N ILE 243.A O no hydrogen 3.077 N/A THR 247.A OG1 ILE 243.A O no hydrogen 2.642 N/A TYR 248.A N HIS 244.A O no hydrogen 3.111 N/A ASN 249.A N GLU 245.A O no hydrogen 2.707 N/A SER 250.A N THR 246.A O no hydrogen 2.880 N/A SER 250.A OG ALA 143.A O no hydrogen 3.078 N/A ILE 251.A N THR 247.A O no hydrogen 3.221 N/A MET 252.A N TYR 248.A O no hydrogen 2.996 N/A LYS 253.A N ASN 249.A O no hydrogen 2.967 N/A LYS 253.A N SER 250.A O no hydrogen 3.223 N/A CYS 254.A N ILE 251.A O no hydrogen 3.195 N/A CYS 254.A SG SER 250.A O no hydrogen 3.276 N/A ARG 259.A NH2 CYS 254.A O no hydrogen 3.303 N/A ASP 261.A N ILE 258.A O no hydrogen 2.956 N/A LEU 262.A N ILE 258.A O no hydrogen 2.891 N/A TYR 263.A N ARG 259.A O no hydrogen 2.940 N/A ALA 264.A N LYS 260.A O no hydrogen 3.235 N/A ASN 265.A N LEU 262.A O no hydrogen 2.823 N/A ASN 266.A N LYS 297.A O no hydrogen 3.139 N/A ASN 266.A ND2 LYS 297.A O no hydrogen 3.326 N/A VAL 267.A N ILE 120.A O no hydrogen 3.265 N/A MET 268.A N ILE 299.A O no hydrogen 2.952 N/A SER 269.A N LEU 122.A O no hydrogen 2.663 N/A SER 269.A OG SER 110.A OG no hydrogen 2.743 N/A GLY 270.A N ARG 304.A O no hydrogen 2.958 N/A THR 272.A N SER 124.A O no hydrogen 3.217 N/A THR 272.A OG1 GLY 125.A O no hydrogen 2.472 N/A THR 273.A N GLY 270.A O no hydrogen 2.888 N/A THR 273.A OG1 SER 269.A O no hydrogen 2.975 N/A THR 273.A OG1 GLY 270.A O no hydrogen 2.605 N/A MET 274.A N GLY 271.A O no hydrogen 2.983 N/A ILE 278.A N TYR 275.A O no hydrogen 3.299 N/A ARG 281.A NE GLU 285.A OE2 no hydrogen 3.263 N/A ARG 281.A NH1 GLU 228.A OE1 no hydrogen 3.158 N/A ARG 281.A NH1 GLU 228.A OE2 no hydrogen 3.178 N/A ARG 281.A NH2 GLU 228.A OE2 no hydrogen 2.952 N/A ARG 281.A NH2 GLU 285.A OE2 no hydrogen 3.122 N/A MET 282.A N ILE 278.A O no hydrogen 2.921 N/A GLN 283.A N ALA 279.A O no hydrogen 3.011 N/A GLN 283.A NE2 ILE 296.A O no hydrogen 3.038 N/A LYS 284.A N ASP 280.A O no hydrogen 3.241 N/A LYS 284.A NZ LEU 190.A O no hydrogen 2.807 N/A GLU 285.A N ARG 281.A O no hydrogen 2.825 N/A ILE 286.A N MET 282.A O no hydrogen 3.131 N/A THR 287.A N GLN 283.A O no hydrogen 2.913 N/A THR 287.A OG1 GLN 283.A O no hydrogen 2.354 N/A ALA 288.A N LYS 284.A O no hydrogen 3.282 N/A LEU 289.A N GLU 285.A O no hydrogen 3.452 N/A ALA 290.A N ILE 286.A O no hydrogen 2.987 N/A LYS 297.A N TYR 263.A O no hydrogen 3.133 N/A ILE 299.A N ASN 266.A O no hydrogen 2.771 N/A ARG 304.A NE THR 273.A O no hydrogen 2.931 N/A ARG 304.A NH1 PRO 301.A O no hydrogen 3.014 N/A ARG 304.A NH2 THR 273.A O no hydrogen 3.040 N/A TYR 306.A N GLU 303.A O no hydrogen 3.287 N/A SER 307.A OG GLU 303.A O no hydrogen 3.496 N/A TRP 309.A NE1 VAL 5.A O no hydrogen 3.100 N/A ILE 310.A N TYR 306.A O no hydrogen 2.925 N/A GLY 311.A N SER 307.A O no hydrogen 2.881 N/A GLY 312.A N VAL 308.A O no hydrogen 3.236 N/A GLY 312.A N TRP 309.A O no hydrogen 2.971 N/A SER 313.A N TRP 309.A O no hydrogen 3.024 N/A SER 313.A OG ASP 20.A O no hydrogen 3.076 N/A ILE 314.A N ILE 310.A O no hydrogen 3.181 N/A LEU 315.A N GLY 311.A O no hydrogen 3.140 N/A ALA 316.A N GLY 312.A O no hydrogen 2.818 N/A SER 317.A OG SER 313.A O no hydrogen 2.578 N/A LEU 318.A N LEU 315.A O no hydrogen 3.083 N/A GLN 322.A NE2 ALA 316.A O no hydrogen 2.641 N/A GLN 322.A NE2 LEU 318.A O no hydrogen 2.657 N/A GLN 323.A NE2 THR 320.A O no hydrogen 3.133 N/A MET 324.A N PHE 321.A O no hydrogen 2.706 N/A TRP 325.A N GLN 322.A O no hydrogen 3.427 N/A TRP 325.A NE1 GLN 322.A OE1 no hydrogen 3.085 N/A ILE 326.A N MET 101.A O no hydrogen 3.214 N/A LYS 328.A N PRO 99.A O no hydrogen 2.880 N/A LYS 328.A NZ PHE 93.A O no hydrogen 2.770 N/A GLU 330.A N THR 327.A OG1 no hydrogen 3.145 N/A TYR 331.A N THR 327.A O no hydrogen 2.966 N/A TYR 331.A OH GLU 94.A OE2 no hydrogen 2.608 N/A ASP 332.A N LYS 328.A O no hydrogen 2.721 N/A GLU 333.A N GLN 329.A O no hydrogen 2.835 N/A ALA 334.A N GLU 330.A O no hydrogen 2.671 N/A GLY 335.A N TYR 331.A O no hydrogen 2.546 N/A