Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3d1q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 8.A N PRO 5.A O no hydrogen 2.908 N/A TYR 9.A N GLU 278.A OE2 no hydrogen 2.890 N/A ARG 11.A N SER 8.A O no hydrogen 2.981 N/A ALA 12.A N TYR 9.A O no hydrogen 2.926 N/A GLU 13.A N ALA 10.A O no hydrogen 2.990 N/A ARG 14.A NE ASP 17.A OD2 no hydrogen 3.125 N/A ARG 14.A NH1 ASP 17.A OD1 no hydrogen 2.806 N/A ARG 14.A NH1 ASP 17.A OD2 no hydrogen 3.334 N/A GLN 16.A N GLN 16.A OE1 no hydrogen 2.894 N/A ASP 17.A N ARG 14.A O no hydrogen 2.944 N/A PHE 18.A N PRO 15.A O no hydrogen 2.956 N/A PHE 21.A N TYR 116.A O no hydrogen 2.777 N/A VAL 22.A N TYR 116.A O no hydrogen 3.440 N/A ARG 24.A N SER 114.A O no hydrogen 2.708 N/A LEU 25.A N ALA 150.A O no hydrogen 2.951 N/A ASP 26.A N PRO 112.A O no hydrogen 2.886 N/A ASN 27.A ND2 ALA 74.A O no hydrogen 3.228 N/A GLY 29.A N ASN 27.A OD1 no hydrogen 2.846 N/A LYS 30.A N ASP 28.A OD1 no hydrogen 2.891 N/A ARG 35.A N SER 73.A OG no hydrogen 2.850 N/A ARG 35.A NH2 LEU 33.A O no hydrogen 2.754 N/A ASN 36.A ND2 ALA 221.A O no hydrogen 2.986 N/A ARG 38.A N GLY 71.A O no hydrogen 3.085 N/A ARG 38.A NH1 ASN 36.A O no hydrogen 2.848 N/A ARG 38.A NH1 GLY 222.A O no hydrogen 3.107 N/A ARG 38.A NH2 GLY 222.A O no hydrogen 3.259 N/A THR 39.A N ASP 42.A OD2 no hydrogen 2.800 N/A THR 39.A OG1 ASP 42.A OD1 no hydrogen 2.673 N/A SER 40.A N ILE 69.A O no hydrogen 2.841 N/A SER 40.A OG ILE 69.A O no hydrogen 3.286 N/A ALA 41.A N THR 39.A OG1 no hydrogen 2.972 N/A ASP 42.A N THR 39.A O no hydrogen 3.051 N/A ARG 45.A N GLU 252.A O no hydrogen 2.842 N/A GLU 48.A N HIS 251.A NE2 no hydrogen 3.031 N/A PHE 51.A N GLU 48.A O no hydrogen 3.139 N/A HIS 52.A N LYS 49.A O no hydrogen 2.827 N/A HIS 52.A ND1 LYS 50.A O no hydrogen 3.111 N/A ASP 54.A N TYR 248.A OH no hydrogen 3.029 N/A ALA 56.A N ASP 54.A OD1 no hydrogen 2.753 N/A TYR 57.A N ASP 54.A O no hydrogen 3.059 N/A TYR 57.A N ASP 54.A OD1 no hydrogen 3.280 N/A TYR 57.A OH ASP 245.A OD1 no hydrogen 2.796 N/A SER 60.A N ASP 245.A OD1 no hydrogen 3.039 N/A ARG 61.A NH1 ASP 42.A O no hydrogen 2.836 N/A ARG 61.A NH2 ASP 42.A O no hydrogen 2.890 N/A GLU 62.A N SER 60.A OG no hydrogen 3.023 N/A MET 64.A N ARG 61.A O no hydrogen 2.924 N/A LEU 67.A N MET 64.A O no hydrogen 3.140 N/A ILE 69.A N SER 40.A OG no hydrogen 3.036 N/A SER 70.A N LEU 215.A O no hydrogen 2.896 N/A SER 70.A OG HIS 216.A ND1 no hydrogen 2.624 N/A GLY 71.A N ARG 38.A O no hydrogen 2.940 N/A SER 72.A N PHE 217.A O no hydrogen 3.037 N/A SER 72.A OG SER 73.A O no hydrogen 2.720 N/A SER 72.A OG HIS 216.A NE2 no hydrogen 2.963 N/A SER 73.A N ARG 35.A O no hydrogen 2.840 N/A SER 73.A OG ARG 35.A O no hydrogen 3.370 N/A SER 73.A OG ALA 74.A O no hydrogen 2.948 N/A ALA 74.A N GLU 220.A O no hydrogen 2.864 N/A THR 76.A N GLN 79.A OE1 no hydrogen 2.868 N/A GLN 79.A N THR 76.A OG1 no hydrogen 3.046 N/A GLN 79.A NE2 ASN 27.A OD1 no hydrogen 3.005 N/A GLN 79.A NE2 GLU 31.A O no hydrogen 2.900 N/A LEU 80.A N THR 76.A O no hydrogen 3.026 N/A LYS 81.A N PRO 77.A O no hydrogen 3.098 N/A ASN 82.A N ALA 78.A O no hydrogen 3.124 N/A ASN 82.A ND2 ALA 32.A O no hydrogen 2.769 N/A VAL 83.A N GLN 79.A O no hydrogen 2.997 N/A ALA 84.A N LEU 80.A O no hydrogen 2.845 N/A ALA 85.A N LYS 81.A O no hydrogen 2.993 N/A LYS 86.A N ASN 82.A O no hydrogen 3.059 N/A LEU 87.A N VAL 83.A O no hydrogen 2.821 N/A ARG 88.A N ALA 84.A O no hydrogen 2.894 N/A ARG 88.A NH1 THR 91.A O no hydrogen 2.992 N/A ARG 88.A NH1 GLY 93.A O no hydrogen 2.936 N/A ARG 88.A NH2 GLY 93.A O no hydrogen 3.355 N/A GLU 89.A N LYS 86.A O no hydrogen 3.109 N/A LYS 90.A N LEU 87.A O no hydrogen 2.786 N/A THR 91.A OG1 ASP 212.A O no hydrogen 3.498 N/A GLY 93.A N THR 91.A OG1 no hydrogen 2.988 N/A TYR 96.A N TRP 214.A O no hydrogen 2.880 N/A ASP 97.A N ARG 182.A O no hydrogen 2.721 N/A VAL 98.A N HIS 216.A O no hydrogen 2.833 N/A ASP 99.A N PHE 184.A O no hydrogen 2.984 N/A LEU 100.A N HIS 218.A O no hydrogen 3.017 N/A ARG 101.A N ASP 99.A OD1 no hydrogen 3.004 N/A ARG 101.A NE GLU 103.A OE1 no hydrogen 2.722 N/A ARG 101.A NH1 ASP 26.A OD2 no hydrogen 2.869 N/A ARG 101.A NH2 ASP 26.A OD1 no hydrogen 3.116 N/A ARG 101.A NH2 ASP 26.A OD2 no hydrogen 3.380 N/A ARG 101.A NH2 GLU 103.A OE1 no hydrogen 3.384 N/A GLN 102.A N ALA 188.A O no hydrogen 2.951 N/A GLN 102.A NE2 LYS 126.A O no hydrogen 3.635 N/A GLU 103.A N GLU 103.A OE2 no hydrogen 2.750 N/A SER 104.A OG ASP 134.A OD1 no hydrogen 2.614 N/A HIS 105.A N GLU 135.A OE1 no hydrogen 2.770 N/A HIS 105.A ND1 GLU 103.A O no hydrogen 2.876 N/A HIS 105.A NE2 ASP 99.A OD2 no hydrogen 2.580 N/A GLY 106.A N VAL 113.A O no hydrogen 2.947 N/A TYR 107.A N GLN 170.A O no hydrogen 2.882 N/A LEU 108.A N ILE 111.A O no hydrogen 2.942 N/A ASP 109.A N LYS 168.A O no hydrogen 2.869 N/A ILE 111.A N LEU 108.A O no hydrogen 2.788 N/A VAL 113.A N GLY 106.A O no hydrogen 2.898 N/A SER 114.A N ARG 24.A O no hydrogen 2.958 N/A SER 114.A OG ASP 26.A OD1 no hydrogen 2.661 N/A TRP 115.A N SER 104.A O no hydrogen 2.867 N/A TYR 116.A N VAL 22.A O no hydrogen 2.878 N/A ARG 119.A NH1 GLU 13.A OE2 no hydrogen 3.381 N/A ASP 120.A N GLY 117.A O no hydrogen 2.681 N/A TRP 121.A N GLU 118.A O no hydrogen 3.223 N/A TRP 121.A NE1 ASP 190.A O no hydrogen 2.871 N/A ASN 123.A ND2 GLN 102.A O no hydrogen 2.913 N/A ASN 123.A ND2 SER 104.A OG no hydrogen 2.967 N/A LEU 124.A N TRP 121.A O no hydrogen 3.101 N/A LYS 126.A N ASN 123.A O no hydrogen 3.025 N/A LYS 126.A NZ ASN 123.A OD1 no hydrogen 2.951 N/A SER 127.A N GLU 130.A OE2 no hydrogen 2.885 N/A GLN 128.A NE2 ARG 185.A O no hydrogen 2.934 N/A GLU 130.A N SER 127.A OG no hydrogen 3.085 N/A ALA 131.A N SER 127.A O no hydrogen 2.907 N/A LEU 132.A N GLN 128.A O no hydrogen 2.914 N/A ALA 133.A N HIS 129.A O no hydrogen 3.126 N/A ASP 134.A N GLU 130.A O no hydrogen 3.026 N/A GLU 135.A N ALA 131.A O no hydrogen 3.083 N/A ARG 136.A N LEU 132.A O no hydrogen 2.961 N/A HIS 137.A N ALA 133.A O no hydrogen 2.954 N/A ARG 138.A N ASP 134.A O no hydrogen 2.946 N/A ARG 138.A NE ASP 134.A OD1 no hydrogen 2.927 N/A ARG 138.A NE ASP 134.A OD2 no hydrogen 3.112 N/A ARG 138.A NH1 ASP 134.A OD2 no hydrogen 3.390 N/A LEU 139.A N GLU 135.A O no hydrogen 2.931 N/A HIS 140.A N ARG 136.A O no hydrogen 3.020 N/A ALA 141.A N HIS 137.A O no hydrogen 2.889 N/A ALA 142.A N ARG 138.A O no hydrogen 3.228 N/A ALA 142.A N LEU 139.A O no hydrogen 3.090 N/A LEU 143.A N HIS 140.A O no hydrogen 3.358 N/A HIS 144.A N VAL 166.A O no hydrogen 2.732 N/A LYS 145.A N ALA 142.A O no hydrogen 2.874 N/A VAL 147.A N ARG 164.A O no hydrogen 2.837 N/A TYR 148.A OH GLY 160.A O no hydrogen 2.549 N/A ILE 149.A N GLU 162.A O no hydrogen 3.072 N/A ALA 150.A N TRP 23.A O no hydrogen 3.028 N/A GLY 153.A N LEU 157.A O no hydrogen 2.953 N/A LYS 156.A N GLY 153.A O no hydrogen 3.223 N/A LEU 157.A N LYS 154.A O no hydrogen 3.134 N/A GLU 159.A N PRO 151.A O no hydrogen 3.118 N/A GLU 162.A N ILE 149.A O no hydrogen 2.990 N/A ARG 164.A N VAL 147.A O no hydrogen 3.072 N/A ARG 164.A NE ASP 109.A OD2 no hydrogen 2.790 N/A ARG 164.A NH1 GLU 162.A OE2 no hydrogen 2.827 N/A ARG 164.A NH2 ASP 109.A OD2 no hydrogen 3.323 N/A VAL 166.A N LYS 145.A O no hydrogen 3.032 N/A GLN 167.A N ASP 109.A OD1 no hydrogen 2.769 N/A GLN 167.A NE2 ARG 165.A O no hydrogen 3.504 N/A LYS 168.A N ASP 109.A OD1 no hydrogen 2.932 N/A GLN 170.A N TYR 107.A O no hydrogen 2.942 N/A THR 171.A N GLU 174.A OE2 no hydrogen 2.859 N/A GLU 174.A N THR 171.A OG1 no hydrogen 3.158 N/A VAL 175.A N THR 171.A O no hydrogen 3.194 N/A ALA 176.A N GLU 172.A O no hydrogen 2.754 N/A GLU 177.A N GLN 173.A O no hydrogen 2.968 N/A ALA 178.A N GLU 174.A O no hydrogen 2.955 N/A ALA 179.A N VAL 175.A O no hydrogen 3.101 N/A ALA 179.A N ALA 176.A O no hydrogen 2.947 N/A GLY 180.A N GLU 177.A O no hydrogen 2.798 N/A MET 181.A N ALA 176.A O no hydrogen 2.918 N/A ARG 182.A N ILE 95.A O no hydrogen 2.875 N/A ARG 182.A NH1 TYR 96.A OH no hydrogen 3.025 N/A TYR 183.A OH ASP 99.A OD2 no hydrogen 2.607 N/A PHE 184.A N ASP 97.A O no hydrogen 3.082 N/A ARG 185.A NE ARG 101.A O no hydrogen 2.798 N/A ARG 185.A NH1 GLU 135.A OE1 no hydrogen 3.473 N/A ARG 185.A NH1 GLU 135.A OE2 no hydrogen 2.872 N/A ARG 185.A NH1 TYR 183.A OH no hydrogen 3.157 N/A ARG 185.A NH2 ARG 101.A O no hydrogen 3.038 N/A ARG 185.A NH2 GLU 135.A OE1 no hydrogen 2.732 N/A ARG 185.A NH2 GLU 135.A OE2 no hydrogen 3.558 N/A ILE 186.A N ASP 99.A O no hydrogen 2.843 N/A ALA 187.A N GLN 128.A OE1 no hydrogen 2.930 N/A ALA 188.A N LEU 100.A O no hydrogen 3.125 N/A ALA 188.A N ILE 186.A O no hydrogen 2.799 N/A THR 189.A OG1 GLN 102.A OE1 no hydrogen 2.607 N/A THR 195.A N ASN 198.A OD1 no hydrogen 2.990 N/A THR 195.A OG1 GLU 197.A OE2 no hydrogen 3.278 N/A ASN 198.A N THR 195.A OG1 no hydrogen 3.040 N/A ASN 198.A ND2 ALA 187.A O no hydrogen 3.148 N/A ILE 199.A N THR 195.A O no hydrogen 3.017 N/A ASP 200.A N PRO 196.A O no hydrogen 2.836 N/A ARG 201.A N GLU 197.A O no hydrogen 3.082 N/A ARG 201.A NE ARG 185.A O no hydrogen 2.731 N/A ARG 201.A NH2 ARG 185.A O no hydrogen 3.141 N/A PHE 202.A N ASN 198.A O no hydrogen 2.996 N/A LEU 203.A N ILE 199.A O no hydrogen 2.864 N/A ALA 204.A N ASP 200.A O no hydrogen 3.017 N/A PHE 205.A N ARG 201.A O no hydrogen 3.116 N/A TYR 206.A N PHE 202.A O no hydrogen 2.746 N/A ARG 207.A N LEU 203.A O no hydrogen 3.066 N/A ARG 207.A NH1 GLY 297.A O no hydrogen 2.733 N/A ARG 207.A NH2 TYR 298.A O no hydrogen 2.960 N/A THR 208.A N PHE 205.A O no hydrogen 3.289 N/A THR 208.A OG1 PHE 205.A O no hydrogen 3.470 N/A LEU 209.A N TYR 206.A O no hydrogen 3.202 N/A ALA 213.A N PRO 210.A O no hydrogen 3.048 N/A TRP 214.A N PRO 94.A O no hydrogen 2.894 N/A TRP 214.A NE1 SER 70.A OG no hydrogen 2.848 N/A LEU 215.A N HIS 68.A O no hydrogen 3.148 N/A HIS 216.A N TYR 96.A O no hydrogen 2.868 N/A HIS 216.A ND1 SER 70.A OG no hydrogen 2.624 N/A HIS 216.A NE2 SER 72.A OG no hydrogen 2.963 N/A PHE 217.A N SER 70.A O no hydrogen 2.850 N/A HIS 218.A N VAL 98.A O no hydrogen 3.154 N/A HIS 218.A ND1 CYS 219.A O no hydrogen 2.950 N/A HIS 218.A NE2 GLU 172.A OE2 no hydrogen 2.539 N/A CYS 219.A SG THR 226.A OG1 no hydrogen 3.113 N/A ARG 225.A NH1 GLU 103.A OE1 no hydrogen 3.480 N/A ARG 225.A NH1 GLU 103.A OE2 no hydrogen 2.807 N/A ARG 225.A NH1 ALA 188.A O no hydrogen 2.827 N/A ARG 225.A NH2 GLU 103.A OE1 no hydrogen 3.152 N/A THR 227.A N VAL 223.A O no hydrogen 2.958 N/A THR 227.A OG1 VAL 223.A O no hydrogen 2.744 N/A ALA 228.A N GLY 224.A O no hydrogen 3.022 N/A PHE 229.A N ARG 225.A O no hydrogen 3.182 N/A MET 230.A N THR 226.A O no hydrogen 2.991 N/A VAL 231.A N THR 227.A O no hydrogen 2.727 N/A MET 232.A N ALA 228.A O no hydrogen 2.942 N/A THR 233.A N PHE 229.A O no hydrogen 2.902 N/A THR 233.A OG1 PHE 229.A O no hydrogen 2.810 N/A ASP 234.A N MET 230.A O no hydrogen 2.900 N/A MET 235.A N VAL 231.A O no hydrogen 2.844 N/A LEU 236.A N MET 232.A O no hydrogen 2.919 N/A LYS 237.A N THR 233.A O no hydrogen 2.958 N/A LYS 237.A NZ ALA 66.A O no hydrogen 2.861 N/A LYS 237.A NZ LEU 67.A O no hydrogen 3.143 N/A ASN 238.A N ASP 234.A O no hydrogen 2.793 N/A ASN 238.A ND2 GLY 63.A O no hydrogen 3.677 N/A ASN 238.A ND2 ASP 234.A O no hydrogen 3.601 N/A ASN 238.A ND2 ASP 234.A OD1 no hydrogen 2.898 N/A VAL 241.A N ASN 238.A O no hydrogen 2.918 N/A ASP 245.A N SER 242.A OG no hydrogen 3.125 N/A ILE 246.A N SER 242.A O no hydrogen 2.987 N/A LEU 247.A N LEU 243.A O no hydrogen 2.915 N/A TYR 248.A N LYS 244.A O no hydrogen 2.906 N/A ARG 249.A N ASP 245.A O no hydrogen 2.993 N/A ARG 249.A NE ASP 234.A OD2 no hydrogen 2.873 N/A ARG 249.A NH1 SER 60.A O no hydrogen 3.116 N/A ARG 249.A NH1 GLU 62.A O no hydrogen 2.832 N/A ARG 249.A NH2 GLU 62.A O no hydrogen 3.051 N/A ARG 249.A NH2 ASP 234.A OD1 no hydrogen 2.619 N/A ARG 249.A NH2 ASP 234.A OD2 no hydrogen 3.487 N/A GLN 250.A N ILE 246.A O no hydrogen 2.971 N/A GLN 250.A NE2 ASP 234.A OD2 no hydrogen 2.889 N/A HIS 251.A N LEU 247.A O no hydrogen 3.109 N/A HIS 251.A ND1 GLY 255.A O no hydrogen 2.876 N/A GLU 252.A N TYR 248.A O no hydrogen 2.696 N/A ILE 253.A N ARG 249.A O no hydrogen 3.051 N/A GLY 254.A N HIS 251.A O no hydrogen 2.919 N/A GLY 255.A N GLN 250.A O no hydrogen 3.087 N/A PHE 256.A N THR 227.A OG1 no hydrogen 2.913 N/A TYR 258.A OH GLY 224.A O no hydrogen 2.697 N/A THR 265.A OG1 LYS 266.A O no hydrogen 3.467 N/A LYS 268.A NZ HIS 155.A ND1 no hydrogen 2.565 N/A ASP 269.A N LYS 266.A O no hydrogen 3.060 N/A SER 270.A N ASP 267.A O no hydrogen 3.258 N/A SER 270.A OG ASP 267.A O no hydrogen 3.091 N/A LYS 272.A N ASP 269.A O no hydrogen 2.985 N/A THR 273.A N SER 270.A O no hydrogen 3.319 N/A THR 273.A OG1 SER 270.A O no hydrogen 3.190 N/A TYR 275.A N LYS 272.A O no hydrogen 2.872 N/A TYR 275.A OH GLU 13.A OE2 no hydrogen 2.631 N/A TYR 276.A N LYS 272.A O no hydrogen 2.974 N/A ARG 277.A N THR 273.A O no hydrogen 3.032 N/A GLU 278.A N LYS 274.A O no hydrogen 2.879 N/A LYS 279.A N TYR 275.A O no hydrogen 2.980 N/A LYS 279.A NZ HIS 191.A O no hydrogen 3.437 N/A ILE 280.A N TYR 276.A O no hydrogen 3.149 N/A VAL 281.A N ARG 277.A O no hydrogen 3.188 N/A MET 282.A N GLU 278.A O no hydrogen 2.860 N/A ILE 283.A N LYS 279.A O no hydrogen 2.916 N/A GLU 284.A N ILE 280.A O no hydrogen 3.446 N/A GLN 285.A N VAL 281.A O no hydrogen 3.008 N/A GLN 285.A NE2 HIS 309.A O no hydrogen 2.727 N/A PHE 286.A N MET 282.A O no hydrogen 2.798 N/A TYR 287.A N ILE 283.A O no hydrogen 3.056 N/A TYR 287.A OH VAL 241.A O no hydrogen 3.300 N/A ARG 288.A N GLU 284.A O no hydrogen 2.982 N/A ARG 288.A NE GLU 292.A OE1 no hydrogen 3.132 N/A TYR 289.A N GLN 285.A O no hydrogen 2.915 N/A TYR 289.A OH THR 300.A O no hydrogen 2.689 N/A VAL 290.A N PHE 286.A O no hydrogen 2.883 N/A GLN 291.A N TYR 287.A O no hydrogen 2.925 N/A GLN 291.A NE2 PRO 239.A O no hydrogen 2.897 N/A GLU 292.A N ARG 288.A O no hydrogen 2.897 N/A ASN 293.A N TYR 289.A O no hydrogen 2.991 N/A ASN 293.A ND2 TYR 289.A O no hydrogen 2.950 N/A GLY 297.A N ARG 294.A O no hydrogen 2.810 N/A TYR 298.A N ASN 293.A O no hydrogen 2.768 N/A GLN 299.A N ASP 296.A OD2 no hydrogen 3.131 N/A GLN 299.A NE2 ASP 296.A O no hydrogen 3.432 N/A SER 303.A N ASP 200.A OD1 no hydrogen 2.811 N/A SER 303.A OG ASP 200.A OD1 no hydrogen 3.549 N/A SER 303.A OG ASP 200.A OD2 no hydrogen 2.488 N/A TRP 305.A N PRO 301.A O no hydrogen 2.956 N/A LEU 306.A N TRP 302.A O no hydrogen 2.807 N/A LYS 307.A N SER 303.A O no hydrogen 3.148 N/A SER 308.A N VAL 304.A O no hydrogen 3.207 N/A SER 308.A OG VAL 304.A O no hydrogen 3.458 N/A SER 308.A OG TRP 305.A O no hydrogen 3.176 N/A SER 308.A OG HIS 309.A ND1 no hydrogen 3.114 N/A HIS 309.A N TRP 305.A O no hydrogen 2.860 N/A HIS 309.A ND1 TRP 305.A O no hydrogen 2.924 N/A