Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qdp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH2 ASN 43.A OD1 no hydrogen 3.141 N/A GLU 5.A N THR 2.A OG1 no hydrogen 3.400 N/A VAL 6.A N THR 2.A O no hydrogen 2.937 N/A THR 7.A N PRO 3.A O no hydrogen 2.876 N/A THR 7.A OG1 PRO 3.A O no hydrogen 2.918 N/A LEU 8.A N ARG 4.A O no hydrogen 2.892 N/A HIS 9.A N GLU 5.A O no hydrogen 2.960 N/A PHE 10.A N VAL 6.A O no hydrogen 3.154 N/A LEU 11.A N THR 7.A O no hydrogen 3.014 N/A ARG 12.A N LEU 8.A O no hydrogen 2.803 N/A ARG 12.A N HIS 9.A O no hydrogen 3.259 N/A THR 13.A N PHE 10.A O no hydrogen 3.041 N/A THR 13.A OG1 HIS 9.A O no hydrogen 2.673 N/A ALA 14.A N PHE 10.A O no hydrogen 2.899 N/A HIS 16.A N ASP 254.A OD1 no hydrogen 2.649 N/A HIS 16.A N ASP 254.A OD2 no hydrogen 2.977 N/A HIS 16.A ND1 GLU 36.A OE1 no hydrogen 2.867 N/A LEU 18.A N VAL 253.A O no hydrogen 2.757 N/A ARG 20.A N GLY 251.A O no hydrogen 2.958 N/A ALA 22.A N THR 19.A OG1 no hydrogen 2.888 N/A LEU 23.A N THR 19.A O no hydrogen 2.916 N/A GLN 24.A N ARG 20.A O no hydrogen 3.093 N/A ARG 25.A N TRP 21.A O no hydrogen 2.583 N/A GLN 26.A N ALA 22.A O no hydrogen 2.783 N/A SER 29.A N GLN 32.A OE1 no hydrogen 2.619 N/A LYS 31.A NZ GLU 35.A OE2 no hydrogen 3.189 N/A GLN 32.A N SER 29.A OG no hydrogen 2.896 N/A LEU 33.A N SER 29.A O no hydrogen 2.861 N/A GLU 34.A N PRO 30.A O no hydrogen 2.894 N/A GLU 35.A N LYS 31.A O no hydrogen 2.959 N/A GLU 36.A N GLN 32.A O no hydrogen 2.664 N/A PHE 37.A N LEU 33.A O no hydrogen 2.859 N/A LEU 38.A N GLU 34.A O no hydrogen 3.017 N/A LYS 39.A N GLU 36.A O no hydrogen 3.065 N/A ILE 40.A N PHE 37.A O no hydrogen 3.232 N/A ASN 43.A ND2 ARG 263.A O no hydrogen 2.808 N/A PHE 44.A N SER 42.A OG no hydrogen 2.995 N/A ASP 49.A N SER 46.A O no hydrogen 2.901 N/A LEU 50.A N PRO 47.A O no hydrogen 3.372 N/A HIS 55.A ND1 ASP 59.A OD2 no hydrogen 2.816 N/A SER 57.A N GLY 54.A O no hydrogen 3.356 N/A SER 57.A OG GLY 54.A O no hydrogen 2.847 N/A LYS 58.A N HIS 55.A O no hydrogen 2.648 N/A LYS 58.A NZ ASP 114.A OD2 no hydrogen 2.689 N/A ASP 59.A N ALA 56.A O no hydrogen 3.181 N/A ARG 60.A N GLN 105.A OE1 no hydrogen 3.196 N/A ARG 60.A NE GLU 138.A O no hydrogen 2.884 N/A ARG 60.A NH1 GLY 106.A O no hydrogen 2.813 N/A ARG 60.A NH1 SER 228.A O no hydrogen 2.682 N/A ARG 60.A NH2 GLY 106.A O no hydrogen 3.041 N/A ARG 60.A NH2 PRO 107.A O no hydrogen 2.955 N/A ILE 64.A N TYR 61.A O no hydrogen 3.194 N/A ASN 67.A ND2 ASN 43.A O no hydrogen 3.014 N/A GLN 69.A NE2.B LEU 264.A O no hydrogen 2.763 N/A SER 70.A N ASN 67.A O no hydrogen 3.221 N/A SER 70.A OG ASN 67.A O no hydrogen 3.534 N/A SER 70.A OG ASP 265.A O no hydrogen 2.540 N/A ARG 71.A N PRO 68.A O no hydrogen 3.316 N/A ARG 71.A NH1 ASP 84.A OD1 no hydrogen 3.141 N/A ARG 71.A NH2 ASP 84.A OD1 no hydrogen 3.167 N/A ARG 71.A NH2 ASP 84.A OD2 no hydrogen 3.412 N/A VAL 72.A N ALA 88.A O no hydrogen 2.905 N/A CYS 73.A SG ASP 84.A OD2 no hydrogen 3.745 N/A LEU 74.A N ASP 84.A O no hydrogen 2.716 N/A GLY 75.A N GLN 121.A OE1 no hydrogen 2.942 N/A ARG 76.A NE GLY 83.A O no hydrogen 2.791 N/A ARG 76.A NH1 ASP 114.A OD1 no hydrogen 3.098 N/A ARG 76.A NH2 GLY 83.A O no hydrogen 3.311 N/A ARG 76.A NH2 ASP 114.A OD1 no hydrogen 3.178 N/A SER 79.A N ARG 76.A O no hydrogen 3.276 N/A TYR 85.A OH ASP 59.A OD1 no hydrogen 2.442 N/A ASN 87.A ND2 ASP 59.A OD1 no hydrogen 3.005 N/A ASN 87.A ND2 ILE 64.A O no hydrogen 2.728 N/A ASN 89.A N ALA 103.A O no hydrogen 3.042 N/A ASN 89.A ND2 ASN 67.A O no hydrogen 3.108 N/A ASN 89.A ND2 SER 70.A OG no hydrogen 2.827 N/A TYR 90.A N SER 70.A O no hydrogen 2.892 N/A TYR 90.A OH GLU 122.A OE2 no hydrogen 2.738 N/A ILE 91.A N TYR 101.A O no hydrogen 2.858 N/A ARG 92.A N ASP 265.A OD2 no hydrogen 2.861 N/A ARG 92.A NE ASP 265.A OD1 no hydrogen 2.839 N/A ARG 92.A NH1 GLN 261.A OE1 no hydrogen 3.040 N/A ARG 92.A NH2 GLN 261.A OE1 no hydrogen 2.832 N/A ARG 92.A NH2 ASP 265.A OD1 no hydrogen 3.027 N/A GLY 93.A N LYS 97.A O no hydrogen 2.874 N/A GLY 96.A N GLY 93.A O no hydrogen 3.005 N/A LYS 97.A N TYR 94.A O no hydrogen 3.211 N/A TYR 101.A N ILE 91.A O no hydrogen 3.112 N/A ILE 102.A N ILE 223.A O no hydrogen 2.746 N/A ALA 103.A N ASN 89.A O no hydrogen 2.885 N/A THR 104.A N VAL 225.A O no hydrogen 3.019 N/A THR 104.A OG1 ASN 87.A O no hydrogen 2.659 N/A THR 104.A OG1 GLN 105.A O no hydrogen 3.211 N/A GLN 105.A NE2 LYS 58.A O no hydrogen 2.920 N/A GLY 106.A N SER 227.A O no hydrogen 3.032 N/A MET 108.A N THR 111.A OG1 no hydrogen 2.881 N/A ASN 110.A ND2 SER 57.A O no hydrogen 3.054 N/A THR 111.A N MET 108.A O no hydrogen 2.773 N/A THR 111.A OG1 MET 108.A O no hydrogen 3.213 N/A PHE 115.A N THR 111.A O no hydrogen 2.869 N/A TRP 116.A N VAL 112.A O no hydrogen 3.136 N/A TRP 116.A NE1 TYR 143.A O no hydrogen 2.978 N/A GLU 117.A N SER 113.A O no hydrogen 2.924 N/A MET 118.A N ASP 114.A O no hydrogen 2.828 N/A VAL 119.A N PHE 115.A O no hydrogen 2.810 N/A TRP 120.A N TRP 116.A O no hydrogen 2.972 N/A GLN 121.A N GLU 117.A O no hydrogen 2.945 N/A GLN 121.A NE2 CYS 73.A O no hydrogen 2.998 N/A GLN 121.A NE2 GLU 122.A OE2 no hydrogen 2.959 N/A GLU 122.A N MET 118.A O no hydrogen 2.916 N/A GLU 123.A N TRP 120.A O no hydrogen 2.886 N/A VAL 124.A N VAL 119.A O no hydrogen 2.876 N/A ILE 127.A N LYS 184.A O no hydrogen 2.818 N/A VAL 128.A N VAL 224.A O no hydrogen 2.673 N/A MET 129.A N ILE 186.A O no hydrogen 2.668 N/A LEU 130.A N HIS 226.A O no hydrogen 2.869 N/A THR 131.A N PHE 188.A O no hydrogen 2.847 N/A THR 131.A OG1 GLN 132.A O no hydrogen 3.441 N/A THR 131.A OG1 GLU 135.A OE1 no hydrogen 2.560 N/A GLN 132.A N THR 131.A OG1 no hydrogen 2.734 N/A LEU 133.A N GLN 132.A OE1.A no hydrogen 2.776 N/A GLU 135.A N GLN 132.A O no hydrogen 3.333 N/A LYS 139.A N GLY 136.A O no hydrogen 3.087 N/A LYS 139.A NZ ASP 193.A OD1 no hydrogen 3.347 N/A CYS 140.A N GLY 136.A O no hydrogen 3.040 N/A HIS 142.A ND1.A HIS 142.A O no hydrogen 2.992 N/A TYR 143.A OH HIS 226.A NE2 no hydrogen 2.612 N/A GLU 149.A N ILE 156.A O no hydrogen 3.064 N/A THR 150.A OG1 GLN 155.A OE1 no hydrogen 2.394 N/A TYR 151.A N PHE 154.A O no hydrogen 3.069 N/A PHE 154.A N TYR 151.A O no hydrogen 3.116 N/A GLN 155.A N GLN 175.A O no hydrogen 2.987 N/A ILE 156.A N GLU 149.A O no hydrogen 2.956 N/A ARG 157.A N THR 173.A O no hydrogen 3.033 N/A ILE 158.A N GLU 147.A O no hydrogen 2.939 N/A GLN 159.A N GLN 171.A O no hydrogen 2.710 N/A ASP 160.A N GLN 171.A O no hydrogen 3.238 N/A LYS 162.A N VAL 169.A O no hydrogen 2.913 N/A TYR 167.A OH GLU 209.A OE1 no hydrogen 2.803 N/A THR 168.A N LEU 187.A O no hydrogen 3.113 N/A THR 168.A OG1 GLU 163.A OE2 no hydrogen 2.845 N/A VAL 169.A N LYS 162.A O no hydrogen 2.876 N/A ARG 170.A N HIS 185.A O no hydrogen 2.684 N/A GLN 171.A N ASP 160.A O no hydrogen 2.901 N/A LEU 172.A N VAL 183.A O no hydrogen 2.808 N/A THR 173.A N ARG 157.A O no hydrogen 2.931 N/A ILE 174.A N ARG 181.A O no hydrogen 2.990 N/A GLN 175.A N GLN 155.A O no hydrogen 2.967 N/A GLN 175.A NE2 GLN 177.A O no hydrogen 2.623 N/A TYR 176.A N GLU 179.A O no hydrogen 2.805 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.886 N/A GLU 179.A N TYR 176.A O no hydrogen 3.012 N/A ARG 180.A NH1 GLN 175.A OE1 no hydrogen 2.904 N/A ARG 181.A N ILE 174.A O no hydrogen 2.897 N/A ARG 181.A NE GLU 179.A OE2 no hydrogen 2.953 N/A ARG 181.A NH1 TRP 120.A O no hydrogen 2.549 N/A ARG 181.A NH2 GLU 179.A OE2 no hydrogen 3.345 N/A VAL 183.A N LEU 172.A O no hydrogen 2.856 N/A LYS 184.A N SER 125.A O no hydrogen 2.794 N/A LYS 184.A NZ GLU 209.A O no hydrogen 3.277 N/A LYS 184.A NZ GLU 209.A OE2 no hydrogen 2.596 N/A LYS 184.A NZ SER 213.A OG no hydrogen 2.429 N/A HIS 185.A N ARG 170.A O no hydrogen 2.607 N/A HIS 185.A NE2 TYR 143.A OH no hydrogen 2.676 N/A ILE 186.A N ILE 127.A O no hydrogen 2.872 N/A LEU 187.A N THR 168.A O no hydrogen 2.974 N/A PHE 188.A N MET 129.A O no hydrogen 2.810 N/A TRP 191.A N THR 131.A O no hydrogen 2.876 N/A TRP 191.A NE1 GLN 195.A O no hydrogen 2.913 N/A HIS 194.A ND1 ASP 193.A OD2 no hydrogen 2.861 N/A GLN 195.A N PRO 192.A O no hydrogen 3.112 N/A THR 196.A OG1 PRO 197.A O no hydrogen 2.790 N/A LEU 204.A N ALA 200.A O no hydrogen 2.885 N/A ARG 205.A N GLY 201.A O no hydrogen 2.978 N/A ARG 205.A NE GLU 166.A OE1 no hydrogen 3.145 N/A ARG 205.A NH2 GLU 166.A OE2 no hydrogen 3.116 N/A LEU 206.A N PRO 202.A O no hydrogen 2.979 N/A VAL 207.A N LEU 203.A O no hydrogen 2.844 N/A ALA 208.A N LEU 204.A O no hydrogen 2.845 N/A GLU 209.A N ARG 205.A O no hydrogen 2.771 N/A VAL 210.A N LEU 206.A O no hydrogen 3.083 N/A GLU 211.A N VAL 207.A O no hydrogen 3.042 N/A GLU 212.A N ALA 208.A O no hydrogen 2.910 N/A SER 213.A N VAL 210.A O no hydrogen 3.081 N/A SER 213.A OG GLU 209.A O no hydrogen 2.923 N/A ILE 223.A N VAL 100.A O no hydrogen 2.996 N/A VAL 224.A N LEU 126.A O no hydrogen 3.070 N/A VAL 225.A N ILE 102.A O no hydrogen 2.824 N/A HIS 226.A N VAL 128.A O no hydrogen 2.949 N/A HIS 226.A NE2 TYR 143.A OH no hydrogen 2.612 N/A SER 227.A OG THR 234.A OG1.B no hydrogen 3.417 N/A SER 228.A OG LYS 139.A O no hydrogen 3.073 N/A GLY 230.A N SER 227.A OG no hydrogen 3.135 N/A ARG 233.A NH1 GLU 135.A OE2 no hydrogen 3.010 N/A ARG 233.A NH1 TRP 191.A O no hydrogen 2.967 N/A ARG 233.A NH2 GLU 135.A OE2 no hydrogen 3.530 N/A ARG 233.A NH2 SER 228.A OG no hydrogen 3.216 N/A THR 234.A OG1.B SER 227.A OG no hydrogen 3.417 N/A GLY 235.A N ILE 231.A O no hydrogen 3.209 N/A CYS 236.A N GLY 232.A O no hydrogen 3.008 N/A CYS 236.A SG GLY 232.A O no hydrogen 3.323 N/A PHE 237.A N ARG 233.A O no hydrogen 2.842 N/A ILE 238.A N THR 234.A O no hydrogen 3.018 N/A ALA 239.A N GLY 235.A O no hydrogen 2.704 N/A THR 240.A N CYS 236.A O no hydrogen 2.889 N/A THR 240.A N PHE 237.A O no hydrogen 2.913 N/A THR 240.A OG1 CYS 236.A O no hydrogen 2.759 N/A ARG 241.A N PHE 237.A O no hydrogen 3.043 N/A ARG 241.A NE GLU 211.A OE2 no hydrogen 2.668 N/A ARG 241.A NH1 TYR 101.A OH no hydrogen 2.533 N/A ARG 241.A NH2 GLU 211.A OE2 no hydrogen 3.174 N/A ILE 242.A N ILE 238.A O no hydrogen 3.131 N/A GLY 243.A N ALA 239.A O no hydrogen 2.927 N/A CYS 244.A N THR 240.A O no hydrogen 2.863 N/A CYS 244.A SG THR 240.A O no hydrogen 3.103 N/A GLN 245.A N ARG 241.A O no hydrogen 2.809 N/A GLN 246.A N ILE 242.A O no hydrogen 2.876 N/A LEU 247.A N GLY 243.A O no hydrogen 3.026 N/A LYS 248.A N CYS 244.A O no hydrogen 2.877 N/A ALA 249.A N GLN 245.A O no hydrogen 2.915 N/A ARG 250.A N GLN 246.A O no hydrogen 2.659 N/A GLY 251.A N LEU 247.A O no hydrogen 2.723 N/A VAL 253.A N LEU 18.A O no hydrogen 3.064 N/A ASP 254.A N GLN 246.A OE1 no hydrogen 2.962 N/A GLY 257.A N ASP 254.A OD1 no hydrogen 2.892 N/A ILE 258.A N ASP 254.A O no hydrogen 2.895 N/A VAL 259.A N ILE 255.A O no hydrogen 2.837 N/A CYS 260.A N LEU 256.A O no hydrogen 2.963 N/A CYS 260.A SG LEU 256.A O no hydrogen 3.271 N/A GLN 261.A N GLY 257.A O no hydrogen 2.958 N/A LEU 262.A N ILE 258.A O no hydrogen 3.075 N/A ARG 263.A N VAL 259.A O no hydrogen 2.989 N/A ARG 263.A NE MET 269.A O no hydrogen 2.756 N/A ARG 263.A NH1 PRO 41.A O no hydrogen 3.181 N/A ARG 263.A NH2 MET 269.A O no hydrogen 2.999 N/A ARG 263.A NH2 ILE 270.A O no hydrogen 2.571 N/A LEU 264.A N CYS 260.A O no hydrogen 3.104 N/A ASP 265.A N GLN 261.A O no hydrogen 3.205 N/A ARG 266.A N LEU 262.A O no hydrogen 2.793 N/A ARG 266.A NE GLY 230.A O no hydrogen 2.768 N/A ARG 266.A NH1 ASN 87.A OD1 no hydrogen 2.912 N/A ARG 266.A NH1 ASN 89.A OD1 no hydrogen 2.582 N/A ARG 266.A NH2 ASN 87.A OD1 no hydrogen 2.728 N/A ARG 266.A NH2 ALA 229.A O no hydrogen 3.147 N/A GLY 267.A N ASN 67.A OD1 no hydrogen 2.944 N/A GLY 268.A N SER 42.A O no hydrogen 2.847 N/A MET 269.A N ARG 266.A O no hydrogen 3.483 N/A ILE 270.A N ILE 231.A O no hydrogen 2.742 N/A GLN 271.A N GLN 275.A OE1 no hydrogen 2.878 N/A THR 272.A N GLN 275.A OE1 no hydrogen 3.219 N/A GLN 275.A N THR 272.A OG1 no hydrogen 2.823 N/A GLN 275.A NE2 GLN 195.A O no hydrogen 2.840 N/A TYR 276.A N THR 272.A O no hydrogen 3.085 N/A TYR 276.A OH GLU 36.A OE2 no hydrogen 2.382 N/A GLN 277.A N ALA 273.A O no hydrogen 2.787 N/A PHE 278.A N GLU 274.A O no hydrogen 2.881 N/A LEU 279.A N GLN 275.A O no hydrogen 3.042 N/A HIS 280.A N TYR 276.A O no hydrogen 3.499 N/A HIS 280.A ND1 TYR 276.A O no hydrogen 2.725 N/A HIS 281.A N GLN 277.A O no hydrogen 3.011 N/A THR 282.A N PHE 278.A O no hydrogen 2.743 N/A THR 282.A OG1 PHE 278.A O no hydrogen 2.841 N/A LEU 283.A N LEU 279.A O no hydrogen 2.893 N/A ALA 284.A N HIS 280.A O no hydrogen 2.843 N/A LEU 285.A N HIS 281.A O no hydrogen 3.004 N/A TYR 286.A N THR 282.A O no hydrogen 2.959 N/A ALA 287.A N LEU 283.A O no hydrogen 3.108 N/A GLY 288.A N LEU 285.A O no hydrogen 2.975 N/A GLN 289.A N TYR 286.A O no hydrogen 2.985 N/A LEU 290.A N ALA 287.A O no hydrogen 2.979 N/A