Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hqb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N ASN 55.A OD1 no hydrogen 3.568 N/A VAL 2.A N ASP 29.A O no hydrogen 2.933 N/A GLY 3.A N LEU 56.A O no hydrogen 2.841 N/A LEU 4.A N VAL 31.A O no hydrogen 2.855 N/A LEU 5.A N PHE 58.A O no hydrogen 2.770 N/A VAL 6.A N GLU 33.A O no hydrogen 3.135 N/A ASN 12.A ND2 GLU 7.A O no hydrogen 2.623 N/A ARG 13.A NH1 GLU 17.A OE2 no hydrogen 2.815 N/A LYS 14.A N TRP 11.A O no hydrogen 3.105 N/A ALA 15.A N ASN 12.A O no hydrogen 3.201 N/A TYR 16.A N ASN 12.A O no hydrogen 3.111 N/A GLU 17.A N ARG 13.A O no hydrogen 2.834 N/A GLY 18.A N LYS 14.A O no hydrogen 3.281 N/A LEU 19.A N ALA 15.A O no hydrogen 2.838 N/A LEU 20.A N TYR 16.A O no hydrogen 2.916 N/A ASN 21.A N GLU 17.A O no hydrogen 2.960 N/A ILE 22.A N GLY 18.A O no hydrogen 2.961 N/A HIS 23.A N LEU 19.A O no hydrogen 3.119 N/A HIS 23.A ND1 VAL 28.A O no hydrogen 2.798 N/A ASN 25.A N ASN 21.A O no hydrogen 2.483 N/A LEU 26.A N ILE 22.A O no hydrogen 3.025 N/A VAL 31.A N VAL 2.A O no hydrogen 2.778 N/A GLU 33.A N LEU 4.A O no hydrogen 2.881 N/A VAL 36.A N VAL 6.A O no hydrogen 3.037 N/A LYS 41.A N SER 38.A OG no hydrogen 3.205 N/A ALA 42.A N SER 38.A O no hydrogen 2.934 N/A HIS 43.A N GLU 39.A O no hydrogen 2.681 N/A ARG 44.A N GLN 40.A O no hydrogen 3.069 N/A ARG 45.A N LYS 41.A O no hydrogen 2.805 N/A ARG 45.A NH1 GLU 48.A OE1 no hydrogen 3.475 N/A ILE 46.A N HIS 43.A O no hydrogen 3.187 N/A LYS 47.A N HIS 43.A O no hydrogen 3.287 N/A LYS 47.A N ARG 44.A O no hydrogen 2.893 N/A GLU 48.A N ARG 44.A O no hydrogen 3.204 N/A LEU 49.A N ARG 45.A O no hydrogen 3.221 N/A VAL 50.A N ILE 46.A O no hydrogen 3.025 N/A ASP 51.A N LYS 47.A O no hydrogen 2.773 N/A GLY 52.A N GLU 48.A O no hydrogen 2.659 N/A GLY 53.A N VAL 50.A O no hydrogen 3.118 N/A VAL 54.A N LEU 49.A O no hydrogen 2.770 N/A ILE 57.A N HIS 79.A O no hydrogen 3.004 N/A PHE 58.A N GLY 3.A O no hydrogen 2.823 N/A GLY 59.A N VAL 81.A O no hydrogen 2.935 N/A HIS 60.A N LEU 5.A O no hydrogen 3.092 N/A PHE 64.A N GLY 61.A O no hydrogen 3.414 N/A TYR 67.A N ALA 63.A O no hydrogen 3.128 N/A PHE 68.A N PHE 64.A O no hydrogen 2.734 N/A SER 69.A N ALA 65.A O no hydrogen 2.885 N/A SER 69.A OG ALA 65.A O no hydrogen 2.831 N/A THR 70.A N GLU 66.A O no hydrogen 3.261 N/A THR 70.A OG1 GLU 39.A OE2 no hydrogen 2.673 N/A THR 70.A OG1 HIS 43.A NE2 no hydrogen 3.239 N/A THR 70.A OG1 GLU 66.A O no hydrogen 3.228 N/A THR 70.A OG1 TYR 67.A O no hydrogen 3.016 N/A ILE 71.A N PHE 68.A O no hydrogen 3.195 N/A HIS 72.A N PHE 68.A O no hydrogen 2.714 N/A HIS 72.A ND1 SER 69.A O no hydrogen 3.222 N/A GLN 74.A N ILE 71.A O no hydrogen 3.202 N/A ASP 77.A N ASP 77.A OD1 no hydrogen 2.576 N/A VAL 78.A N TYR 75.A O no hydrogen 3.024 N/A HIS 79.A N ASN 55.A O no hydrogen 2.977 N/A HIS 79.A NE2 THR 93.A OG1 no hydrogen 2.760 N/A PHE 80.A N ASN 91.A O no hydrogen 2.599 N/A VAL 81.A N ILE 57.A O no hydrogen 2.899 N/A SER 82.A N THR 93.A O no hydrogen 3.082 N/A PHE 83.A N GLY 59.A O no hydrogen 2.816 N/A ASN 84.A N LEU 95.A O no hydrogen 2.773 N/A GLY 85.A N SER 82.A OG no hydrogen 3.160 N/A VAL 87.A N ASN 236.A OD1 no hydrogen 2.737 N/A ASN 91.A ND2 HIS 72.A O no hydrogen 2.746 N/A ASN 91.A ND2 TYR 75.A O no hydrogen 2.832 N/A ASN 91.A ND2 VAL 78.A O no hydrogen 2.788 N/A THR 93.A N PHE 80.A O no hydrogen 2.678 N/A THR 93.A OG1 HIS 79.A NE2 no hydrogen 2.760 N/A THR 93.A OG1 GLU 233.A O no hydrogen 2.722 N/A SER 94.A N GLY 235.A O no hydrogen 2.925 N/A SER 94.A OG GLY 85.A O no hydrogen 3.180 N/A SER 94.A OG HIS 96.A NE2 no hydrogen 2.840 N/A SER 94.A OG ASN 236.A OD1 no hydrogen 2.955 N/A LEU 95.A N SER 82.A O no hydrogen 2.836 N/A HIS 96.A N LEU 237.A O no hydrogen 3.026 N/A HIS 96.A NE2 SER 94.A OG no hydrogen 2.840 N/A GLU 98.A N TYR 239.A O no hydrogen 2.559 N/A TYR 100.A OH ASP 133.A OD2 no hydrogen 2.313 N/A TYR 103.A N TYR 100.A O no hydrogen 2.989 N/A PHE 104.A N ALA 101.A O no hydrogen 3.142 N/A GLY 106.A N GLY 102.A O no hydrogen 2.761 N/A ALA 108.A N GLY 105.A O no hydrogen 2.903 N/A ALA 109.A N GLY 106.A O no hydrogen 3.000 N/A SER 110.A OG VAL 107.A O no hydrogen 3.413 N/A SER 111.A OG ASP 169.A OD1 no hydrogen 3.280 N/A SER 111.A OG ASP 169.A OD2 no hydrogen 2.526 N/A GLU 112.A N ASP 169.A OD1 no hydrogen 2.795 N/A THR 113.A N ASP 169.A OD1 no hydrogen 3.149 N/A THR 113.A OG1 GLN 167.A O no hydrogen 3.247 N/A LYS 115.A N SER 111.A OG no hydrogen 3.347 N/A LYS 115.A NZ GLU 166.A O no hydrogen 3.009 N/A VAL 116.A N GLU 141.A O no hydrogen 3.341 N/A GLY 117.A N VAL 170.A O no hydrogen 3.016 N/A VAL 118.A N PHE 143.A O no hydrogen 2.604 N/A ILE 119.A N TYR 172.A O no hydrogen 3.030 N/A ALA 120.A N ARG 145.A O no hydrogen 2.944 N/A GLN 125.A N PHE 122.A O no hydrogen 3.182 N/A VAL 128.A N GLN 125.A O no hydrogen 2.902 N/A GLU 129.A N PRO 126.A O no hydrogen 2.804 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.942 N/A GLY 130.A N PRO 126.A O no hydrogen 3.246 N/A PHE 131.A N GLU 127.A O no hydrogen 2.915 N/A VAL 132.A N VAL 128.A O no hydrogen 3.312 N/A ASP 133.A N GLU 129.A O no hydrogen 2.934 N/A GLY 134.A N GLY 130.A O no hydrogen 3.112 N/A ALA 135.A N PHE 131.A O no hydrogen 3.022 N/A LYS 136.A N ASP 133.A O no hydrogen 3.107 N/A TYR 137.A N ASP 133.A O no hydrogen 2.612 N/A ASN 138.A ND2 HIS 114.A NE2 no hydrogen 2.969 N/A SER 140.A N ALA 135.A O no hydrogen 2.812 N/A PHE 143.A N VAL 116.A O no hydrogen 2.700 N/A ARG 145.A N VAL 118.A O no hydrogen 2.842 N/A ARG 145.A NE VAL 144.A O no hydrogen 2.785 N/A VAL 147.A N ALA 120.A O no hydrogen 2.461 N/A ALA 153.A N THR 151.A O no hydrogen 3.017 N/A LYS 155.A N ASP 152.A OD1 no hydrogen 3.005 N/A ALA 156.A N ASP 152.A O no hydrogen 2.931 N/A LEU 157.A N ALA 153.A O no hydrogen 2.804 N/A GLU 158.A N ASP 154.A O no hydrogen 2.948 N/A LEU 159.A N LYS 155.A O no hydrogen 2.837 N/A PHE 160.A N ALA 156.A O no hydrogen 2.992 N/A GLN 161.A N LEU 157.A O no hydrogen 2.891 N/A GLU 162.A N GLU 158.A O no hydrogen 2.728 N/A LEU 163.A N LEU 159.A O no hydrogen 3.049 N/A GLN 164.A NE2 ASP 191.A OD2 no hydrogen 3.401 N/A LYS 165.A N GLN 161.A O no hydrogen 2.984 N/A GLU 166.A N LEU 163.A O no hydrogen 3.190 N/A GLN 167.A N GLN 164.A O no hydrogen 3.007 N/A VAL 168.A N LEU 163.A O no hydrogen 3.272 N/A ASP 169.A N LYS 115.A O no hydrogen 3.270 N/A PHE 171.A N PHE 192.A O no hydrogen 2.743 N/A TYR 172.A N GLY 117.A O no hydrogen 2.833 N/A TYR 172.A OH THR 212.A OG1 no hydrogen 2.615 N/A ALA 174.A N TYR 172.A O no hydrogen 3.037 N/A GLY 175.A N PRO 173.A O no hydrogen 2.979 N/A TYR 178.A OH ILE 119.A O no hydrogen 2.758 N/A HIS 179.A N GLY 175.A O no hydrogen 2.858 N/A HIS 179.A ND1 PRO 173.A O no hydrogen 2.785 N/A VAL 182.A N TYR 178.A O no hydrogen 3.163 N/A VAL 183.A N HIS 179.A O no hydrogen 2.788 N/A GLU 184.A N VAL 180.A O no hydrogen 2.752 N/A ALA 185.A N PRO 181.A O no hydrogen 3.282 N/A ILE 186.A N VAL 182.A O no hydrogen 3.118 N/A LYS 187.A N VAL 183.A O no hydrogen 2.813 N/A ASP 188.A N GLU 184.A O no hydrogen 2.774 N/A GLN 189.A N ALA 185.A O no hydrogen 2.920 N/A GLY 190.A N ILE 186.A O no hydrogen 2.661 N/A GLY 190.A N LYS 187.A O no hydrogen 3.129 N/A ASP 191.A N ILE 186.A O no hydrogen 3.294 N/A PHE 192.A N ASP 169.A O no hydrogen 3.072 N/A ALA 193.A N THR 207.A O no hydrogen 2.825 N/A ILE 194.A N PHE 171.A O no hydrogen 2.677 N/A GLY 195.A N THR 210.A O no hydrogen 2.483 N/A TYR 196.A OH GLU 127.A OE1 no hydrogen 3.207 N/A VAL 197.A N THR 212.A O no hydrogen 2.930 N/A GLN 200.A NE2 TYR 196.A O no hydrogen 3.077 N/A SER 206.A OG GLY 205.A O no hydrogen 2.871 N/A LEU 209.A N ALA 193.A O no hydrogen 3.123 N/A THR 210.A OG1 LEU 209.A O no hydrogen 2.571 N/A THR 210.A OG1 GLY 249.A O no hydrogen 3.488 N/A SER 211.A OG ASP 199.A O no hydrogen 2.587 N/A THR 212.A N GLY 195.A O no hydrogen 2.794 N/A THR 212.A OG1 TYR 172.A OH no hydrogen 2.615 N/A THR 212.A OG1 GLY 195.A O no hydrogen 3.237 N/A VAL 213.A N SER 247.A O no hydrogen 3.049 N/A GLN 214.A N VAL 197.A O no hydrogen 3.499 N/A HIS 215.A N VAL 245.A O no hydrogen 2.882 N/A HIS 215.A NE2 SER 247.A OG no hydrogen 2.691 N/A VAL 216.A N GLN 214.A O no hydrogen 3.063 N/A ASP 218.A N ASP 217.A OD1 no hydrogen 2.813 N/A LEU 219.A N HIS 215.A O no hydrogen 2.799 N/A TYR 220.A N VAL 216.A O no hydrogen 2.869 N/A TYR 220.A OH HIS 60.A ND1 no hydrogen 2.734 N/A VAL 221.A N ASP 217.A O no hydrogen 3.186 N/A LEU 222.A N ASP 218.A O no hydrogen 2.740 N/A VAL 223.A N LEU 219.A O no hydrogen 2.810 N/A ALA 224.A N TYR 220.A O no hydrogen 2.978 N/A ALA 224.A N VAL 221.A O no hydrogen 2.891 N/A LYS 225.A N VAL 221.A O no hydrogen 2.971 N/A LYS 225.A N LEU 222.A O no hydrogen 3.095 N/A ARG 226.A N LEU 222.A O no hydrogen 3.115 N/A PHE 227.A N VAL 223.A O no hydrogen 3.282 N/A GLN 228.A N LYS 225.A O no hydrogen 3.201 N/A GLU 229.A N LYS 225.A O no hydrogen 2.981 N/A GLY 235.A N ILE 92.A O no hydrogen 2.980 N/A LEU 237.A N SER 94.A O no hydrogen 2.787 N/A TYR 239.A N HIS 96.A O no hydrogen 2.758 N/A PHE 241.A N ASP 240.A OD1 no hydrogen 2.616 N/A ASP 243.A N ASP 240.A O no hydrogen 3.075 N/A GLY 244.A N PHE 241.A O no hydrogen 3.311 N/A SER 247.A N VAL 213.A O no hydrogen 2.946 N/A SER 247.A OG HIS 215.A NE2 no hydrogen 2.691 N/A GLY 249.A N SER 211.A O no hydrogen 2.641 N/A GLU 250.A N ASP 199.A OD1 no hydrogen 3.254 N/A SER 252.A N LEU 209.A O no hydrogen 2.858 N/A SER 252.A OG SER 206.A O no hydrogen 3.555 N/A VAL 254.A N SER 252.A OG no hydrogen 3.184 N/A VAL 255.A N SER 252.A O no hydrogen 2.996 N/A ARG 260.A NH2 SER 252.A O no hydrogen 2.529 N/A ARG 260.A NH2 VAL 255.A O no hydrogen 3.553 N/A GLN 262.A N GLU 258.A O no hydrogen 3.028 N/A ILE 263.A N VAL 259.A O no hydrogen 3.364 N/A THR 264.A N ARG 260.A O no hydrogen 2.856 N/A THR 264.A OG1 ARG 260.A O no hydrogen 2.897 N/A ASP 265.A N GLU 261.A O no hydrogen 2.888 N/A ALA 266.A N GLN 262.A O no hydrogen 2.861 N/A ILE 267.A N ILE 263.A O no hydrogen 2.633 N/A SER 268.A N THR 264.A O no hydrogen 3.235 N/A SER 268.A OG THR 264.A O no hydrogen 2.736 N/A SER 268.A OG ASP 265.A O no hydrogen 2.602 N/A THR 269.A N ASP 265.A O no hydrogen 2.838 N/A THR 269.A OG1 ASP 265.A O no hydrogen 2.957 N/A TYR 270.A N ALA 266.A O no hydrogen 2.811 N/A TYR 270.A OH ASP 240.A OD2 no hydrogen 2.864 N/A ILE 271.A N ILE 267.A O no hydrogen 2.629 N/A GLN 272.A N SER 268.A O no hydrogen 3.117 N/A GLN 272.A N THR 269.A O no hydrogen 2.874 N/A THR 273.A N THR 269.A O no hydrogen 2.582 N/A HIS 278.A N PHE 276.A O no hydrogen 2.335 N/A