Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1uek_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N VAL 41.A O no hydrogen 2.767 N/A ARG 3.A N LEU 39.A O no hydrogen 2.822 N/A ARG 3.A NE GLN 100.A OE1 no hydrogen 2.893 N/A ARG 3.A NH2 GLN 100.A OE1 no hydrogen 3.136 N/A ALA 5.A N ASP 37.A O no hydrogen 2.886 N/A ALA 7.A N LEU 35.A O no hydrogen 2.946 N/A LYS 8.A N LEU 91.A O no hydrogen 2.900 N/A LYS 8.A NZ ASN 10.A OD1 no hydrogen 2.626 N/A LYS 8.A NZ GLY 90.A O no hydrogen 2.972 N/A VAL 9.A N ALA 31.A O no hydrogen 2.983 N/A ASN 10.A N SER 231.A OG no hydrogen 3.095 N/A ASN 10.A ND2 THR 28.A OG1 no hydrogen 3.001 N/A LEU 11.A N LEU 29.A O no hydrogen 2.759 N/A GLY 12.A N ASN 10.A O no hydrogen 2.842 N/A LEU 13.A N TRP 199.A O no hydrogen 2.839 N/A SER 14.A N HIS 27.A O no hydrogen 2.854 N/A SER 14.A OG PRO 179.A O no hydrogen 2.677 N/A VAL 15.A N SER 201.A OG no hydrogen 3.094 N/A ARG 16.A N GLU 25.A O no hydrogen 2.674 N/A ARG 16.A NE ASP 180.A OD2 no hydrogen 2.793 N/A ARG 16.A NH2 GLY 178.A O no hydrogen 3.012 N/A ARG 18.A NE GLY 22.A O no hydrogen 3.102 N/A ARG 19.A N TYR 23.A O no hydrogen 2.650 N/A ARG 19.A NE ASP 21.A OD1 no hydrogen 3.356 N/A ARG 19.A NE ASP 21.A OD2 no hydrogen 2.875 N/A ARG 19.A NH1 ASP 21.A OD2 no hydrogen 2.325 N/A ARG 19.A NH2 GLU 25.A OE2 no hydrogen 3.060 N/A GLY 22.A N ARG 19.A O no hydrogen 2.789 N/A TYR 23.A N ASP 21.A OD1 no hydrogen 2.724 N/A GLU 25.A N PHE 17.A O no hydrogen 2.973 N/A LEU 26.A N GLY 139.A O no hydrogen 2.810 N/A HIS 27.A N SER 14.A O no hydrogen 2.905 N/A HIS 27.A NE2 GLU 136.A OE1 no hydrogen 2.797 N/A THR 28.A N ALA 137.A O no hydrogen 2.995 N/A THR 28.A OG1 GLY 12.A O no hydrogen 2.709 N/A LEU 29.A N GLY 12.A O no hydrogen 3.300 N/A PHE 30.A N ALA 135.A O no hydrogen 2.741 N/A ALA 31.A N VAL 9.A O no hydrogen 2.937 N/A PHE 33.A N ALA 7.A O no hydrogen 2.884 N/A SER 34.A N THR 264.A O no hydrogen 2.920 N/A ASP 37.A N ALA 5.A O no hydrogen 2.934 N/A ARG 38.A N GLU 82.A O no hydrogen 3.093 N/A ARG 38.A NE GLU 2.A OE2 no hydrogen 2.727 N/A ARG 38.A NH1 GLU 82.A OE2 no hydrogen 3.293 N/A ARG 38.A NH2 GLU 2.A OE1 no hydrogen 2.533 N/A ARG 38.A NH2 GLU 2.A OE2 no hydrogen 3.404 N/A LEU 39.A N ARG 3.A O no hydrogen 2.991 N/A VAL 40.A N LEU 80.A O no hydrogen 2.937 N/A VAL 41.A N MET 1.A O no hydrogen 2.763 N/A GLU 42.A N ARG 78.A O no hydrogen 2.922 N/A VAL 44.A N GLY 76.A O no hydrogen 3.030 N/A HIS 49.A N VAL 77.A O no hydrogen 2.946 N/A HIS 49.A ND1 VAL 77.A O no hydrogen 3.270 N/A GLN 51.A N ILE 79.A O no hydrogen 2.890 N/A GLU 57.A N TYR 54.A O no hydrogen 3.053 N/A ASN 58.A N GLY 55.A O no hydrogen 3.054 N/A ARG 62.A N ASN 58.A O no hydrogen 3.150 N/A ARG 62.A NE GLU 57.A O no hydrogen 3.401 N/A ARG 62.A NH2 GLU 57.A O no hydrogen 3.032 N/A ALA 63.A N LEU 59.A O no hydrogen 2.807 N/A ALA 64.A N ALA 60.A O no hydrogen 3.073 N/A SER 65.A N TYR 61.A O no hydrogen 2.978 N/A LEU 66.A N ARG 62.A O no hydrogen 2.915 N/A TYR 67.A N ALA 63.A O no hydrogen 2.888 N/A TYR 67.A OH TYR 109.A O no hydrogen 2.590 N/A LEU 68.A N ALA 64.A O no hydrogen 2.996 N/A GLU 69.A N SER 65.A O no hydrogen 3.123 N/A ALA 70.A N LEU 66.A O no hydrogen 2.947 N/A ALA 71.A N TYR 67.A O no hydrogen 2.814 N/A GLY 72.A N GLU 69.A O no hydrogen 3.210 N/A GLN 73.A N LEU 68.A O no hydrogen 2.838 N/A GLY 76.A N VAL 44.A O no hydrogen 2.827 N/A VAL 77.A N GLY 47.A O no hydrogen 2.944 N/A ARG 78.A N GLU 42.A O no hydrogen 2.852 N/A ILE 79.A N HIS 49.A O no hydrogen 2.806 N/A LEU 80.A N VAL 40.A O no hydrogen 2.857 N/A LEU 81.A N GLN 51.A O no hydrogen 2.881 N/A GLU 82.A N ARG 38.A O no hydrogen 2.839 N/A LYS 83.A NZ ASP 37.A OD2 no hydrogen 2.733 N/A LYS 83.A NZ ASP 97.A OD1 no hydrogen 3.241 N/A ARG 84.A N ASP 37.A OD1 no hydrogen 2.776 N/A ARG 84.A NH1 ALA 36.A O no hydrogen 2.871 N/A ILE 85.A N ASP 37.A OD1 no hydrogen 2.921 N/A SER 96.A N GLY 92.A O no hydrogen 2.947 N/A SER 96.A OG PRO 6.A O no hydrogen 2.641 N/A ASP 97.A N GLY 93.A O no hydrogen 2.813 N/A ALA 98.A N GLY 94.A O no hydrogen 3.063 N/A ALA 99.A N SER 95.A O no hydrogen 2.999 N/A GLN 100.A N SER 96.A O no hydrogen 2.983 N/A VAL 101.A N ASP 97.A O no hydrogen 3.065 N/A LEU 102.A N ALA 98.A O no hydrogen 2.980 N/A LEU 103.A N ALA 99.A O no hydrogen 2.913 N/A ALA 104.A N GLN 100.A O no hydrogen 2.789 N/A LEU 105.A N VAL 101.A O no hydrogen 2.938 N/A GLN 106.A N LEU 102.A O no hydrogen 2.904 N/A ALA 107.A N LEU 103.A O no hydrogen 3.163 N/A LEU 108.A N ALA 104.A O no hydrogen 2.920 N/A TYR 109.A N LEU 105.A O no hydrogen 2.752 N/A TYR 109.A OH GLY 76.A O no hydrogen 2.717 N/A ALA 117.A N ASP 114.A OD2 no hydrogen 3.071 N/A LEU 118.A N ASP 114.A O no hydrogen 3.206 N/A ALA 119.A N LEU 115.A O no hydrogen 2.811 N/A ARG 120.A N PHE 116.A O no hydrogen 2.874 N/A THR 121.A N ALA 117.A O no hydrogen 3.075 N/A THR 121.A OG1 ALA 117.A O no hydrogen 3.200 N/A LEU 122.A N LEU 118.A O no hydrogen 2.942 N/A GLY 123.A N ALA 119.A O no hydrogen 2.803 N/A ASP 125.A N SER 95.A OG no hydrogen 3.009 N/A VAL 126.A N GLY 123.A O no hydrogen 3.159 N/A PHE 129.A N ASP 125.A O no hydrogen 3.027 N/A LEU 130.A N VAL 126.A O no hydrogen 3.127 N/A LEU 131.A N PHE 128.A O no hydrogen 3.040 N/A ALA 135.A N PHE 30.A O no hydrogen 3.040 N/A GLU 136.A N LYS 145.A O no hydrogen 2.721 N/A ALA 137.A N THR 28.A O no hydrogen 2.795 N/A ARG 138.A N ARG 143.A O no hydrogen 2.824 N/A ARG 138.A NH1 ASP 180.A OD1 no hydrogen 3.268 N/A ARG 138.A NH1 ASP 180.A OD2 no hydrogen 2.815 N/A ARG 138.A NH2 ASP 180.A OD1 no hydrogen 2.834 N/A GLY 139.A N GLU 25.A OE1 no hydrogen 2.879 N/A VAL 140.A N GLU 142.A OE2 no hydrogen 2.755 N/A GLY 141.A N ARG 138.A O no hydrogen 2.970 N/A GLU 142.A N GLU 142.A OE2 no hydrogen 2.636 N/A ARG 143.A N ARG 138.A O no hydrogen 3.273 N/A LYS 145.A N GLU 136.A O no hydrogen 2.786 N/A LYS 145.A NZ GLU 136.A OE2 no hydrogen 2.563 N/A LEU 147.A N GLY 134.A O no hydrogen 3.004 N/A VAL 152.A N LEU 265.A O no hydrogen 2.922 N/A ALA 154.A N GLY 263.A O no hydrogen 2.982 N/A VAL 155.A N GLY 239.A O no hydrogen 2.940 N/A VAL 156.A N TRP 261.A O no hydrogen 2.903 N/A PHE 157.A N PHE 237.A O no hydrogen 2.852 N/A PHE 158.A N ARG 259.A O no hydrogen 2.738 N/A ARG 162.A NH1 GLY 88.A O no hydrogen 3.110 N/A LEU 167.A N PRO 164.A O no hydrogen 3.199 N/A ARG 170.A N PRO 166.A O no hydrogen 2.788 N/A ALA 171.A N LEU 167.A O no hydrogen 2.998 N/A VAL 172.A N TYR 169.A O no hydrogen 3.125 N/A ARG 173.A N ASP 176.A OD1 no hydrogen 2.872 N/A ARG 173.A NH2 ARG 170.A O no hydrogen 2.709 N/A ARG 173.A NH2 VAL 172.A O no hydrogen 2.885 N/A ASP 176.A N ARG 173.A O no hydrogen 2.694 N/A PHE 177.A N PRO 174.A O no hydrogen 3.220 N/A GLY 178.A N VAL 15.A O no hydrogen 2.810 N/A LEU 181.A N HIS 27.A ND1 no hydrogen 2.968 N/A ILE 186.A N PRO 182.A O no hydrogen 2.932 N/A LEU 187.A N VAL 183.A O no hydrogen 2.981 N/A GLU 188.A N GLU 184.A O no hydrogen 2.923 N/A ALA 189.A N ALA 185.A O no hydrogen 2.962 N/A LEU 190.A N ILE 186.A O no hydrogen 2.979 N/A ALA 191.A N LEU 187.A O no hydrogen 3.076 N/A ARG 192.A N GLU 188.A O no hydrogen 2.933 N/A ARG 192.A NE GLU 194.A OE1 no hydrogen 3.408 N/A GLY 193.A N LEU 190.A O no hydrogen 3.256 N/A GLU 194.A N ALA 189.A O no hydrogen 2.933 N/A TYR 198.A OH GLY 227.A O no hydrogen 2.686 N/A TRP 199.A NE1 SER 14.A OG no hydrogen 3.135 N/A ASN 200.A ND2 MET 230.A O no hydrogen 2.839 N/A ASN 200.A ND2 GLY 232.A O no hydrogen 2.835 N/A SER 201.A N LEU 13.A O no hydrogen 2.821 N/A SER 201.A OG ASP 176.A O no hydrogen 3.531 N/A LEU 202.A N ASN 200.A OD1 no hydrogen 2.882 N/A GLU 203.A N ASN 200.A O no hydrogen 2.900 N/A GLY 204.A N SER 201.A O no hydrogen 3.147 N/A ALA 206.A N LEU 202.A O no hydrogen 2.967 N/A PHE 207.A N GLU 203.A O no hydrogen 2.878 N/A ARG 208.A N GLY 204.A O no hydrogen 3.316 N/A ARG 208.A NH1 ASP 176.A OD2 no hydrogen 2.936 N/A ARG 208.A NH2 ASP 176.A OD1 no hydrogen 3.133 N/A LEU 209.A N PRO 205.A O no hydrogen 2.881 N/A PHE 210.A N ALA 206.A O no hydrogen 2.716 N/A LEU 213.A N PHE 210.A O no hydrogen 2.853 N/A LYS 214.A N PRO 211.A O no hydrogen 3.062 N/A LYS 214.A NZ PHE 207.A O no hydrogen 3.305 N/A VAL 216.A N GLU 212.A O no hydrogen 3.191 N/A ARG 217.A N LEU 213.A O no hydrogen 3.112 N/A GLY 218.A N LYS 214.A O no hydrogen 2.901 N/A ARG 219.A N GLU 215.A O no hydrogen 3.022 N/A MET 220.A N VAL 216.A O no hydrogen 3.213 N/A ARG 221.A N ARG 217.A O no hydrogen 2.948 N/A ALA 222.A N GLY 218.A O no hydrogen 2.979 N/A LEU 223.A N MET 220.A O no hydrogen 3.234 N/A GLY 224.A N ARG 221.A O no hydrogen 2.904 N/A LEU 225.A N MET 220.A O no hydrogen 3.366 N/A ARG 226.A N LEU 240.A O no hydrogen 2.800 N/A ARG 226.A NE GLU 194.A O no hydrogen 3.241 N/A ARG 226.A NH1 GLU 242.A OE1 no hydrogen 3.393 N/A ARG 226.A NH2 GLU 194.A O no hydrogen 2.961 N/A GLY 227.A N GLU 195.A OE1 no hydrogen 2.769 N/A LEU 229.A N PHE 238.A O no hydrogen 3.042 N/A MET 230.A N GLU 203.A OE2 no hydrogen 2.718 N/A SER 231.A N ALA 236.A O no hydrogen 2.757 N/A SER 231.A OG GLY 90.A O no hydrogen 3.155 N/A GLY 234.A N SER 231.A O no hydrogen 2.914 N/A SER 235.A OG LEU 161.A O no hydrogen 3.275 N/A ALA 236.A N ALA 89.A O no hydrogen 2.991 N/A PHE 237.A N PHE 157.A O no hydrogen 2.841 N/A PHE 238.A N LEU 229.A O no hydrogen 2.922 N/A GLY 239.A N VAL 155.A O no hydrogen 2.977 N/A LEU 240.A N ARG 226.A O no hydrogen 2.807 N/A ALA 241.A N PRO 153.A O no hydrogen 3.031 N/A GLU 242.A N HIS 246.A ND1 no hydrogen 2.914 N/A HIS 246.A NE2 LEU 223.A O no hydrogen 2.746 N/A ALA 247.A N GLY 243.A O no hydrogen 2.983 N/A ARG 248.A N PRO 244.A O no hydrogen 2.993 N/A ARG 248.A NH1 ASP 245.A OD1 no hydrogen 2.546 N/A ARG 248.A NH2 ASP 245.A OD1 no hydrogen 2.992 N/A ARG 249.A N ASP 245.A O no hydrogen 2.912 N/A ALA 250.A N HIS 246.A O no hydrogen 2.860 N/A ALA 251.A N ALA 247.A O no hydrogen 2.939 N/A GLU 252.A N ARG 248.A O no hydrogen 2.988 N/A ALA 253.A N ARG 249.A O no hydrogen 3.077 N/A LEU 254.A N ALA 250.A O no hydrogen 3.030 N/A ARG 255.A N GLU 252.A O no hydrogen 3.282 N/A ARG 255.A NE ALA 260.A O no hydrogen 3.161 N/A ARG 255.A NH2 ALA 260.A O no hydrogen 2.792 N/A ALA 256.A N ALA 253.A O no hydrogen 3.474 N/A TRP 257.A N LEU 254.A O no hydrogen 2.875 N/A ARG 259.A N PHE 158.A O no hydrogen 3.117 N/A ARG 259.A NH1 ALA 260.A O no hydrogen 3.340 N/A ARG 259.A NH2 ALA 260.A O no hydrogen 3.536 N/A TRP 261.A N VAL 156.A O no hydrogen 2.931 N/A GLY 263.A N ALA 154.A O no hydrogen 2.974 N/A THR 264.A N SER 34.A OG no hydrogen 2.871 N/A LEU 265.A N VAL 152.A O no hydrogen 2.904 N/A GLY 266.A N PRO 32.A O no hydrogen 2.794 N/A GLY 267.A N LEU 149.A O no hydrogen 3.116 N/A