Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4p4o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N GLN 1.A O no hydrogen 2.777 N/A LEU 6.A N MET 3.A O no hydrogen 3.276 N/A ALA 9.A N ASP 5.A O no hydrogen 2.562 N/A LEU 10.A N ASN 7.A O no hydrogen 3.068 N/A LYS 13.A N GLY 11.A O no hydrogen 2.495 N/A VAL 16.A N GLU 12.A O no hydrogen 2.896 N/A SER 17.A N LYS 13.A O no hydrogen 3.268 N/A SER 17.A OG LYS 13.A O no hydrogen 3.250 N/A SER 18.A OG TYR 14.A O no hydrogen 2.871 N/A TYR 19.A N VAL 16.A O no hydrogen 3.156 N/A HIS 20.A N VAL 16.A O no hydrogen 3.379 N/A ALA 26.A N LEU 23.A O no hydrogen 2.430 N/A LYS 30.A NZ ASP 53.A OD1 no hydrogen 2.722 N/A LYS 30.A NZ ASP 53.A OD2 no hydrogen 2.662 N/A LYS 32.A N LYS 28.A O no hydrogen 3.164 N/A ALA 33.A N PRO 29.A O no hydrogen 3.235 N/A ILE 34.A N LYS 30.A O no hydrogen 2.702 N/A GLN 35.A N LEU 31.A O no hydrogen 2.784 N/A GLU 36.A N LYS 32.A O no hydrogen 2.872 N/A LEU 37.A N ALA 33.A O no hydrogen 2.655 N/A THR 38.A N ILE 34.A O no hydrogen 2.943 N/A THR 38.A OG1 ILE 34.A O no hydrogen 3.087 N/A THR 38.A OG1 GLN 35.A O no hydrogen 3.427 N/A GLN 39.A N GLU 36.A O no hydrogen 3.026 N/A GLN 39.A NE2 GLU 36.A O no hydrogen 2.976 N/A VAL 40.A N LEU 37.A O no hydrogen 2.898 N/A PHE 43.A N VAL 40.A O no hydrogen 3.019 N/A ALA 48.A N GLY 44.A O no hydrogen 2.903 N/A ALA 49.A N PRO 45.A O no hydrogen 2.893 N/A ALA 50.A N ARG 46.A O no hydrogen 2.922 N/A LEU 51.A N ALA 47.A O no hydrogen 2.911 N/A PHE 52.A N ALA 48.A O no hydrogen 2.987 N/A ASP 53.A N ALA 49.A O no hydrogen 2.821 N/A ARG 54.A N ALA 50.A O no hydrogen 2.810 N/A GLU 55.A N LEU 51.A O no hydrogen 2.938 N/A GLY 56.A N PHE 52.A O no hydrogen 3.228 N/A ILE 57.A N LEU 51.A O no hydrogen 3.336 N/A PHE 58.A N GLU 62.A OE1 no hydrogen 2.680 N/A THR 59.A N GLU 62.A OE1 no hydrogen 2.934 N/A VAL 60.A N GLU 36.A OE2 no hydrogen 3.166 N/A LEU 63.A N THR 59.A O no hydrogen 3.037 N/A LEU 64.A N VAL 60.A O no hydrogen 2.804 N/A GLN 65.A N ASP 61.A O no hydrogen 3.089 N/A LYS 66.A N GLU 62.A O no hydrogen 2.965 N/A LYS 66.A N LEU 63.A O no hydrogen 3.168 N/A LYS 66.A NZ GLU 55.A O no hydrogen 2.916 N/A LYS 66.A NZ GLU 55.A OE1 no hydrogen 3.522 N/A SER 69.A N LYS 66.A O no hydrogen 2.851 N/A SER 69.A OG LYS 66.A O no hydrogen 2.621 N/A ILE 70.A N ALA 67.A O no hydrogen 3.010 N/A LEU 73.A N ILE 70.A O no hydrogen 3.530 N/A THR 74.A N GLN 77.A OE1 no hydrogen 2.945 N/A GLN 77.A N THR 74.A OG1 no hydrogen 3.036 N/A GLN 77.A NE2 GLY 42.A O no hydrogen 2.946 N/A ARG 78.A N THR 74.A O no hydrogen 3.012 N/A ARG 78.A NH1 ALA 67.A O no hydrogen 3.176 N/A ARG 78.A NH1 ILE 70.A O no hydrogen 3.469 N/A ARG 78.A NH2 ILE 70.A O no hydrogen 2.794 N/A VAL 79.A N ASP 75.A O no hydrogen 3.057 N/A GLY 80.A N GLN 76.A O no hydrogen 3.065 N/A ILE 81.A N GLN 77.A O no hydrogen 2.899 N/A LYS 82.A N ARG 78.A O no hydrogen 2.922 N/A TYR 83.A N VAL 79.A O no hydrogen 3.014 N/A TYR 83.A OH GLU 170.A OE2 no hydrogen 2.656 N/A PHE 84.A N ILE 81.A O no hydrogen 3.228 N/A TYR 85.A OH ASP 61.A OD1 no hydrogen 2.312 N/A ILE 87.A N TYR 83.A O no hydrogen 2.862 N/A ASN 88.A N PHE 84.A O no hydrogen 3.041 N/A GLU 89.A N ASP 86.A O no hydrogen 3.143 N/A ILE 91.A N SER 130.A O no hydrogen 2.791 N/A MET 93.A N PRO 128.A O no hydrogen 2.792 N/A GLU 95.A N PRO 92.A O no hydrogen 2.788 N/A SER 96.A N PRO 92.A O no hydrogen 3.232 N/A VAL 97.A N MET 93.A O no hydrogen 2.976 N/A HIS 99.A N GLU 95.A O no hydrogen 3.020 N/A GLU 100.A N SER 96.A O no hydrogen 2.914 N/A ASN 101.A N VAL 97.A O no hydrogen 2.920 N/A TYR 102.A N LEU 98.A O no hydrogen 2.769 N/A LEU 103.A N HIS 99.A O no hydrogen 2.833 N/A ARG 104.A N GLU 100.A O no hydrogen 2.951 N/A ARG 104.A NE ILE 117.A O no hydrogen 3.127 N/A GLU 105.A N ASN 101.A O no hydrogen 2.932 N/A LYS 106.A N TYR 102.A O no hydrogen 2.915 N/A LYS 106.A NZ GLU 105.A OE1 no hydrogen 2.888 N/A CYS 107.A N LEU 103.A O no hydrogen 2.905 N/A MET 108.A N ARG 104.A O no hydrogen 3.052 N/A GLU 109.A N GLU 105.A O no hydrogen 3.055 N/A VAL 110.A N LYS 106.A O no hydrogen 3.065 N/A LEU 111.A N CYS 107.A O no hydrogen 2.846 N/A GLY 112.A N CYS 107.A O no hydrogen 3.232 N/A GLY 112.A N MET 108.A O no hydrogen 2.903 N/A PHE 115.A N GLY 112.A O no hydrogen 3.316 N/A SER 116.A N SER 138.A O no hydrogen 2.678 N/A LEU 118.A N ILE 136.A O no hydrogen 2.946 N/A ILE 119.A N GLU 100.A OE2 no hydrogen 3.457 N/A CYS 120.A N ASP 134.A O no hydrogen 2.794 N/A CYS 120.A SG THR 218.A OG1 no hydrogen 3.728 N/A GLY 121.A N PHE 217.A O no hydrogen 2.771 N/A SER 122.A OG SER 130.A OG no hydrogen 2.608 N/A TYR 123.A OH GLU 100.A OE1 no hydrogen 2.795 N/A ARG 124.A N CYS 120.A O no hydrogen 3.218 N/A ARG 124.A NH1 THR 218.A OG1 no hydrogen 2.841 N/A ARG 124.A NH1 GLU 287.A OE1 no hydrogen 3.466 N/A ARG 124.A NH1 GLU 287.A OE2 no hydrogen 2.829 N/A ARG 124.A NH2 GLU 287.A OE1 no hydrogen 2.716 N/A ARG 125.A N GLY 121.A O no hydrogen 3.344 N/A ARG 125.A NE ASP 305.A OD1 no hydrogen 3.219 N/A ARG 125.A NE ASP 305.A OD2 no hydrogen 3.164 N/A ARG 125.A NH1 THR 218.A O no hydrogen 2.631 N/A ARG 125.A NH2 ASP 305.A OD1 no hydrogen 3.046 N/A ARG 126.A N TYR 123.A O no hydrogen 2.928 N/A HIS 127.A N SER 122.A O no hydrogen 3.078 N/A HIS 127.A NE2 ASP 305.A OD2 no hydrogen 2.692 N/A SER 130.A N ILE 91.A O no hydrogen 2.858 N/A SER 130.A OG SER 122.A OG no hydrogen 2.608 N/A VAL 133.A N ARG 199.A O no hydrogen 2.776 N/A ALA 135.A N ASP 201.A O no hydrogen 2.758 N/A ILE 136.A N LEU 118.A O no hydrogen 2.832 N/A LEU 137.A N ARG 203.A O no hydrogen 2.809 N/A SER 138.A N SER 116.A O no hydrogen 2.960 N/A ARG 139.A NH2 PRO 144.A O no hydrogen 2.784 N/A THR 140.A N ASP 114.A O no hydrogen 2.873 N/A ALA 143.A N THR 140.A O no hydrogen 3.438 N/A VAL 150.A N GLU 206.A OE2 no hydrogen 2.745 N/A ALA 152.A N PRO 149.A O no hydrogen 2.827 N/A THR 153.A N VAL 150.A O no hydrogen 2.944 N/A THR 153.A OG1 VAL 150.A O no hydrogen 2.613 N/A GLY 154.A N ALA 151.A O no hydrogen 3.400 N/A HIS 158.A N GLY 154.A O no hydrogen 3.168 N/A PHE 159.A N VAL 155.A O no hydrogen 2.885 N/A VAL 160.A N LEU 156.A O no hydrogen 2.900 N/A GLU 161.A N GLY 157.A O no hydrogen 2.996 N/A PHE 162.A N HIS 158.A O no hydrogen 3.015 N/A LEU 163.A N PHE 159.A O no hydrogen 3.127 N/A GLU 164.A N VAL 160.A O no hydrogen 2.900 N/A SER 165.A N GLU 161.A O no hydrogen 2.911 N/A SER 165.A OG PHE 162.A O no hydrogen 2.564 N/A LEU 166.A N PHE 162.A O no hydrogen 3.212 N/A LYS 167.A N GLU 164.A O no hydrogen 2.783 N/A TYR 168.A N LEU 163.A O no hydrogen 3.040 N/A LEU 169.A N LEU 163.A O no hydrogen 3.284 N/A GLU 170.A N MET 183.A O no hydrogen 2.937 N/A MET 173.A N MET 181.A O no hydrogen 2.769 N/A ALA 174.A N MET 181.A O no hydrogen 3.215 N/A GLY 176.A N LYS 179.A O no hydrogen 3.056 N/A TYR 180.A N ILE 202.A O no hydrogen 2.851 N/A MET 181.A N ALA 174.A O no hydrogen 2.881 N/A GLY 182.A N VAL 200.A O no hydrogen 2.931 N/A MET 183.A N ALA 171.A O no hydrogen 2.879 N/A GLY 184.A N ARG 198.A O no hydrogen 2.736 N/A ARG 185.A N TYR 168.A O no hydrogen 2.740 N/A ARG 185.A NE GLU 170.A OE1 no hydrogen 2.747 N/A ARG 185.A NH1 TYR 195.A O no hydrogen 2.804 N/A ARG 185.A NH2 GLU 170.A OE1 no hydrogen 3.472 N/A ARG 185.A NH2 GLU 170.A OE2 no hydrogen 2.873 N/A ARG 189.A N LYS 193.A O no hydrogen 3.049 N/A LYS 193.A N ARG 189.A O no hydrogen 2.729 N/A ALA 197.A N ASP 86.A OD2 no hydrogen 3.202 N/A ARG 198.A N GLY 184.A O no hydrogen 2.719 N/A ARG 198.A NE GLU 95.A OE1 no hydrogen 2.848 N/A ARG 198.A NH2 GLU 95.A OE2 no hydrogen 2.577 N/A ARG 199.A NH1 GLY 182.A O no hydrogen 3.042 N/A ARG 199.A NH1 VAL 200.A O no hydrogen 3.386 N/A ARG 199.A NH1 ASP 201.A OD1 no hydrogen 3.124 N/A ARG 199.A NH2 ASP 201.A OD1 no hydrogen 2.870 N/A VAL 200.A N GLY 182.A O no hydrogen 2.822 N/A ASP 201.A N VAL 133.A O no hydrogen 2.723 N/A ILE 202.A N TYR 180.A O no hydrogen 2.908 N/A ARG 203.A N ALA 135.A O no hydrogen 2.877 N/A ARG 203.A NH2 GLU 240.A OE2 no hydrogen 2.972 N/A LEU 204.A N LEU 178.A O no hydrogen 2.890 N/A ILE 205.A N LEU 137.A O no hydrogen 2.899 N/A THR 207.A OG1 ARG 139.A O no hydrogen 2.682 N/A LYS 208.A NZ GLU 278.A OE2 no hydrogen 3.526 N/A SER 209.A N GLU 206.A O no hydrogen 2.875 N/A SER 209.A OG TYR 241.A O no hydrogen 2.702 N/A VAL 210.A N THR 207.A O no hydrogen 3.180 N/A THR 212.A OG1 SER 209.A O no hydrogen 2.853 N/A THR 212.A OG1 GLU 240.A O no hydrogen 2.856 N/A ALA 213.A N SER 209.A O no hydrogen 2.912 N/A MET 214.A N VAL 210.A O no hydrogen 2.785 N/A LEU 215.A N PRO 211.A O no hydrogen 3.102 N/A THR 216.A N THR 212.A O no hydrogen 2.837 N/A THR 216.A OG1 THR 212.A O no hydrogen 3.139 N/A PHE 217.A N ALA 213.A O no hydrogen 2.731 N/A THR 218.A N MET 214.A O no hydrogen 2.978 N/A THR 218.A OG1 MET 214.A O no hydrogen 2.530 N/A GLY 219.A N LEU 215.A O no hydrogen 3.010 N/A SER 220.A N ARG 304.A O no hydrogen 3.002 N/A SER 220.A OG ARG 304.A O no hydrogen 3.168 N/A PHE 223.A N SER 220.A OG no hydrogen 3.360 N/A ASN 224.A N SER 220.A O no hydrogen 2.867 N/A ASN 224.A ND2 THR 216.A O no hydrogen 2.791 N/A VAL 225.A N LYS 221.A O no hydrogen 3.060 N/A ILE 226.A N ASN 222.A O no hydrogen 2.942 N/A MET 227.A N PHE 223.A O no hydrogen 2.956 N/A ARG 228.A N ASN 224.A O no hydrogen 2.915 N/A ARG 228.A NH2 THR 216.A OG1 no hydrogen 3.001 N/A GLN 229.A N VAL 225.A O no hydrogen 2.860 N/A ALA 230.A N ILE 226.A O no hydrogen 3.011 N/A ALA 231.A N MET 227.A O no hydrogen 2.967 N/A ILE 232.A N ARG 228.A O no hydrogen 2.962 N/A SER 233.A N GLN 229.A O no hydrogen 2.960 N/A SER 233.A OG GLN 229.A O no hydrogen 3.459 N/A SER 233.A OG ALA 230.A O no hydrogen 2.545 N/A LYS 234.A N ALA 230.A O no hydrogen 3.217 N/A LYS 234.A N ALA 231.A O no hydrogen 2.856 N/A GLY 235.A N ILE 232.A O no hydrogen 2.988 N/A TYR 236.A N ALA 231.A O no hydrogen 2.860 N/A LEU 237.A N PHE 244.A O no hydrogen 2.755 N/A ASN 239.A N GLY 242.A O no hydrogen 3.181 N/A GLU 240.A N GLU 240.A OE1 no hydrogen 2.605 N/A TYR 241.A N ASN 239.A OD1 no hydrogen 2.700 N/A GLY 242.A N ASN 239.A OD1 no hydrogen 3.128 N/A PHE 244.A N LEU 237.A O no hydrogen 2.891 N/A LYS 245.A N LYS 280.A O no hydrogen 2.788 N/A LEU 246.A N GLY 235.A O no hydrogen 2.761 N/A GLY 247.A N GLY 235.A O no hydrogen 2.943 N/A THR 248.A N GLU 251.A OE1 no hydrogen 2.878 N/A GLU 251.A N THR 248.A OG1 no hydrogen 3.280 N/A ALA 252.A N THR 248.A O no hydrogen 3.015 N/A ARG 253.A N PRO 249.A O no hydrogen 3.132 N/A ALA 254.A N GLU 250.A O no hydrogen 2.871 N/A LEU 255.A N GLU 251.A O no hydrogen 2.890 N/A TYR 256.A N ALA 252.A O no hydrogen 2.919 N/A GLU 257.A N ARG 253.A O no hydrogen 2.962 N/A GLU 257.A N ALA 254.A O no hydrogen 2.858 N/A ARG 258.A N LEU 255.A O no hydrogen 2.984 N/A ILE 259.A N LEU 255.A O no hydrogen 3.029 N/A GLY 260.A N TYR 256.A O no hydrogen 3.196 N/A ARG 262.A NE GLY 260.A O no hydrogen 2.726 N/A ARG 262.A NH2 ILE 259.A O no hydrogen 2.489 N/A LYS 264.A NZ GLU 269.A OE1 no hydrogen 3.094 N/A ASN 265.A ND2 GLU 268.A O no hydrogen 3.001 N/A GLY 267.A N ASN 265.A OD1 no hydrogen 2.597 N/A GLU 268.A N ASN 265.A OD1 no hydrogen 2.847 N/A GLU 269.A N VAL 272.A O no hydrogen 3.033 N/A VAL 272.A N GLU 269.A O no hydrogen 2.988 N/A LYS 274.A N GLY 267.A O no hydrogen 2.803 N/A GLU 278.A N LYS 274.A O no hydrogen 2.809 N/A ASP 279.A N ASP 275.A O no hydrogen 3.017 N/A LYS 280.A N LEU 277.A O no hydrogen 2.802 N/A ARG 281.A N GLU 278.A O no hydrogen 3.007 N/A ARG 281.A NE GLU 278.A OE1 no hydrogen 3.317 N/A ARG 281.A NE GLU 278.A OE2 no hydrogen 2.741 N/A ARG 281.A NH1 TYR 241.A O no hydrogen 2.899 N/A ARG 281.A NH2 TYR 241.A O no hydrogen 3.387 N/A ARG 281.A NH2 GLU 278.A OE1 no hydrogen 3.004 N/A VAL 282.A N LEU 243.A O no hydrogen 2.739 N/A ARG 285.A N ASP 289.A OD2 no hydrogen 2.658 N/A SER 286.A N ASP 289.A OD2 no hydrogen 3.215 N/A GLN 288.A NE2 ASP 292.A OD1 no hydrogen 2.800 N/A GLN 288.A NE2 ASP 292.A OD2 no hydrogen 3.540 N/A ASP 289.A N SER 286.A OG no hydrogen 3.147 N/A PHE 291.A N GLU 287.A O no hydrogen 3.246 N/A ASP 292.A N GLN 288.A O no hydrogen 2.850 N/A VAL 293.A N ASP 289.A O no hydrogen 2.965 N/A LEU 294.A N VAL 290.A O no hydrogen 3.067 N/A GLY 295.A N ASP 292.A O no hydrogen 3.077 N/A MET 296.A N PHE 291.A O no hydrogen 2.891 N/A GLU 302.A N GLU 302.A OE1 no hydrogen 2.855 N/A ASN 303.A N LYS 300.A O no hydrogen 2.740 N/A ARG 304.A N PRO 301.A O no hydrogen 3.141 N/A ARG 304.A NE ALA 299.A O no hydrogen 2.729 N/A ARG 304.A NH1 GLU 287.A OE1 no hydrogen 3.485 N/A ARG 304.A NH1 GLU 287.A OE2 no hydrogen 2.896 N/A ARG 304.A NH2 GLU 287.A OE1 no hydrogen 2.928 N/A ARG 304.A NH2 ALA 299.A O no hydrogen 2.861 N/A