Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4b4m_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A NZ ARG 6.A O no hydrogen 3.265 N/A ARG 6.A NH1 SER 107.A O no hydrogen 2.768 N/A ARG 6.A NH2 SER 129.A O no hydrogen 3.137 N/A ARG 6.A NH2 ARG 131.A O no hydrogen 3.261 N/A LYS 7.A N LEU 106.A O no hydrogen 2.996 N/A LYS 7.A NZ PHE 101.A O no hydrogen 3.124 N/A LYS 7.A NZ ILE 102.A O no hydrogen 3.212 N/A LYS 7.A NZ ASP 105.A OD2 no hydrogen 2.608 N/A GLY 8.A N GLU 53.A O no hydrogen 2.800 N/A ILE 9.A N ALA 108.A O no hydrogen 2.704 N/A ILE 10.A N LEU 55.A O no hydrogen 2.852 N/A LEU 11.A N VAL 110.A O no hydrogen 3.113 N/A ALA 12.A N ILE 57.A O no hydrogen 2.737 N/A HIS 20.A N THR 17.A O no hydrogen 2.955 N/A HIS 20.A ND1 THR 23.A OG1 no hydrogen 2.813 N/A THR 23.A N LEU 19.A O no hydrogen 3.350 N/A THR 23.A OG1 HIS 20.A ND1 no hydrogen 2.813 N/A LEU 24.A N PRO 21.A O no hydrogen 3.063 N/A SER 27.A OG GLN 29.A OE1 no hydrogen 3.502 N/A LYS 28.A NZ ASP 113.A OD2 no hydrogen 2.863 N/A LYS 28.A NZ THR 229.A O no hydrogen 2.667 N/A LYS 28.A NZ THR 229.A OG1 no hydrogen 3.328 N/A GLN 29.A N GLN 29.A OE1 no hydrogen 2.395 N/A GLN 29.A NE2 GLY 13.A O no hydrogen 3.289 N/A LEU 30.A N SER 27.A O no hydrogen 3.134 N/A LEU 31.A N LYS 28.A O no hydrogen 2.974 N/A VAL 33.A N LYS 36.A O no hydrogen 2.873 N/A LYS 36.A NZ ASP 35.A OD1 no hydrogen 2.859 N/A LYS 36.A NZ TYR 41.A OH no hydrogen 3.167 N/A LYS 36.A NZ GLU 246.A OE2 no hydrogen 2.804 N/A LYS 36.A NZ VAL 253.A O no hydrogen 2.807 N/A MET 38.A N LEU 31.A O no hydrogen 2.867 N/A ILE 39.A N GLN 29.A O no hydrogen 2.820 N/A TYR 40.A N PRO 37.A O no hydrogen 3.000 N/A TYR 41.A N MET 38.A O no hydrogen 3.015 N/A TYR 41.A OH VAL 33.A O no hydrogen 2.760 N/A LEU 43.A N ILE 39.A O no hydrogen 3.072 N/A SER 44.A N TYR 40.A O no hydrogen 2.735 N/A SER 44.A OG TYR 40.A O no hydrogen 2.725 N/A THR 45.A N TYR 41.A O no hydrogen 2.954 N/A THR 45.A OG1 TYR 41.A O no hydrogen 2.654 N/A LEU 46.A N PRO 42.A O no hydrogen 2.913 N/A MET 47.A N LEU 43.A O no hydrogen 3.024 N/A LEU 48.A N SER 44.A O no hydrogen 2.819 N/A ALA 49.A N THR 45.A O no hydrogen 3.079 N/A GLY 50.A N MET 47.A O no hydrogen 2.801 N/A ILE 51.A N LEU 46.A O no hydrogen 3.180 N/A ARG 52.A NE GLY 77.A O no hydrogen 2.908 N/A ARG 52.A NH2 GLY 77.A O no hydrogen 2.947 N/A ILE 54.A N ASP 79.A O no hydrogen 3.008 N/A LEU 55.A N GLY 8.A O no hydrogen 2.719 N/A ILE 56.A N GLN 81.A O no hydrogen 2.942 N/A ILE 57.A N ILE 10.A O no hydrogen 2.990 N/A SER 58.A N ALA 83.A O no hydrogen 3.197 N/A SER 58.A OG THR 59.A O no hydrogen 3.262 N/A GLN 61.A N GLN 61.A OE1 no hydrogen 2.739 N/A ASP 62.A N THR 59.A O no hydrogen 3.271 N/A ASP 62.A N THR 59.A OG1 no hydrogen 3.216 N/A THR 63.A N THR 59.A O no hydrogen 3.273 N/A THR 63.A OG1 SER 58.A OG no hydrogen 2.613 N/A THR 63.A OG1 THR 59.A O no hydrogen 3.005 N/A PHE 66.A N ASP 62.A O no hydrogen 3.092 N/A GLN 67.A N THR 63.A O no hydrogen 2.802 N/A GLN 68.A N PRO 64.A O no hydrogen 2.751 N/A LEU 69.A N ARG 65.A O no hydrogen 3.082 N/A LEU 70.A N PHE 66.A O no hydrogen 2.887 N/A GLY 71.A N GLN 67.A O no hydrogen 2.841 N/A SER 74.A N ASP 72.A OD1 no hydrogen 2.969 N/A SER 74.A OG ASP 72.A OD1 no hydrogen 2.595 N/A TRP 76.A N GLY 73.A O no hydrogen 2.797 N/A GLY 77.A N SER 74.A O no hydrogen 3.443 N/A LEU 78.A N GLY 73.A O no hydrogen 2.950 N/A ASP 79.A N ARG 52.A O no hydrogen 2.837 N/A LEU 80.A N ASP 72.A O no hydrogen 2.793 N/A GLN 81.A N ILE 54.A O no hydrogen 2.988 N/A GLN 81.A NE2 ASP 79.A OD2 no hydrogen 3.125 N/A TYR 82.A OH GLY 71.A O no hydrogen 2.637 N/A ALA 83.A N ILE 56.A O no hydrogen 3.061 N/A GLN 85.A N SER 58.A O no hydrogen 2.823 N/A GLN 85.A NE2 GLY 90.A O no hydrogen 3.647 N/A GLN 85.A NE2 GLN 93.A OE1 no hydrogen 2.666 N/A SER 87.A OG ASP 89.A OD1 no hydrogen 2.856 N/A ALA 92.A N LEU 200.A O no hydrogen 3.197 N/A GLN 93.A N GLY 90.A O no hydrogen 3.293 N/A GLN 93.A NE2 ASP 89.A OD2 no hydrogen 3.047 N/A ALA 94.A N LEU 91.A O no hydrogen 2.943 N/A PHE 95.A N ALA 92.A O no hydrogen 3.006 N/A ILE 97.A N GLN 93.A O no hydrogen 2.889 N/A GLY 98.A N ALA 94.A O no hydrogen 2.698 N/A GLU 99.A N LEU 96.A O no hydrogen 3.304 N/A ILE 102.A N GLY 98.A O no hydrogen 2.843 N/A GLY 103.A N GLU 99.A O no hydrogen 3.050 N/A ASP 105.A N ILE 102.A O no hydrogen 3.232 N/A SER 107.A N TYR 181.A O no hydrogen 3.017 N/A LEU 109.A N TYR 179.A O no hydrogen 2.659 N/A VAL 110.A N ILE 9.A O no hydrogen 2.994 N/A LEU 111.A N GLY 177.A O no hydrogen 2.942 N/A GLY 112.A N LEU 11.A O no hydrogen 2.794 N/A ASN 114.A N LEU 111.A O no hydrogen 3.392 N/A ASN 114.A ND2 ASP 113.A OD1 no hydrogen 3.096 N/A TYR 116.A OH THR 176.A OG1 no hydrogen 3.162 N/A TYR 117.A N ALA 225.A O no hydrogen 2.886 N/A HIS 122.A ND1 GLU 123.A OE2 no hydrogen 3.051 N/A LEU 124.A N ASP 120.A O no hydrogen 3.053 N/A LEU 125.A N PHE 121.A O no hydrogen 2.881 N/A GLY 126.A N HIS 122.A O no hydrogen 2.867 N/A SER 127.A N GLU 123.A O no hydrogen 3.079 N/A SER 127.A OG LEU 124.A O no hydrogen 3.199 N/A SER 129.A N LEU 125.A O no hydrogen 2.972 N/A GLN 130.A N GLY 126.A O no hydrogen 3.006 N/A GLY 134.A N ASP 182.A OD2 no hydrogen 2.808 N/A ALA 135.A N GLN 214.A O no hydrogen 2.864 N/A SER 136.A N PHE 180.A O no hydrogen 2.860 N/A VAL 137.A N SER 216.A O no hydrogen 2.997 N/A ALA 139.A N GLU 218.A O no hydrogen 3.044 N/A TYR 140.A N ALA 174.A O no hydrogen 2.784 N/A TYR 140.A OH TYR 224.A O no hydrogen 2.663 N/A VAL 142.A N ASN 172.A O no hydrogen 2.879 N/A ARG 147.A N ASP 144.A O no hydrogen 3.093 N/A ARG 147.A NH1 ASP 144.A OD2 no hydrogen 2.782 N/A ARG 147.A NH1 ASP 228.A OD2 no hydrogen 3.167 N/A ARG 147.A NH2 ASP 228.A OD1 no hydrogen 3.073 N/A TYR 148.A N PRO 145.A O no hydrogen 2.811 N/A VAL 150.A N GLU 163.A O no hydrogen 2.779 N/A VAL 151.A N TYR 173.A O no hydrogen 3.009 N/A GLU 152.A N SER 161.A O no hydrogen 3.089 N/A ASP 154.A N LYS 158.A O no hydrogen 2.907 N/A GLY 157.A N ASP 154.A O no hydrogen 2.899 N/A LYS 158.A N ASP 154.A OD1 no hydrogen 3.072 N/A LYS 158.A NZ ASP 154.A OD1 no hydrogen 3.553 N/A LYS 158.A NZ ASP 154.A OD2 no hydrogen 3.153 N/A ILE 160.A N GLU 152.A O no hydrogen 2.898 N/A SER 161.A OG GLU 152.A OE1 no hydrogen 2.893 N/A GLU 163.A N VAL 150.A O no hydrogen 2.993 N/A LYS 165.A N TYR 148.A O no hydrogen 2.815 N/A LYS 165.A NZ GLU 164.A OE2 no hydrogen 2.823 N/A SER 171.A OG VAL 151.A O no hydrogen 2.648 N/A TYR 173.A N SER 171.A OG no hydrogen 3.080 N/A ALA 174.A N TYR 140.A O no hydrogen 2.889 N/A VAL 175.A N GLY 149.A O no hydrogen 2.757 N/A THR 176.A N PHE 138.A O no hydrogen 2.823 N/A THR 176.A OG1 TYR 116.A OH no hydrogen 3.162 N/A GLY 177.A N ASN 114.A OD1 no hydrogen 3.272 N/A TYR 179.A N LEU 109.A O no hydrogen 2.648 N/A PHE 180.A N SER 136.A O no hydrogen 3.005 N/A TYR 181.A N SER 107.A O no hydrogen 2.983 N/A TYR 181.A OH ASN 206.A OD1 no hydrogen 2.517 N/A GLN 184.A N ASP 182.A OD1 no hydrogen 2.919 N/A GLN 184.A NE2 ASP 182.A OD2 no hydrogen 2.836 N/A GLN 184.A NE2 GLN 214.A OE1 no hydrogen 3.047 N/A ILE 188.A N GLN 184.A O no hydrogen 3.129 N/A ALA 189.A N VAL 185.A O no hydrogen 2.861 N/A ARG 190.A N VAL 186.A O no hydrogen 2.911 N/A ARG 190.A NH1 GLU 99.A OE1 no hydrogen 2.733 N/A ARG 190.A NH1 GLU 99.A OE2 no hydrogen 3.233 N/A ARG 190.A NH2 ASP 187.A OD1 no hydrogen 2.446 N/A ASP 191.A N ASP 187.A O no hydrogen 3.256 N/A ASP 191.A N ILE 188.A O no hydrogen 3.237 N/A LEU 192.A N ALA 189.A O no hydrogen 3.288 N/A SER 195.A N GLU 199.A O no hydrogen 2.869 N/A SER 195.A OG GLU 199.A O no hydrogen 3.013 N/A SER 195.A OG GLU 201.A OE2 no hydrogen 3.088 N/A GLY 198.A N SER 195.A O no hydrogen 3.044 N/A LEU 200.A N ASP 89.A O no hydrogen 2.883 N/A THR 203.A OG1 GLU 164.A OE1 no hydrogen 2.452 N/A VAL 205.A N GLU 201.A O no hydrogen 3.381 N/A ASN 206.A N ILE 202.A O no hydrogen 2.874 N/A ARG 207.A N THR 203.A O no hydrogen 2.854 N/A ARG 207.A NE LEU 162.A O no hydrogen 3.450 N/A ARG 207.A NH1 ASP 204.A OD1 no hydrogen 2.918 N/A ARG 207.A NH2 LEU 162.A O no hydrogen 2.917 N/A ALA 208.A N ASP 204.A O no hydrogen 3.117 N/A TYR 209.A N VAL 205.A O no hydrogen 3.314 N/A TYR 209.A OH ASP 182.A OD1 no hydrogen 2.609 N/A LEU 210.A N ASN 206.A O no hydrogen 2.965 N/A GLU 211.A N ARG 207.A O no hydrogen 2.678 N/A ARG 212.A N ALA 208.A O no hydrogen 3.274 N/A ARG 212.A NE GLN 184.A OE1 no hydrogen 3.277 N/A ARG 212.A NH2 GLN 184.A OE1 no hydrogen 2.712 N/A GLY 213.A N LEU 210.A O no hydrogen 2.885 N/A GLN 214.A N TYR 209.A O no hydrogen 2.784 N/A SER 216.A N ALA 135.A O no hydrogen 2.976 N/A GLU 218.A N VAL 137.A O no hydrogen 3.082 N/A MET 220.A N ALA 139.A O no hydrogen 2.862 N/A TYR 224.A N GLY 221.A O no hydrogen 3.104 N/A TYR 224.A OH HIS 119.A O no hydrogen 2.885 N/A TYR 224.A OH ASP 120.A O no hydrogen 3.306 N/A ALA 225.A N TYR 117.A O no hydrogen 2.794 N/A TRP 226.A N TYR 140.A OH no hydrogen 3.181 N/A TRP 226.A NE1 ASN 114.A OD1 no hydrogen 2.734 N/A LEU 227.A N LEU 115.A O no hydrogen 2.933 N/A THR 229.A OG1 ASP 113.A O no hydrogen 2.461 N/A GLY 230.A N ASP 228.A OD1 no hydrogen 2.918 N/A THR 231.A N SER 234.A OG no hydrogen 2.944 N/A THR 231.A OG1 SER 234.A OG no hydrogen 3.153 N/A SER 234.A N THR 231.A OG1 no hydrogen 2.963 N/A SER 234.A OG ASP 228.A O no hydrogen 3.352 N/A SER 234.A OG THR 231.A O no hydrogen 3.174 N/A SER 234.A OG THR 231.A OG1 no hydrogen 3.153 N/A LEU 235.A N THR 231.A O no hydrogen 2.971 N/A LEU 236.A N HIS 232.A O no hydrogen 3.143 N/A GLU 237.A N ASP 233.A O no hydrogen 3.010 N/A ALA 238.A N SER 234.A O no hydrogen 2.852 N/A GLY 239.A N LEU 235.A O no hydrogen 3.119 N/A GLN 240.A N LEU 236.A O no hydrogen 3.062 N/A GLN 240.A NE2.B GLN 240.A O no hydrogen 2.826 N/A GLN 240.A NE2.B THR 244.A OG1 no hydrogen 2.943 N/A PHE 241.A N GLU 237.A O no hydrogen 2.983 N/A ILE 242.A N ALA 238.A O no hydrogen 3.116 N/A ALA 243.A N GLY 239.A O no hydrogen 2.987 N/A THR 244.A N GLN 240.A O no hydrogen 3.065 N/A THR 244.A OG1 GLN 240.A O no hydrogen 2.909 N/A LEU 245.A N PHE 241.A O no hydrogen 3.218 N/A GLU 246.A N ILE 242.A O no hydrogen 2.908 N/A ASN 247.A N ALA 243.A O no hydrogen 2.808 N/A ASN 247.A ND2 TYR 34.A OH no hydrogen 3.101 N/A ASN 247.A ND2 ALA 243.A O no hydrogen 2.856 N/A ARG 248.A N THR 244.A O no hydrogen 3.044 N/A GLN 249.A N LEU 245.A O no hydrogen 2.999 N/A GLY 250.A N GLU 246.A O no hydrogen 3.118 N/A LYS 252.A N TYR 286.A OH no hydrogen 3.176 N/A LYS 252.A NZ ASP 35.A OD2 no hydrogen 2.734 N/A VAL 253.A N GLU 246.A OE2 no hydrogen 2.739 N/A CYS 255.A SG GLU 257.A OE1 no hydrogen 3.616 N/A CYS 255.A SG TYR 283.A OH no hydrogen 3.569 N/A GLU 257.A N GLU 257.A OE1 no hydrogen 2.782 N/A ILE 259.A N CYS 255.A O no hydrogen 3.043 N/A ALA 260.A N PRO 256.A O no hydrogen 2.931 N/A TYR 261.A N GLU 257.A O no hydrogen 2.951 N/A ARG 262.A N GLU 258.A O no hydrogen 2.907 N/A ARG 262.A NE GLU 258.A OE2 no hydrogen 2.915 N/A ARG 262.A NH2 GLU 258.A OE2 no hydrogen 2.874 N/A GLN 263.A N ILE 259.A O no hydrogen 2.868 N/A GLN 263.A NE2 MET 47.A O no hydrogen 2.909 N/A LYS 264.A N TYR 261.A O no hydrogen 3.356 N/A TRP 265.A N ALA 260.A O no hydrogen 2.897 N/A GLN 270.A N ASP 267.A OD1 no hydrogen 2.947 N/A GLN 270.A NE2 ASN 75.A O no hydrogen 2.970 N/A LEU 271.A N ASP 267.A O no hydrogen 3.032 N/A GLU 272.A N ALA 268.A O no hydrogen 2.997 N/A LYS 273.A N ALA 269.A O no hydrogen 3.249 N/A LEU 274.A N GLN 270.A O no hydrogen 3.041 N/A ALA 275.A N LEU 271.A O no hydrogen 2.878 N/A ALA 276.A N GLU 272.A O no hydrogen 3.164 N/A LEU 278.A N ALA 275.A O no hydrogen 3.270 N/A ALA 279.A N ALA 276.A O no hydrogen 2.958 N/A ASN 281.A N LEU 278.A O no hydrogen 3.049 N/A TYR 283.A N ASN 281.A OD1 no hydrogen 2.599 N/A TYR 283.A OH GLU 257.A OE1 no hydrogen 2.617 N/A GLY 284.A N ASN 281.A OD1 no hydrogen 3.198 N/A GLN 285.A N ASN 281.A O no hydrogen 3.181 N/A GLN 285.A NE2 ALA 279.A O no hydrogen 3.578 N/A TYR 286.A N GLY 282.A O no hydrogen 2.963 N/A TYR 286.A OH GLU 258.A OE1 no hydrogen 2.558 N/A LEU 287.A N TYR 283.A O no hydrogen 2.987 N/A LYS 288.A N GLY 284.A O no hydrogen 3.082 N/A ARG 289.A N GLN 285.A O no hydrogen 3.035 N/A ARG 289.A NH1 GLY 250.A O no hydrogen 3.492 N/A ARG 289.A NH1 GLU 293.A OE1 no hydrogen 2.755 N/A ARG 289.A NH2 GLY 250.A O no hydrogen 2.707 N/A LEU 290.A N TYR 286.A O no hydrogen 3.196 N/A LEU 291.A N LYS 288.A O no hydrogen 3.070 N/A THR 292.A N ARG 289.A O no hydrogen 3.156 N/A THR 292.A OG1 ARG 289.A O no hydrogen 3.414 N/A GLU 293.A N ARG 289.A O no hydrogen 3.228 N/A