Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cml_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N VAL 305.A O no hydrogen 2.970 N/A TYR 4.A OH GLN 6.A OE1 no hydrogen 2.773 N/A GLN 6.A N VAL 303.A O no hydrogen 2.947 N/A PHE 8.A N ILE 301.A O no hydrogen 2.927 N/A ARG 9.A N ASP 38.A OD2 no hydrogen 2.760 N/A PHE 10.A N PHE 299.A O no hydrogen 2.899 N/A PHE 11.A N VAL 39.A O no hydrogen 2.826 N/A ALA 12.A N SER 297.A O no hydrogen 2.853 N/A GLY 13.A N CYS 41.A O no hydrogen 2.891 N/A THR 14.A N VAL 295.A O no hydrogen 2.942 N/A TYR 15.A N GLY 43.A O no hydrogen 2.937 N/A ASN 16.A ND2 GLU 46.A OE2 no hydrogen 3.307 N/A ASN 16.A ND2 ASP 190.A OD2 no hydrogen 2.842 N/A VAL 17.A N GLN 45.A O no hydrogen 3.034 N/A ASN 18.A N ASN 16.A OD1 no hydrogen 3.091 N/A GLY 19.A N GLU 46.A O no hydrogen 2.705 N/A GLN 20.A N VAL 17.A O no hydrogen 2.904 N/A GLN 20.A NE2 ASN 18.A O no hydrogen 2.873 N/A SER 21.A OG GLU 64.A OE1 no hydrogen 2.703 N/A LYS 23.A NZ GLN 20.A OE1 no hydrogen 3.537 N/A LYS 23.A NZ SER 21.A O no hydrogen 2.985 N/A ARG 27.A NE SER 31.A OG no hydrogen 2.829 N/A ARG 27.A NH2 SER 31.A O no hydrogen 3.087 N/A TRP 29.A N LEU 26.A O no hydrogen 2.938 N/A TRP 29.A NE1 VAL 295.A O no hydrogen 3.231 N/A LEU 30.A N LEU 26.A O no hydrogen 2.827 N/A SER 31.A N ARG 27.A O no hydrogen 2.888 N/A SER 31.A OG GLY 72.A O no hydrogen 2.769 N/A ASN 32.A ND2 LEU 28.A O no hydrogen 3.256 N/A ASP 38.A N ARG 9.A O no hydrogen 2.843 N/A VAL 39.A N ARG 9.A O no hydrogen 3.095 N/A TYR 40.A N TYR 95.A O no hydrogen 2.950 N/A TYR 40.A OH LEU 30.A O no hydrogen 2.672 N/A CYS 41.A N PHE 11.A O no hydrogen 2.805 N/A VAL 42.A N LEU 93.A O no hydrogen 2.899 N/A GLY 43.A N GLY 13.A O no hydrogen 2.804 N/A PHE 44.A N MET 91.A O no hydrogen 2.787 N/A GLN 45.A N TYR 15.A O no hydrogen 2.967 N/A GLN 45.A NE2 THR 14.A OG1 no hydrogen 2.918 N/A GLN 45.A NE2 ASN 141.A OD1 no hydrogen 2.887 N/A LEU 47.A N GLY 89.A O no hydrogen 3.071 N/A SER 50.A N ASP 48.A OD1 no hydrogen 2.820 N/A SER 50.A OG ASP 48.A OD1 no hydrogen 2.572 N/A LYS 51.A NZ GLU 52.A OE1 no hydrogen 3.472 N/A LYS 51.A NZ GLU 52.A OE2 no hydrogen 2.823 N/A GLU 52.A N GLU 52.A OE1 no hydrogen 2.959 N/A ALA 53.A N SER 50.A OG no hydrogen 3.111 N/A PHE 54.A N SER 50.A O no hydrogen 3.043 N/A PHE 55.A N LYS 51.A O no hydrogen 3.016 N/A PHE 56.A N ALA 53.A O no hydrogen 2.799 N/A HIS 57.A N GLU 52.A O no hydrogen 3.213 N/A THR 59.A OG1 ASP 48.A OD2 no hydrogen 2.572 N/A LYS 61.A N THR 59.A OG1 no hydrogen 3.030 N/A GLU 62.A N THR 59.A O no hydrogen 3.245 N/A GLU 64.A N PRO 60.A O no hydrogen 3.035 N/A TRP 65.A N LYS 61.A O no hydrogen 3.029 N/A TRP 65.A NE1 GLN 20.A O no hydrogen 2.816 N/A PHE 66.A N GLU 62.A O no hydrogen 2.993 N/A LYS 67.A N GLU 63.A O no hydrogen 2.950 N/A ALA 68.A N GLU 64.A O no hydrogen 3.094 N/A VAL 69.A N TRP 65.A O no hydrogen 2.976 N/A SER 70.A N PHE 66.A O no hydrogen 2.926 N/A SER 70.A OG PHE 66.A O no hydrogen 3.050 N/A SER 70.A OG TYR 95.A OH no hydrogen 2.836 N/A GLU 71.A N LYS 67.A O no hydrogen 2.909 N/A GLY 72.A N ALA 68.A O no hydrogen 3.063 N/A GLY 72.A N VAL 69.A O no hydrogen 2.911 N/A HIS 74.A N TYR 40.A OH no hydrogen 3.217 N/A ASP 76.A N HIS 74.A ND1 no hydrogen 3.151 N/A TYR 79.A OH PRO 37.A O no hydrogen 2.578 N/A ALA 80.A N VAL 96.A O no hydrogen 2.723 N/A VAL 82.A N LEU 94.A O no hydrogen 2.812 N/A LYS 83.A N LEU 94.A O no hydrogen 3.322 N/A ILE 85.A N LEU 92.A O no hydrogen 3.069 N/A ARG 86.A NE GLU 62.A OE1 no hydrogen 2.800 N/A ARG 86.A NH1 VAL 88.A O no hydrogen 2.810 N/A LEU 87.A N ILE 90.A O no hydrogen 2.831 N/A ILE 90.A N LEU 87.A O no hydrogen 2.893 N/A MET 91.A N PHE 44.A O no hydrogen 3.121 N/A LEU 92.A N ILE 85.A O no hydrogen 2.893 N/A LEU 93.A N VAL 42.A O no hydrogen 2.773 N/A LEU 94.A N LYS 83.A O no hydrogen 2.949 N/A TYR 95.A N TYR 40.A O no hydrogen 2.943 N/A TYR 95.A OH SER 70.A OG no hydrogen 2.836 N/A VAL 96.A N ALA 80.A O no hydrogen 2.960 N/A LYS 97.A N ASP 38.A O no hydrogen 2.990 N/A LYS 97.A NZ ASP 38.A OD1 no hydrogen 3.142 N/A GLN 98.A N LYS 78.A O no hydrogen 2.831 N/A GLN 98.A NE2 GLN 98.A O no hydrogen 3.563 N/A HIS 100.A N LYS 97.A O no hydrogen 2.831 N/A HIS 100.A NE2 ASP 38.A OD1 no hydrogen 2.906 N/A ALA 101.A N GLN 98.A O no hydrogen 2.981 N/A TYR 103.A N HIS 100.A O no hydrogen 3.052 N/A ILE 104.A N ALA 101.A O no hydrogen 3.135 N/A SER 105.A N GLN 131.A O no hydrogen 2.895 N/A GLU 108.A N ARG 129.A O no hydrogen 2.876 N/A GLU 110.A N ALA 127.A O no hydrogen 3.055 N/A VAL 112.A N GLY 125.A O no hydrogen 2.793 N/A THR 114.A N LYS 123.A O no hydrogen 2.933 N/A GLY 115.A N MET 120.A O no hydrogen 2.970 N/A ILE 116.A N ASN 122.A OD1 no hydrogen 2.853 N/A GLY 118.A N GLY 115.A O no hydrogen 2.777 N/A ARG 119.A N ILE 116.A O no hydrogen 3.107 N/A MET 120.A N ILE 116.A O no hydrogen 3.051 N/A LYS 123.A NZ ASN 122.A O no hydrogen 3.035 N/A GLY 124.A N HIS 143.A O no hydrogen 2.926 N/A GLY 125.A N VAL 112.A O no hydrogen 2.835 N/A VAL 126.A N ASN 141.A O no hydrogen 2.872 N/A ALA 127.A N GLU 110.A O no hydrogen 2.927 N/A ILE 128.A N VAL 139.A O no hydrogen 2.975 N/A ARG 129.A N GLU 108.A O no hydrogen 2.823 N/A ARG 129.A NE HIS 182.A NE2 no hydrogen 3.016 N/A ARG 129.A NH1 GLU 106.A O no hydrogen 2.886 N/A ARG 129.A NH1 GLU 106.A OE1 no hydrogen 3.239 N/A ARG 129.A NH2 HIS 182.A NE2 no hydrogen 3.552 N/A PHE 130.A N ILE 137.A O no hydrogen 2.881 N/A GLN 131.A N SER 105.A O no hydrogen 2.858 N/A GLN 131.A NE2 HIS 133.A O no hydrogen 2.887 N/A PHE 132.A N THR 135.A O no hydrogen 2.876 N/A HIS 133.A N TYR 103.A O no hydrogen 2.890 N/A ASN 134.A N ARG 304.A O no hydrogen 2.901 N/A THR 135.A N PHE 132.A O no hydrogen 2.926 N/A SER 136.A N ASP 183.A OD2 no hydrogen 2.999 N/A ILE 137.A N PHE 130.A O no hydrogen 2.847 N/A CYS 138.A N VAL 184.A O no hydrogen 2.929 N/A VAL 139.A N ILE 128.A O no hydrogen 2.879 N/A VAL 140.A N LEU 186.A O no hydrogen 2.870 N/A ASN 141.A N VAL 126.A O no hydrogen 2.865 N/A ASN 141.A ND2 PHE 44.A O no hydrogen 2.954 N/A ASN 141.A ND2 MET 91.A O no hydrogen 2.898 N/A SER 142.A N LEU 188.A O no hydrogen 2.999 N/A HIS 143.A N GLY 124.A O no hydrogen 2.791 N/A LEU 144.A N ASP 190.A O no hydrogen 3.155 N/A ALA 145.A N ASP 157.A OD2 no hydrogen 3.044 N/A GLU 150.A N HIS 147.A O no hydrogen 3.085 N/A ARG 153.A NE ASP 157.A OD1 no hydrogen 2.898 N/A ARG 153.A NH2 THR 114.A O no hydrogen 2.796 N/A ARG 153.A NH2 GLY 115.A O no hydrogen 3.096 N/A ARG 154.A N GLU 150.A O no hydrogen 3.105 N/A ARG 154.A NH1 ALA 145.A O no hydrogen 2.806 N/A ARG 154.A NH1 HIS 147.A O no hydrogen 2.690 N/A ARG 154.A NH2 HIS 147.A O no hydrogen 2.958 N/A ARG 154.A NH2 ILE 148.A O no hydrogen 3.158 N/A ARG 154.A NH2 GLN 220.A OE1 no hydrogen 2.838 N/A ASN 155.A N TYR 151.A O no hydrogen 2.938 N/A ASN 155.A ND2 GLN 224.A OE1 no hydrogen 2.818 N/A GLN 156.A N GLU 152.A O no hydrogen 2.984 N/A GLN 156.A NE2 GLN 156.A O no hydrogen 3.463 N/A GLN 156.A NE2 ASP 160.A OD1 no hydrogen 2.762 N/A ASP 157.A N ARG 153.A O no hydrogen 2.770 N/A TYR 158.A N ARG 154.A O no hydrogen 3.041 N/A LYS 159.A N ASN 155.A O no hydrogen 3.009 N/A ASP 160.A N GLN 156.A O no hydrogen 2.829 N/A ILE 161.A N ASP 157.A O no hydrogen 2.994 N/A CYS 162.A N TYR 158.A O no hydrogen 3.032 N/A CYS 162.A SG TYR 158.A O no hydrogen 3.373 N/A SER 163.A N LYS 159.A O no hydrogen 2.977 N/A SER 163.A OG LYS 159.A O no hydrogen 3.260 N/A SER 163.A OG ASP 160.A O no hydrogen 3.413 N/A ARG 164.A N ASP 160.A O no hydrogen 2.924 N/A ARG 164.A NH1 GLY 113.A O no hydrogen 2.812 N/A ARG 164.A NH1 GLY 118.A O no hydrogen 3.363 N/A ARG 164.A NH2 GLY 113.A O no hydrogen 3.360 N/A MET 165.A N ILE 161.A O no hydrogen 3.042 N/A PHE 167.A N LEU 177.A O no hydrogen 2.758 N/A THR 178.A N ASN 181.A OD1.B no hydrogen 3.423 N/A THR 178.A OG1 SER 180.A OG no hydrogen 3.212 N/A THR 178.A OG1 ASN 181.A OD1.B no hydrogen 3.109 N/A SER 180.A OG THR 178.A OG1 no hydrogen 3.212 N/A ASN 181.A N.A THR 178.A O no hydrogen 3.247 N/A ASN 181.A N.B THR 178.A O no hydrogen 3.234 N/A HIS 182.A ND1 ILE 179.A O no hydrogen 2.868 N/A ASP 183.A N SER 136.A OG no hydrogen 2.937 N/A VAL 184.A N SER 136.A O no hydrogen 3.055 N/A ILE 185.A N LYS 272.A O no hydrogen 2.858 N/A LEU 186.A N CYS 138.A O no hydrogen 2.959 N/A TRP 187.A N LEU 270.A O no hydrogen 2.883 N/A TRP 187.A NE1 SER 142.A OG no hydrogen 2.903 N/A LEU 188.A N VAL 140.A O no hydrogen 2.832 N/A GLY 189.A N ARG 268.A O no hydrogen 3.147 N/A ASN 192.A N CYS 266.A O no hydrogen 3.171 N/A ASN 192.A ND2 LEU 144.A O no hydrogen 3.003 N/A TYR 193.A OH ASN 155.A OD1 no hydrogen 2.705 N/A ARG 194.A N GLN 220.A OE1 no hydrogen 2.901 N/A ARG 194.A NE ASN 192.A O no hydrogen 2.997 N/A ARG 194.A NE ASN 192.A OD1 no hydrogen 3.298 N/A ARG 194.A NH2 ASN 192.A OD1 no hydrogen 2.864 N/A GLU 196.A N TYR 218.A O no hydrogen 2.708 N/A LEU 198.A N GLU 196.A O no hydrogen 2.658 N/A GLU 201.A N GLU 201.A OE1 no hydrogen 2.837 N/A LYS 202.A N ASP 199.A OD1 no hydrogen 2.908 N/A VAL 203.A N ASP 199.A O no hydrogen 3.030 N/A LYS 204.A N VAL 200.A O no hydrogen 2.995 N/A LYS 205.A N GLU 201.A O no hydrogen 2.944 N/A LEU 206.A N LYS 202.A O no hydrogen 2.942 N/A ILE 207.A N VAL 203.A O no hydrogen 3.113 N/A GLU 208.A N LYS 204.A O no hydrogen 2.979 N/A GLU 209.A N LYS 205.A O no hydrogen 2.834 N/A LYS 210.A N ILE 207.A O no hydrogen 2.958 N/A ASP 211.A N LEU 206.A O no hydrogen 2.962 N/A MET 214.A N ASP 211.A OD1 no hydrogen 3.173 N/A LEU 215.A N ASP 211.A O no hydrogen 3.294 N/A TYR 216.A N PHE 212.A O no hydrogen 2.911 N/A ALA 217.A N MET 214.A O no hydrogen 3.137 N/A TYR 218.A N LEU 215.A O no hydrogen 3.019 N/A ASP 219.A N TYR 216.A O no hydrogen 3.063 N/A GLN 220.A N ARG 194.A O no hydrogen 2.922 N/A GLN 220.A NE2 ILE 148.A O no hydrogen 2.769 N/A GLN 220.A NE2 GLU 196.A OE2.A no hydrogen 2.916 N/A LYS 222.A N ASP 219.A OD2 no hydrogen 2.904 N/A ILE 223.A N ASP 219.A O no hydrogen 3.126 N/A GLN 224.A N GLN 220.A O no hydrogen 2.874 N/A VAL 225.A N LEU 221.A O no hydrogen 2.852 N/A ALA 226.A N LYS 222.A O no hydrogen 2.985 N/A ALA 227.A N ILE 223.A O no hydrogen 2.926 N/A LYS 228.A N VAL 225.A O no hydrogen 2.891 N/A THR 229.A N GLN 224.A O no hydrogen 3.179 N/A THR 229.A OG1 GLN 224.A O no hydrogen 3.158 N/A THR 229.A OG1 GLN 224.A OE1 no hydrogen 2.668 N/A PHE 234.A N PHE 231.A O no hydrogen 3.119 N/A THR 235.A N TRP 271.A O no hydrogen 2.876 N/A GLN 242.A NE2 TYR 247.A OH no hydrogen 2.863 N/A THR 244.A N ALA 264.A O no hydrogen 3.280 N/A THR 244.A OG1 ASP 267.A OD2 no hydrogen 2.594 N/A LYS 246.A NZ ASP 291.A OD2 no hydrogen 2.887 N/A TYR 247.A N ASP 291.A O no hydrogen 2.904 N/A TYR 247.A OH PRO 243.A O no hydrogen 2.726 N/A ASP 248.A N ASP 253.A O no hydrogen 2.917 N/A GLY 250.A N LYS 288.A O no hydrogen 2.799 N/A SER 251.A N ASP 248.A O no hydrogen 3.166 N/A SER 251.A OG ASP 248.A O no hydrogen 2.821 N/A ASP 253.A N SER 251.A OG no hydrogen 3.012 N/A ASP 255.A N LYS 246.A O no hydrogen 2.872 N/A THR 256.A N ASP 248.A OD1 no hydrogen 2.986 N/A THR 256.A OG1 ASP 248.A OD1 no hydrogen 3.313 N/A THR 256.A OG1 ASP 248.A OD2 no hydrogen 2.557 N/A SER 257.A N ASP 255.A OD1 no hydrogen 3.046 N/A SER 257.A OG ASP 255.A OD1 no hydrogen 2.681 N/A SER 257.A OG ASP 255.A OD2 no hydrogen 3.108 N/A CYS 260.A N SER 257.A O no hydrogen 3.114 N/A ARG 261.A N ASP 255.A OD2 no hydrogen 2.946 N/A ALA 264.A N TYR 245.A O no hydrogen 2.829 N/A TRP 265.A NE1 PHE 241.A O no hydrogen 2.796 N/A CYS 266.A SG ASN 192.A OD1 no hydrogen 3.616 N/A ARG 268.A N GLY 189.A O no hydrogen 3.019 N/A ARG 268.A NE GLU 236.A OE2 no hydrogen 2.697 N/A ARG 268.A NH1 ASP 219.A OD1 no hydrogen 2.883 N/A ARG 268.A NH1 ASP 219.A OD2 no hydrogen 3.454 N/A ARG 268.A NH1 TRP 265.A O no hydrogen 2.784 N/A ARG 268.A NH2 ASP 219.A OD2 no hydrogen 2.999 N/A ARG 268.A NH2 GLU 236.A OE1 no hydrogen 3.112 N/A ILE 269.A N TYR 281.A OH no hydrogen 3.090 N/A LEU 270.A N TRP 187.A O no hydrogen 2.734 N/A TRP 271.A N THR 235.A O no hydrogen 2.996 N/A LYS 272.A N ILE 185.A O no hydrogen 2.955 N/A THR 277.A N ASP 300.A O no hydrogen 2.949 N/A GLN 278.A NE2 SER 297.A OG no hydrogen 2.775 N/A LEU 279.A N VAL 298.A O no hydrogen 2.787 N/A SER 280.A N VAL 298.A O no hydrogen 3.401 N/A TYR 281.A OH GLU 236.A OE2 no hydrogen 2.562 N/A GLN 282.A N SER 296.A O no hydrogen 2.948 N/A HIS 284.A N PRO 294.A O no hydrogen 2.950 N/A HIS 284.A NE2 SER 296.A OG no hydrogen 2.763 N/A LEU 287.A N HIS 284.A O no hydrogen 3.498 N/A LYS 288.A N GLU 24.A OE1 no hydrogen 3.233 N/A LYS 288.A N GLU 24.A OE2 no hydrogen 2.923 N/A THR 289.A N GLU 24.A OE1 no hydrogen 3.075 N/A THR 289.A OG1 GLU 24.A OE1 no hydrogen 2.707 N/A SER 290.A OG ASN 16.A O no hydrogen 2.628 N/A SER 290.A OG ASP 291.A OD1 no hydrogen 3.336 N/A HIS 292.A N SER 290.A OG no hydrogen 3.104 N/A HIS 292.A ND1 ASP 267.A OD2 no hydrogen 2.740 N/A LYS 293.A N THR 244.A O no hydrogen 2.968 N/A LYS 293.A NZ SER 251.A O no hydrogen 3.251 N/A LYS 293.A NZ ASP 252.A OD1 no hydrogen 2.735 N/A LYS 293.A NZ MET 285.A O no hydrogen 2.786 N/A LYS 293.A NZ LEU 287.A O no hydrogen 3.131 N/A VAL 295.A N THR 14.A O no hydrogen 2.938 N/A SER 296.A N GLN 282.A O no hydrogen 2.832 N/A SER 296.A OG HIS 284.A NE2 no hydrogen 2.763 N/A SER 297.A N ALA 12.A O no hydrogen 2.844 N/A SER 297.A OG SER 280.A O no hydrogen 2.697 N/A VAL 298.A N SER 280.A O no hydrogen 3.334 N/A PHE 299.A N PHE 10.A O no hydrogen 2.810 N/A ASP 300.A N THR 277.A O no hydrogen 2.851 N/A ILE 301.A N PHE 8.A O no hydrogen 2.883 N/A GLY 302.A N ASN 275.A O no hydrogen 2.782 N/A VAL 303.A N GLN 6.A O no hydrogen 2.783 N/A ARG 304.A N THR 135.A OG1 no hydrogen 2.876 N/A ARG 304.A NH1 THR 3.A OG1 no hydrogen 3.032 N/A VAL 305.A N TYR 4.A O no hydrogen 2.838 N/A ALA 307.A N TYR 2.A O no hydrogen 2.840 N/A