Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ml4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ LEU 304.A O no hydrogen 3.449 N/A GLY 4.A N VAL 303.A O no hydrogen 2.999 N/A ARG 5.A N TRP 2.A O no hydrogen 3.128 N/A ARG 5.A NH1 ASP 17.A OD1 no hydrogen 3.047 N/A ARG 5.A NH2 ASP 17.A OD1 no hydrogen 3.182 N/A ARG 5.A NH2 ASP 17.A OD2 no hydrogen 3.251 N/A VAL 7.A N VAL 124.A O no hydrogen 2.964 N/A ILE 10.A N GLN 133.A OE1 no hydrogen 3.137 N/A ASP 12.A N SER 9.A O no hydrogen 2.901 N/A PHE 13.A N ILE 10.A O no hydrogen 3.265 N/A SER 14.A N ASP 17.A OD1 no hydrogen 3.449 N/A ASP 17.A N SER 14.A OG no hydrogen 3.297 N/A ILE 18.A N SER 14.A O no hydrogen 3.259 N/A GLU 19.A N LYS 15.A O no hydrogen 2.993 N/A THR 20.A N GLU 16.A O no hydrogen 2.853 N/A THR 20.A OG1 GLU 16.A O no hydrogen 2.654 N/A VAL 21.A N ASP 17.A O no hydrogen 3.020 N/A LEU 22.A N ILE 18.A O no hydrogen 2.999 N/A ALA 23.A N GLU 19.A O no hydrogen 2.926 N/A THR 24.A N THR 20.A O no hydrogen 2.786 N/A THR 24.A OG1 THR 20.A O no hydrogen 2.837 N/A ALA 25.A N VAL 21.A O no hydrogen 2.725 N/A GLU 26.A N LEU 22.A O no hydrogen 3.206 N/A ARG 27.A N ALA 23.A O no hydrogen 3.084 N/A ARG 27.A NE GLU 31.A OE2 no hydrogen 2.854 N/A ARG 27.A NH2 TYR 40.A OH no hydrogen 3.177 N/A LEU 28.A N THR 24.A O no hydrogen 3.043 N/A GLU 29.A N ALA 25.A O no hydrogen 3.062 N/A ARG 30.A N GLU 26.A O no hydrogen 3.048 N/A GLU 31.A N ARG 27.A O no hydrogen 2.853 N/A LEU 32.A N LEU 28.A O no hydrogen 2.800 N/A LYS 33.A N GLU 29.A O no hydrogen 3.428 N/A GLU 34.A N ARG 30.A O no hydrogen 3.227 N/A LYS 35.A N GLU 31.A O no hydrogen 3.021 N/A LYS 35.A NZ GLU 31.A OE1 no hydrogen 3.524 N/A GLY 36.A N LEU 32.A O no hydrogen 2.480 N/A GLN 37.A NE2 LEU 38.A O no hydrogen 2.939 N/A GLN 37.A NE2 HIS 66.A O no hydrogen 3.441 N/A LEU 38.A N ARG 67.A O no hydrogen 3.172 N/A TYR 40.A OH GLU 31.A OE1 no hydrogen 2.562 N/A TYR 40.A OH GLU 31.A OE2 no hydrogen 3.298 N/A ALA 41.A N LEU 68.A O no hydrogen 2.891 N/A LYS 42.A N GLU 39.A O no hydrogen 3.039 N/A LYS 44.A N ALA 41.A O no hydrogen 2.978 N/A ILE 45.A N ASP 101.A OD2 no hydrogen 2.665 N/A LEU 46.A N ALA 71.A O no hydrogen 2.829 N/A ALA 47.A N VAL 102.A O no hydrogen 3.008 N/A THR 48.A N ILE 73.A O no hydrogen 2.913 N/A THR 48.A OG1 GLU 62.A OE2 no hydrogen 2.792 N/A THR 48.A OG1 ILE 73.A O no hydrogen 3.462 N/A LEU 49.A N VAL 104.A O no hydrogen 2.793 N/A PHE 50.A N PHE 75.A O no hydrogen 3.084 N/A PHE 51.A N ARG 106.A O no hydrogen 2.764 N/A ARG 58.A N SER 54.A OG no hydrogen 2.981 N/A ARG 58.A NH1 GLU 62.A OE2 no hydrogen 3.102 N/A LEU 59.A N THR 55.A O no hydrogen 3.175 N/A SER 60.A N ARG 56.A O no hydrogen 2.770 N/A SER 60.A OG ARG 56.A O no hydrogen 2.770 N/A SER 60.A OG THR 57.A O no hydrogen 3.441 N/A PHE 61.A N THR 57.A O no hydrogen 3.351 N/A GLU 62.A N ARG 58.A O no hydrogen 2.940 N/A SER 63.A N LEU 59.A O no hydrogen 2.872 N/A ALA 64.A N SER 60.A O no hydrogen 2.785 N/A MET 65.A N PHE 61.A O no hydrogen 2.966 N/A HIS 66.A N GLU 62.A O no hydrogen 3.160 N/A ARG 67.A N SER 63.A O no hydrogen 2.999 N/A LEU 68.A N ALA 64.A O no hydrogen 2.960 N/A LEU 68.A N MET 65.A O no hydrogen 3.202 N/A GLY 69.A N HIS 66.A O no hydrogen 2.946 N/A GLY 70.A N MET 65.A O no hydrogen 2.874 N/A ALA 71.A N LYS 44.A O no hydrogen 2.983 N/A ILE 73.A N LEU 46.A O no hydrogen 2.969 N/A PHE 75.A N THR 48.A O no hydrogen 3.059 N/A SER 79.A N GLU 77.A OE2 no hydrogen 2.869 N/A THR 80.A N GLU 77.A O no hydrogen 3.126 N/A THR 80.A OG1 GLU 77.A O no hydrogen 2.825 N/A SER 81.A N ALA 78.A O no hydrogen 2.904 N/A SER 81.A OG ALA 78.A O no hydrogen 2.737 N/A VAL 83.A N SER 81.A OG no hydrogen 3.303 N/A LYS 84.A N SER 81.A O no hydrogen 3.204 N/A LYS 84.A NZ SER 79.A OG no hydrogen 3.064 N/A LYS 85.A N SER 82.A O no hydrogen 3.024 N/A GLY 86.A N VAL 83.A O no hydrogen 2.985 N/A GLU 87.A N SER 82.A O no hydrogen 3.337 N/A THR 92.A N SER 88.A O no hydrogen 3.194 N/A THR 92.A OG1 SER 88.A O no hydrogen 2.625 N/A ILE 93.A N LEU 89.A O no hydrogen 2.990 N/A LYS 94.A N ARG 90.A O no hydrogen 2.977 N/A THR 95.A N ASP 91.A O no hydrogen 2.979 N/A VAL 96.A N THR 92.A O no hydrogen 2.890 N/A GLU 97.A N ILE 93.A O no hydrogen 2.839 N/A GLN 98.A N THR 95.A O no hydrogen 3.145 N/A TYR 99.A N VAL 96.A O no hydrogen 2.874 N/A CYS 100.A SG VAL 96.A O no hydrogen 3.625 N/A CYS 100.A SG VAL 102.A O no hydrogen 3.536 N/A ASP 101.A N ILE 45.A O no hydrogen 2.848 N/A ILE 103.A N PRO 123.A O no hydrogen 2.891 N/A VAL 104.A N ALA 47.A O no hydrogen 2.985 N/A ILE 105.A N ILE 125.A O no hydrogen 2.983 N/A ARG 106.A N LEU 49.A O no hydrogen 3.116 N/A ARG 106.A NE ALA 127.A O no hydrogen 2.948 N/A ARG 106.A NH1 PRO 53.A O no hydrogen 3.011 N/A ARG 106.A NH2 ALA 127.A O no hydrogen 2.984 N/A HIS 107.A N GLY 128.A O no hydrogen 3.037 N/A LYS 109.A N HIS 107.A ND1 no hydrogen 3.136 N/A GLY 111.A N ASP 129.A OD2 no hydrogen 2.808 N/A ALA 112.A N LYS 109.A O no hydrogen 3.155 N/A LEU 115.A N GLY 111.A O no hydrogen 3.093 N/A ALA 116.A N ALA 112.A O no hydrogen 3.002 N/A ALA 117.A N ALA 113.A O no hydrogen 2.822 N/A GLU 118.A N ARG 114.A O no hydrogen 2.964 N/A VAL 119.A N LEU 115.A O no hydrogen 3.318 N/A GLU 121.A N GLU 97.A OE1 no hydrogen 3.348 N/A VAL 124.A N ASP 6.A OD2 no hydrogen 2.994 N/A ILE 125.A N ILE 103.A O no hydrogen 2.755 N/A ASN 126.A N VAL 7.A O no hydrogen 2.825 N/A ASN 126.A ND2 ILE 8.A O no hydrogen 3.043 N/A ASN 126.A ND2 ASP 129.A OD1 no hydrogen 2.818 N/A ASN 126.A ND2 GLN 133.A O no hydrogen 3.544 N/A ALA 127.A N ILE 105.A O no hydrogen 2.766 N/A GLY 128.A N ASN 126.A OD1 no hydrogen 2.797 N/A ASP 129.A N GLN 133.A O no hydrogen 3.270 N/A GLY 130.A N HIS 107.A O no hydrogen 2.903 N/A SER 131.A N GLU 110.A OE2 no hydrogen 2.611 N/A SER 131.A OG GLU 110.A OE2 no hydrogen 3.170 N/A ASN 132.A N ASP 129.A O no hydrogen 2.975 N/A ASN 132.A ND2 ASP 129.A OD2 no hydrogen 2.794 N/A GLN 133.A N ASP 129.A OD1 no hydrogen 2.844 N/A GLN 133.A NE2 GLU 174.A OE1 no hydrogen 2.828 N/A HIS 134.A N SER 171.A OG no hydrogen 2.992 N/A GLN 137.A NE2 ASP 141.A OD1 no hydrogen 2.784 N/A THR 138.A N HIS 134.A O no hydrogen 3.369 N/A THR 138.A OG1 HIS 134.A O no hydrogen 3.557 N/A LEU 139.A N PRO 135.A O no hydrogen 3.015 N/A LEU 140.A N THR 136.A O no hydrogen 3.084 N/A ASP 141.A N GLN 137.A O no hydrogen 2.755 N/A LEU 142.A N THR 138.A O no hydrogen 2.862 N/A TYR 143.A N LEU 139.A O no hydrogen 3.259 N/A THR 144.A N LEU 140.A O no hydrogen 3.027 N/A THR 144.A OG1 LEU 140.A O no hydrogen 2.787 N/A ILE 145.A N ASP 141.A O no hydrogen 2.933 N/A LYS 146.A N LEU 142.A O no hydrogen 2.976 N/A LYS 147.A N TYR 143.A O no hydrogen 2.823 N/A GLU 148.A N THR 144.A O no hydrogen 2.750 N/A PHE 149.A N ILE 145.A O no hydrogen 2.792 N/A GLY 154.A N ASP 180.A O no hydrogen 2.872 N/A LYS 156.A N ASP 222.A OD2 no hydrogen 2.520 N/A ILE 157.A N GLU 182.A O no hydrogen 3.026 N/A GLY 158.A N VAL 223.A O no hydrogen 2.702 N/A LEU 159.A N TYR 184.A O no hydrogen 2.651 N/A LEU 160.A N TYR 225.A O no hydrogen 2.979 N/A GLY 161.A N ILE 186.A O no hydrogen 3.064 N/A ASP 162.A N THR 227.A OG1 no hydrogen 2.848 N/A LEU 163.A N GLY 161.A O no hydrogen 3.041 N/A LEU 163.A N LEU 191.A O no hydrogen 3.154 N/A TYR 165.A N ASP 162.A OD1 no hydrogen 2.940 N/A GLY 166.A N ASP 162.A O no hydrogen 3.107 N/A ARG 167.A NH1 GLU 52.A OE2 no hydrogen 2.720 N/A ARG 167.A NH1 GLY 130.A O no hydrogen 2.958 N/A ARG 167.A NH2 GLU 52.A OE2 no hydrogen 2.647 N/A VAL 169.A N GLY 166.A O no hydrogen 3.094 N/A HIS 170.A N GLY 166.A O no hydrogen 3.210 N/A HIS 170.A ND1 ASN 132.A O no hydrogen 3.133 N/A HIS 170.A NE2 LEU 163.A O no hydrogen 2.657 N/A SER 171.A N ARG 167.A O no hydrogen 3.279 N/A SER 171.A OG GLN 133.A OE1 no hydrogen 2.842 N/A SER 171.A OG ARG 167.A O no hydrogen 3.521 N/A LEU 172.A N THR 168.A O no hydrogen 3.052 N/A ALA 173.A N VAL 169.A O no hydrogen 2.992 N/A GLU 174.A N HIS 170.A O no hydrogen 3.472 N/A ALA 175.A N SER 171.A O no hydrogen 2.927 N/A LEU 176.A N LEU 172.A O no hydrogen 3.187 N/A THR 177.A N GLU 174.A O no hydrogen 3.218 N/A PHE 178.A N ALA 175.A O no hydrogen 3.150 N/A TYR 179.A N LEU 176.A O no hydrogen 2.827 N/A TYR 179.A OH GLU 19.A OE2 no hydrogen 2.728 N/A ASP 180.A N ASP 153.A OD1 no hydrogen 2.519 N/A GLU 182.A N LEU 155.A O no hydrogen 3.067 N/A LEU 183.A N LYS 207.A O no hydrogen 3.033 N/A TYR 184.A N ILE 157.A O no hydrogen 2.753 N/A TYR 184.A OH GLU 182.A OE2 no hydrogen 2.735 N/A LEU 185.A N VAL 209.A O no hydrogen 2.938 N/A ILE 186.A N LEU 159.A O no hydrogen 2.843 N/A SER 187.A N THR 211.A O no hydrogen 2.929 N/A SER 187.A OG PRO 188.A O no hydrogen 3.110 N/A SER 187.A OG LEU 191.A O no hydrogen 3.184 N/A LEU 191.A N PRO 188.A O no hydrogen 2.986 N/A ARG 192.A NH1 GLU 189.A O no hydrogen 2.585 N/A VAL 198.A N PRO 194.A O no hydrogen 3.216 N/A GLU 199.A N ARG 195.A O no hydrogen 2.719 N/A GLU 200.A N HIS 196.A O no hydrogen 2.841 N/A LEU 201.A N ILE 197.A O no hydrogen 3.058 N/A ARG 202.A N GLU 199.A O no hydrogen 2.889 N/A GLU 203.A N GLU 199.A O no hydrogen 2.741 N/A GLU 203.A N GLU 200.A O no hydrogen 2.851 N/A LYS 204.A NZ THR 177.A O no hydrogen 3.480 N/A GLY 205.A N ARG 202.A O no hydrogen 3.192 N/A MET 206.A N LEU 201.A O no hydrogen 2.925 N/A VAL 209.A N LEU 183.A O no hydrogen 3.133 N/A THR 211.A N LEU 185.A O no hydrogen 2.981 N/A THR 211.A OG1 THR 213.A O no hydrogen 3.378 N/A THR 213.A N THR 211.A OG1 no hydrogen 3.291 N/A THR 213.A OG1 ASP 216.A OD1 no hydrogen 2.875 N/A VAL 217.A N LEU 214.A O no hydrogen 2.963 N/A ILE 218.A N LEU 214.A O no hydrogen 2.817 N/A LYS 220.A N VAL 217.A O no hydrogen 3.167 N/A LEU 221.A N ILE 218.A O no hydrogen 3.248 N/A ASP 222.A N LYS 156.A O no hydrogen 2.800 N/A VAL 223.A N LYS 156.A O no hydrogen 3.140 N/A LEU 224.A N ARG 262.A O no hydrogen 2.822 N/A TYR 225.A N GLY 158.A O no hydrogen 2.810 N/A TYR 225.A OH ASP 141.A OD2 no hydrogen 2.827 N/A VAL 226.A N MET 264.A O no hydrogen 2.867 N/A THR 227.A N LEU 160.A O no hydrogen 3.045 N/A THR 227.A OG1 LEU 160.A O no hydrogen 2.900 N/A ARG 228.A NH1 GLU 232.A OE2 no hydrogen 3.078 N/A ARG 228.A NH2 GLU 232.A OE1 no hydrogen 2.880 N/A GLN 230.A N ASP 162.A OD2 no hydrogen 2.849 N/A GLN 230.A NE2 ARG 228.A O no hydrogen 2.795 N/A LYS 231.A N ILE 229.A O no hydrogen 2.692 N/A GLU 232.A N GLU 232.A OE2 no hydrogen 2.768 N/A ARG 233.A N GLN 230.A O no hydrogen 2.725 N/A ARG 233.A NH1 GLU 52.A OE1 no hydrogen 2.897 N/A ARG 233.A NH2 GLU 52.A OE1 no hydrogen 3.299 N/A ARG 233.A NH2 GLU 52.A OE2 no hydrogen 2.881 N/A PHE 234.A N LYS 231.A O no hydrogen 3.322 N/A GLU 239.A N ASP 236.A OD2 no hydrogen 2.759 N/A TYR 240.A N GLU 237.A O no hydrogen 2.888 N/A LEU 241.A N GLU 237.A O no hydrogen 2.733 N/A LYS 242.A N GLN 238.A O no hydrogen 3.281 N/A LYS 242.A NZ GLN 238.A O no hydrogen 2.745 N/A VAL 243.A N TYR 240.A O no hydrogen 3.197 N/A SER 246.A OG LYS 244.A O no hydrogen 2.890 N/A TYR 247.A OH THR 227.A O no hydrogen 2.743 N/A GLN 248.A NE2 ASP 271.A O no hydrogen 2.647 N/A VAL 249.A N GLU 272.A O no hydrogen 2.784 N/A LEU 251.A N GLU 276.A OE2 no hydrogen 2.610 N/A LEU 254.A N ASN 250.A O no hydrogen 3.121 N/A GLU 255.A N LYS 252.A O no hydrogen 2.908 N/A LYS 258.A NZ LYS 220.A O no hydrogen 3.237 N/A GLU 260.A N GLU 260.A OE2 no hydrogen 2.617 N/A LEU 261.A N LYS 258.A O no hydrogen 3.028 N/A ARG 262.A N ASP 222.A O no hydrogen 2.767 N/A ARG 262.A NE GLU 148.A OE1 no hydrogen 3.523 N/A ARG 262.A NH1 ASP 259.A O no hydrogen 3.560 N/A ARG 262.A NH1 LEU 261.A O no hydrogen 2.834 N/A ILE 263.A N HIS 282.A O no hydrogen 2.989 N/A MET 264.A N LEU 224.A O no hydrogen 2.719 N/A HIS 265.A N GLN 288.A OE1 no hydrogen 2.959 N/A HIS 265.A NE2 GLU 272.A OE2 no hydrogen 2.623 N/A LEU 267.A N HIS 265.A ND1 no hydrogen 2.666 N/A ARG 269.A NH1 ASP 278.A OD1 no hydrogen 2.708 N/A ARG 269.A NH2 ASP 278.A OD1 no hydrogen 3.180 N/A ARG 269.A NH2 ASP 278.A OD2 no hydrogen 2.666 N/A VAL 270.A N GLU 272.A OE1 no hydrogen 3.007 N/A VAL 270.A N GLU 272.A OE2 no hydrogen 3.380 N/A ASP 271.A N GLU 272.A OE1 no hydrogen 3.092 N/A GLU 272.A N GLU 272.A OE1 no hydrogen 2.757 N/A HIS 274.A N VAL 249.A O no hydrogen 2.766 N/A GLU 276.A N HIS 274.A ND1 no hydrogen 2.760 N/A VAL 277.A N HIS 274.A O no hydrogen 2.942 N/A ASP 278.A N PRO 275.A O no hydrogen 3.113 N/A THR 280.A N VAL 277.A O no hydrogen 2.995 N/A THR 280.A OG1 VAL 277.A O no hydrogen 2.626 N/A HIS 282.A N THR 280.A OG1 no hydrogen 3.276 N/A HIS 282.A ND1 LEU 261.A O no hydrogen 2.518 N/A ILE 284.A N ILE 263.A O no hydrogen 3.184 N/A TYR 285.A OH ASP 278.A OD1 no hydrogen 2.757 N/A ARG 287.A N ILE 284.A O no hydrogen 3.033 N/A GLN 288.A N ILE 284.A O no hydrogen 2.874 N/A GLN 288.A NE2 ASP 141.A OD1 no hydrogen 2.919 N/A VAL 289.A N TYR 285.A O no hydrogen 3.059 N/A PHE 290.A N PHE 286.A O no hydrogen 3.435 N/A ASN 291.A N ARG 287.A O no hydrogen 3.290 N/A ASN 291.A ND2 THR 144.A OG1 no hydrogen 2.866 N/A GLY 292.A N VAL 289.A O no hydrogen 3.016 N/A VAL 293.A N PHE 290.A O no hydrogen 3.456 N/A VAL 295.A N ASN 291.A O no hydrogen 3.244 N/A ARG 296.A N GLY 292.A O no hydrogen 2.880 N/A ARG 296.A NE THR 136.A OG1 no hydrogen 3.373 N/A ARG 296.A NH2 THR 136.A OG1 no hydrogen 2.829 N/A MET 297.A N VAL 293.A O no hydrogen 2.674 N/A ALA 298.A N PRO 294.A O no hydrogen 2.923 N/A LEU 299.A N VAL 295.A O no hydrogen 3.031 N/A LEU 300.A N ARG 296.A O no hydrogen 2.946 N/A ALA 301.A N MET 297.A O no hydrogen 2.953 N/A LEU 302.A N ALA 298.A O no hydrogen 2.869 N/A VAL 303.A N LEU 299.A O no hydrogen 2.958 N/A LEU 304.A N LEU 300.A O no hydrogen 2.905 N/A GLY 305.A N LEU 302.A O no hydrogen 2.966 N/A VAL 306.A N ALA 301.A O no hydrogen 2.940 N/A