Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4tus_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A ND2 HIS 42.A O no hydrogen 3.313 N/A ILE 6.A N ASN 3.A O no hydrogen 3.144 N/A THR 7.A N ASN 3.A O no hydrogen 3.210 N/A THR 7.A OG1 ASN 3.A O no hydrogen 3.399 N/A THR 7.A OG1 GLY 4.A O no hydrogen 3.057 N/A ASP 8.A N GLY 4.A O no hydrogen 3.052 N/A LEU 10.A N ILE 6.A O no hydrogen 2.937 N/A THR 11.A N THR 7.A O no hydrogen 2.880 N/A THR 11.A OG1 THR 7.A O no hydrogen 2.954 N/A GLU 12.A N ASP 8.A O no hydrogen 2.958 N/A LEU 13.A N MET 9.A O no hydrogen 2.989 N/A ALA 14.A N LEU 10.A O no hydrogen 2.993 N/A ASN 15.A N THR 11.A O no hydrogen 2.970 N/A PHE 16.A N GLU 12.A O no hydrogen 3.190 N/A GLU 17.A N LEU 13.A O no hydrogen 3.176 N/A LYS 18.A N ALA 14.A O no hydrogen 2.997 N/A ASN 19.A N ASN 15.A O no hydrogen 2.806 N/A ASN 19.A ND2 ASN 89.A OD1 no hydrogen 3.015 N/A VAL 20.A N PHE 16.A O no hydrogen 2.860 N/A SER 21.A N PHE 16.A O no hydrogen 3.212 N/A SER 21.A OG GLU 17.A OE1 no hydrogen 3.102 N/A ALA 23.A N GLU 17.A O no hydrogen 2.694 N/A LYS 26.A N ALA 23.A O no hydrogen 3.102 N/A TYR 27.A N ALA 23.A O no hydrogen 3.046 N/A ASN 28.A N ILE 24.A O no hydrogen 3.031 N/A ALA 29.A N HIS 25.A O no hydrogen 3.007 N/A TYR 30.A N LYS 26.A O no hydrogen 2.926 N/A ARG 31.A N TYR 27.A O no hydrogen 2.988 N/A ARG 31.A NH1 ASP 266.A OD2 no hydrogen 2.968 N/A ARG 31.A NH2 ASP 266.A OD2 no hydrogen 3.485 N/A LYS 32.A N ASN 28.A O no hydrogen 2.834 N/A ALA 33.A N ALA 29.A O no hydrogen 3.002 N/A ALA 34.A N TYR 30.A O no hydrogen 2.878 N/A SER 35.A N ARG 31.A O no hydrogen 3.006 N/A SER 35.A OG GLU 325.A O no hydrogen 2.938 N/A VAL 36.A N LYS 32.A O no hydrogen 3.072 N/A ILE 37.A N ALA 33.A O no hydrogen 3.086 N/A ALA 38.A N ALA 34.A O no hydrogen 2.873 N/A LYS 39.A N SER 35.A O no hydrogen 3.176 N/A TYR 40.A N ILE 37.A O no hydrogen 3.256 N/A TYR 40.A OH GLU 49.A OE2 no hydrogen 2.753 N/A ILE 44.A N ASN 3.A OD1 no hydrogen 2.781 N/A LYS 45.A N GLU 49.A OE1 no hydrogen 3.020 N/A LYS 45.A NZ LYS 43.A O no hydrogen 3.524 N/A GLY 47.A N ASP 65.A OD1 no hydrogen 2.780 N/A GLU 49.A N SER 46.A O no hydrogen 3.249 N/A ALA 50.A N SER 46.A O no hydrogen 3.445 N/A LYS 51.A N GLY 47.A O no hydrogen 2.861 N/A LYS 52.A N GLU 49.A O no hydrogen 3.392 N/A LEU 53.A N ALA 50.A O no hydrogen 3.007 N/A VAL 56.A N LEU 53.A O no hydrogen 3.217 N/A ALA 61.A N GLY 57.A O no hydrogen 3.045 N/A GLU 62.A N THR 58.A O no hydrogen 3.048 N/A LYS 63.A N LYS 59.A O no hydrogen 3.134 N/A ILE 64.A N ILE 60.A O no hydrogen 2.807 N/A ASP 65.A N ALA 61.A O no hydrogen 2.867 N/A GLU 66.A N GLU 62.A O no hydrogen 2.834 N/A PHE 67.A N LYS 63.A O no hydrogen 3.008 N/A LEU 68.A N ILE 64.A O no hydrogen 2.991 N/A ALA 69.A N ASP 65.A O no hydrogen 3.166 N/A THR 70.A N GLU 66.A O no hydrogen 3.048 N/A THR 70.A OG1 GLU 66.A O no hydrogen 2.924 N/A GLY 71.A N PHE 67.A O no hydrogen 2.624 N/A LYS 72.A N THR 70.A OG1 no hydrogen 3.266 N/A ARG 74.A N GLU 66.A OE2 no hydrogen 2.758 N/A LEU 76.A N LEU 73.A O no hydrogen 2.967 N/A GLU 77.A N LEU 73.A O no hydrogen 3.175 N/A LYS 78.A N ARG 74.A O no hydrogen 2.928 N/A ILE 79.A N LYS 75.A O no hydrogen 3.148 N/A ARG 80.A N LEU 76.A O no hydrogen 2.981 N/A ARG 80.A NH2 GLU 12.A OE1 no hydrogen 3.045 N/A GLN 81.A N GLU 77.A O no hydrogen 2.963 N/A ASP 82.A N LYS 78.A O no hydrogen 2.912 N/A SER 85.A N ASP 82.A OD2 no hydrogen 3.467 N/A SER 85.A OG ASP 82.A OD2 no hydrogen 2.607 N/A SER 86.A N ASP 82.A O no hydrogen 3.085 N/A SER 86.A OG ASP 82.A O no hydrogen 2.749 N/A SER 87.A N ASP 83.A O no hydrogen 2.972 N/A SER 87.A OG ASP 83.A O no hydrogen 2.766 N/A ILE 88.A N THR 84.A O no hydrogen 2.920 N/A ASN 89.A N SER 85.A O no hydrogen 2.906 N/A PHE 90.A N SER 86.A O no hydrogen 3.012 N/A LEU 91.A N SER 87.A O no hydrogen 3.108 N/A THR 92.A OG1 ASN 89.A O no hydrogen 2.754 N/A ARG 93.A N PHE 90.A O no hydrogen 2.845 N/A ARG 93.A NE GLU 138.A OE2 no hydrogen 2.589 N/A ARG 93.A NH2 GLU 138.A OE1 no hydrogen 2.831 N/A ARG 93.A NH2 GLU 138.A OE2 no hydrogen 3.070 N/A VAL 94.A N LEU 91.A O no hydrogen 3.011 N/A SER 95.A OG HIS 126.A NE2 no hydrogen 2.934 N/A ILE 97.A N VAL 94.A O no hydrogen 3.116 N/A ALA 102.A N GLY 98.A O no hydrogen 2.979 N/A ARG 103.A N PRO 99.A O no hydrogen 3.103 N/A ARG 103.A NH2 VAL 20.A O no hydrogen 2.802 N/A LYS 104.A N SER 100.A O no hydrogen 3.086 N/A PHE 105.A N ALA 101.A O no hydrogen 2.955 N/A VAL 106.A N ALA 102.A O no hydrogen 3.162 N/A ASP 107.A N ARG 103.A O no hydrogen 3.069 N/A GLU 108.A N LYS 104.A O no hydrogen 3.314 N/A GLU 108.A N PHE 105.A O no hydrogen 2.902 N/A GLY 109.A N VAL 106.A O no hydrogen 2.821 N/A ILE 110.A N PHE 105.A O no hydrogen 2.876 N/A LYS 111.A N ASP 115.A OD2 no hydrogen 3.101 N/A LYS 111.A NZ ASP 83.A OD2 no hydrogen 3.188 N/A ASP 115.A N THR 112.A OG1 no hydrogen 3.114 N/A LEU 116.A N THR 112.A O no hydrogen 3.168 N/A ARG 117.A N LEU 113.A O no hydrogen 3.084 N/A LYS 118.A N GLU 114.A O no hydrogen 2.832 N/A ASN 119.A N ASP 115.A O no hydrogen 3.002 N/A ASN 119.A ND2 ASP 115.A O no hydrogen 3.070 N/A GLU 120.A N ARG 117.A O no hydrogen 3.196 N/A LYS 122.A N ASN 119.A O no hydrogen 3.074 N/A LYS 122.A NZ ASP 121.A OD2 no hydrogen 3.383 N/A LEU 123.A N GLU 120.A O no hydrogen 2.998 N/A ASN 124.A N GLN 127.A OE1 no hydrogen 2.989 N/A HIS 125.A NE2 THR 218.A O no hydrogen 2.961 N/A HIS 126.A NE2 SER 95.A OG no hydrogen 2.934 N/A GLN 127.A N ASN 124.A OD1 no hydrogen 2.735 N/A GLN 127.A NE2 GLY 96.A O no hydrogen 3.078 N/A ARG 128.A N ASN 124.A O no hydrogen 3.020 N/A ILE 129.A N HIS 125.A O no hydrogen 3.122 N/A GLY 130.A N HIS 126.A O no hydrogen 2.977 N/A LEU 131.A N GLN 127.A O no hydrogen 2.953 N/A LYS 132.A N ARG 128.A O no hydrogen 3.005 N/A TYR 133.A N ILE 129.A O no hydrogen 3.022 N/A TYR 133.A OH ASP 217.A OD1 no hydrogen 2.834 N/A PHE 134.A N LEU 131.A O no hydrogen 3.277 N/A PHE 137.A N TYR 133.A O no hydrogen 2.823 N/A GLU 138.A N GLY 135.A O no hydrogen 3.194 N/A LYS 139.A N ASP 136.A O no hydrogen 3.078 N/A ARG 140.A NE SER 178.A OG no hydrogen 2.780 N/A ARG 140.A NH2 SER 178.A OG no hydrogen 2.755 N/A ILE 141.A N SER 179.A O no hydrogen 2.754 N/A ARG 143.A N GLU 177.A O no hydrogen 2.803 N/A ARG 143.A NH1 PHE 172.A O no hydrogen 2.977 N/A ARG 143.A NH1 ALA 176.A O no hydrogen 2.796 N/A ARG 143.A NH2 PHE 172.A O no hydrogen 3.196 N/A GLU 145.A N PRO 142.A O no hydrogen 2.867 N/A MET 146.A N PRO 142.A O no hydrogen 3.193 N/A LEU 147.A N ARG 143.A O no hydrogen 3.010 N/A GLN 148.A N GLU 144.A O no hydrogen 3.445 N/A MET 149.A N GLU 145.A O no hydrogen 2.892 N/A GLN 150.A N MET 146.A O no hydrogen 2.653 N/A ASP 151.A N LEU 147.A O no hydrogen 2.962 N/A ILE 152.A N GLN 148.A O no hydrogen 3.290 N/A VAL 153.A N MET 149.A O no hydrogen 2.949 N/A LEU 154.A N GLN 150.A O no hydrogen 2.847 N/A ASN 155.A N ASP 151.A O no hydrogen 3.078 N/A GLU 156.A N ILE 152.A O no hydrogen 2.973 N/A VAL 157.A N VAL 153.A O no hydrogen 3.109 N/A LYS 158.A N LEU 154.A O no hydrogen 3.250 N/A LYS 159.A N ASN 155.A O no hydrogen 2.948 N/A LYS 159.A NZ GLU 156.A OE2 no hydrogen 2.850 N/A VAL 160.A N VAL 157.A O no hydrogen 3.289 N/A ASP 161.A N VAL 157.A O no hydrogen 3.317 N/A GLU 163.A N ASP 161.A OD1 no hydrogen 3.286 N/A TYR 164.A N ASP 161.A O no hydrogen 3.160 N/A TYR 164.A OH LEU 201.A O no hydrogen 2.719 N/A ILE 165.A N THR 187.A O no hydrogen 3.021 N/A THR 167.A N LEU 185.A O no hydrogen 2.780 N/A THR 167.A OG1 TYR 255.A OH no hydrogen 3.029 N/A CYS 169.A N ASP 183.A O no hydrogen 2.767 N/A CYS 169.A SG THR 167.A O no hydrogen 3.528 N/A GLY 170.A N PHE 262.A O no hydrogen 2.806 N/A SER 171.A OG SER 179.A OG no hydrogen 3.148 N/A ARG 173.A NH1 GLU 306.A OE1 no hydrogen 3.176 N/A ARG 173.A NH1 GLU 306.A OE2 no hydrogen 3.358 N/A ARG 173.A NH2 GLU 306.A OE2 no hydrogen 2.739 N/A ARG 174.A N GLY 170.A O no hydrogen 3.384 N/A ARG 174.A NE SER 324.A OG no hydrogen 2.901 N/A ARG 174.A NH1 THR 263.A O no hydrogen 2.850 N/A GLY 175.A N PHE 172.A O no hydrogen 2.863 N/A ALA 176.A N SER 171.A O no hydrogen 3.040 N/A SER 179.A N ILE 141.A O no hydrogen 2.916 N/A SER 179.A OG SER 171.A OG no hydrogen 3.148 N/A MET 182.A N ARG 244.A O no hydrogen 3.017 N/A VAL 184.A N ASP 246.A O no hydrogen 2.801 N/A LEU 185.A N THR 167.A O no hydrogen 2.745 N/A LEU 186.A N ARG 248.A O no hydrogen 2.870 N/A THR 187.A N ILE 165.A O no hydrogen 3.037 N/A HIS 188.A ND1 SER 190.A OG no hydrogen 2.623 N/A HIS 188.A NE2 ASP 161.A OD1 no hydrogen 2.650 N/A SER 190.A N HIS 188.A ND1 no hydrogen 3.319 N/A SER 190.A OG HIS 188.A ND1 no hydrogen 2.623 N/A PHE 191.A N HIS 188.A O no hydrogen 2.978 N/A SER 193.A N ASP 253.A OD2 no hydrogen 3.018 N/A SER 193.A OG ASP 253.A OD1 no hydrogen 2.603 N/A SER 193.A OG ASP 253.A OD2 no hydrogen 3.519 N/A GLU 194.A N THR 192.A OG1 no hydrogen 3.213 N/A GLN 204.A N LYS 200.A O no hydrogen 2.860 N/A VAL 206.A N LEU 202.A O no hydrogen 3.043 N/A GLU 207.A N HIS 203.A O no hydrogen 2.762 N/A GLN 208.A N GLN 204.A O no hydrogen 2.957 N/A GLN 208.A NE2 GLU 156.A OE1 no hydrogen 2.704 N/A LEU 209.A N VAL 205.A O no hydrogen 3.119 N/A GLN 210.A N VAL 206.A O no hydrogen 3.020 N/A LYS 211.A N GLU 207.A O no hydrogen 3.019 N/A VAL 212.A N GLN 208.A O no hydrogen 3.226 N/A HIS 213.A N GLN 210.A O no hydrogen 3.042 N/A PHE 214.A N LEU 209.A O no hydrogen 2.832 N/A ILE 215.A N LEU 209.A O no hydrogen 3.086 N/A THR 216.A N VAL 229.A O no hydrogen 2.798 N/A THR 216.A OG1 ASP 217.A OD1 no hydrogen 2.875 N/A THR 216.A OG1 VAL 229.A O no hydrogen 3.471 N/A ASP 217.A N VAL 229.A O no hydrogen 3.386 N/A LEU 219.A N MET 227.A O no hydrogen 2.734 N/A SER 220.A N MET 227.A O no hydrogen 2.881 N/A LYS 221.A NZ HIS 203.A ND1 no hydrogen 2.978 N/A GLY 222.A N LYS 225.A O no hydrogen 3.080 N/A PHE 226.A N ILE 247.A O no hydrogen 2.832 N/A MET 227.A N SER 220.A O no hydrogen 2.825 N/A GLY 228.A N ILE 245.A O no hydrogen 3.031 N/A VAL 229.A N ASP 217.A O no hydrogen 2.847 N/A CYS 230.A N ARG 243.A O no hydrogen 2.691 N/A CYS 230.A SG ARG 243.A O no hydrogen 3.752 N/A GLN 231.A N PHE 214.A O no hydrogen 2.893 N/A GLN 231.A NE2 GLU 239.A OE1 no hydrogen 3.200 N/A GLN 231.A NE2 TYR 240.A O no hydrogen 2.886 N/A HIS 242.A N ASP 136.A OD2 no hydrogen 3.093 N/A ARG 243.A N CYS 230.A O no hydrogen 2.597 N/A ARG 243.A NH1 ARG 140.A O no hydrogen 3.361 N/A ARG 243.A NH2 GLU 145.A OE1 no hydrogen 2.781 N/A ARG 244.A NH1 GLY 228.A O no hydrogen 3.022 N/A ARG 244.A NH1 ILE 245.A O no hydrogen 3.302 N/A ARG 244.A NH1 ASP 246.A OD1 no hydrogen 2.908 N/A ARG 244.A NH2 ASP 246.A OD1 no hydrogen 2.992 N/A ILE 245.A N GLY 228.A O no hydrogen 3.029 N/A ASP 246.A N MET 182.A O no hydrogen 2.907 N/A ILE 247.A N PHE 226.A O no hydrogen 2.876 N/A ARG 248.A N VAL 184.A O no hydrogen 2.909 N/A ARG 248.A NH2 GLU 285.A OE2 no hydrogen 2.928 N/A ARG 248.A NH2 TYR 286.A OH no hydrogen 2.936 N/A LEU 249.A N THR 224.A O no hydrogen 2.844 N/A ILE 250.A N LEU 186.A O no hydrogen 2.938 N/A LYS 252.A N PHE 191.A O no hydrogen 2.888 N/A GLN 254.A N PRO 251.A O no hydrogen 2.839 N/A TYR 255.A OH THR 167.A OG1 no hydrogen 3.029 N/A GLY 258.A N GLN 254.A O no hydrogen 3.153 N/A VAL 259.A N TYR 255.A O no hydrogen 2.768 N/A LEU 260.A N TYR 256.A O no hydrogen 2.907 N/A TYR 261.A N CYS 257.A O no hydrogen 3.028 N/A PHE 262.A N GLY 258.A O no hydrogen 2.931 N/A THR 263.A N VAL 259.A O no hydrogen 3.122 N/A THR 263.A OG1 VAL 259.A O no hydrogen 2.348 N/A GLY 264.A N LEU 260.A O no hydrogen 3.429 N/A GLY 264.A N TYR 261.A O no hydrogen 3.108 N/A SER 265.A N ARG 323.A O no hydrogen 3.006 N/A SER 265.A OG ARG 323.A O no hydrogen 3.078 N/A SER 265.A OG GLU 325.A OXT no hydrogen 3.063 N/A PHE 268.A N SER 265.A OG no hydrogen 3.343 N/A ASN 269.A N SER 265.A O no hydrogen 2.957 N/A ASN 269.A ND2 TYR 261.A O no hydrogen 2.938 N/A LYS 270.A N ASP 266.A O no hydrogen 3.258 N/A ASN 271.A N ILE 267.A O no hydrogen 2.867 N/A ASN 271.A ND2 GLU 325.A OE1 no hydrogen 2.752 N/A MET 272.A N PHE 268.A O no hydrogen 2.778 N/A ARG 273.A N ASN 269.A O no hydrogen 3.066 N/A ARG 273.A NH1 ILE 283.A O no hydrogen 3.311 N/A ALA 274.A N LYS 270.A O no hydrogen 3.120 N/A HIS 275.A N ASN 271.A O no hydrogen 2.946 N/A HIS 275.A NE2 ILE 313.A O no hydrogen 2.679 N/A ALA 276.A N MET 272.A O no hydrogen 2.898 N/A LEU 277.A N ARG 273.A O no hydrogen 3.012 N/A LYS 279.A N ALA 276.A O no hydrogen 3.158 N/A LYS 279.A NZ GLN 314.A OE1 no hydrogen 2.926 N/A GLY 280.A N LEU 277.A O no hydrogen 3.120 N/A PHE 281.A N ALA 276.A O no hydrogen 2.860 N/A THR 282.A N ARG 289.A O no hydrogen 2.724 N/A ASN 284.A N THR 287.A O no hydrogen 3.044 N/A TYR 286.A N ASN 284.A OD1 no hydrogen 3.218 N/A THR 287.A N ASN 284.A OD1 no hydrogen 2.790 N/A THR 287.A OG1 ASN 284.A OD1 no hydrogen 3.034 N/A ARG 289.A N THR 282.A O no hydrogen 2.903 N/A ARG 289.A NE THR 287.A OG1 no hydrogen 3.265 N/A ARG 289.A NH1 GLY 298.A O no hydrogen 3.166 N/A ARG 289.A NH1 GLU 299.A OE2 no hydrogen 3.362 N/A LEU 291.A N GLY 280.A O no hydrogen 2.957 N/A GLY 292.A N VAL 296.A O no hydrogen 2.895 N/A GLY 295.A N GLY 292.A O no hydrogen 3.361 N/A GLY 298.A N PRO 290.A O no hydrogen 2.696 N/A LEU 301.A N ILE 288.A O no hydrogen 2.946 N/A ASP 304.A N ASP 308.A OD2 no hydrogen 2.955 N/A ASP 308.A N SER 305.A OG no hydrogen 3.189 N/A PHE 310.A N GLU 306.A O no hydrogen 3.384 N/A ASP 311.A N LYS 307.A O no hydrogen 2.947 N/A TYR 312.A N ASP 308.A O no hydrogen 3.214 N/A TYR 312.A OH PRO 302.A O no hydrogen 2.685 N/A GLN 314.A N ASP 311.A O no hydrogen 2.979 N/A TRP 315.A N PHE 310.A O no hydrogen 2.812 N/A ARG 318.A NE ASP 322.A O no hydrogen 3.190 N/A ARG 318.A NH1 GLU 325.A OE2 no hydrogen 2.905 N/A ARG 318.A NH2 ASP 322.A O no hydrogen 2.703 N/A ARG 318.A NH2 GLU 325.A OE2 no hydrogen 2.401 N/A ASP 322.A N GLU 319.A O no hydrogen 2.685 N/A ARG 323.A N PRO 320.A O no hydrogen 3.293 N/A ARG 323.A NE ARG 318.A O no hydrogen 3.068 N/A ARG 323.A NH1 GLU 306.A OE1 no hydrogen 2.762 N/A ARG 323.A NH2 GLU 306.A OE1 no hydrogen 3.469 N/A ARG 323.A NH2 ARG 318.A O no hydrogen 3.135 N/A GLU 325.A N ARG 323.A O no hydrogen 2.898 N/A