Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6csw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N GLN 3.A OE1 no hydrogen 2.796 N/A ALA 5.A N GLU 8.A OE2 no hydrogen 2.809 N/A GLY 7.A N VAL 20.A O no hydrogen 2.810 N/A GLU 8.A N ALA 5.A O no hydrogen 3.071 N/A ILE 10.A N TRP 18.A O no hydrogen 2.816 N/A ASP 12.A N ALA 16.A O no hydrogen 3.001 N/A MET 13.A N SER 91.A O no hydrogen 3.001 N/A ALA 14.A N ASP 12.A OD1 no hydrogen 2.904 N/A ALA 15.A N ASP 12.A O no hydrogen 2.850 N/A ALA 16.A N ASP 12.A OD1 no hydrogen 3.032 N/A TRP 18.A N ILE 10.A O no hydrogen 2.841 N/A TRP 18.A NE1 ASP 12.A OD2 no hydrogen 3.069 N/A LYS 19.A N ASP 30.A O no hydrogen 2.785 N/A LYS 19.A NZ GLY 7.A O no hydrogen 3.366 N/A VAL 20.A N GLU 8.A O no hydrogen 3.012 N/A GLY 21.A N LEU 28.A O no hydrogen 2.621 N/A ILE 24.A N ILE 26.A O no hydrogen 3.229 N/A TYR 27.A N VAL 45.A O no hydrogen 2.797 N/A TYR 27.A OH GLN 3.A OE1 no hydrogen 2.827 N/A LEU 28.A N LEU 22.A O no hydrogen 2.915 N/A ALA 29.A N CYS 43.A O no hydrogen 2.861 N/A ASP 30.A N LYS 19.A O no hydrogen 3.179 N/A MET 31.A N ASP 30.A OD1 no hydrogen 2.703 N/A ASN 32.A N ALA 17.A O no hydrogen 3.207 N/A SER 33.A OG ASN 32.A O no hydrogen 3.018 N/A ALA 41.A N GLY 38.A O no hydrogen 3.219 N/A CYS 43.A N ALA 29.A O no hydrogen 3.315 N/A VAL 44.A N MET 106.A O no hydrogen 3.012 N/A VAL 45.A N TYR 27.A O no hydrogen 2.619 N/A LYS 46.A N MET 104.A O no hydrogen 2.870 N/A LYS 46.A NZ GLU 58.A OE1 no hydrogen 2.827 N/A LYS 46.A NZ GLU 58.A OE2 no hydrogen 3.524 N/A VAL 47.A N CYS 25.A O no hydrogen 3.025 N/A GLU 48.A N ARG 102.A O no hydrogen 3.047 N/A SER 50.A N SER 100.A O no hydrogen 2.956 N/A SER 50.A OG SER 100.A O no hydrogen 3.431 N/A ASN 52.A N PRO 49.A O no hydrogen 2.762 N/A LEU 55.A N ASN 52.A OD1 no hydrogen 3.131 N/A THR 57.A N GLY 53.A O no hydrogen 3.101 N/A THR 57.A OG1 GLY 53.A O no hydrogen 3.213 N/A GLU 58.A N PRO 54.A O no hydrogen 2.850 N/A LEU 59.A N LEU 55.A O no hydrogen 2.874 N/A LYS 60.A N PHE 56.A O no hydrogen 3.030 N/A LYS 60.A NZ GLN 63.A OE1 no hydrogen 3.119 N/A PHE 61.A N THR 57.A O no hydrogen 3.216 N/A TYR 62.A N GLU 58.A O no hydrogen 2.961 N/A GLN 63.A N LEU 59.A O no hydrogen 2.862 N/A GLN 63.A NE2 TYR 88.A OH no hydrogen 3.453 N/A ARG 64.A N LYS 60.A O no hydrogen 3.024 N/A ARG 64.A NH1 TYR 148.A OH no hydrogen 2.916 N/A ALA 65.A N PHE 61.A O no hydrogen 2.837 N/A ALA 66.A N TYR 62.A O no hydrogen 3.012 N/A LYS 67.A N GLN 70.A OE1 no hydrogen 3.103 N/A LYS 67.A NZ GLN 63.A O no hydrogen 2.740 N/A LYS 67.A NZ GLN 70.A OE1 no hydrogen 2.889 N/A GLN 70.A NE2 ARG 64.A O no hydrogen 2.925 N/A ILE 71.A N LYS 67.A O no hydrogen 3.033 N/A GLN 72.A N PRO 68.A O no hydrogen 2.984 N/A LYS 73.A N GLU 69.A O no hydrogen 2.875 N/A TRP 74.A N GLN 70.A O no hydrogen 3.157 N/A ILE 75.A N ILE 71.A O no hydrogen 2.911 N/A ARG 76.A N GLN 72.A O no hydrogen 2.974 N/A THR 77.A N LYS 73.A O no hydrogen 3.006 N/A THR 77.A OG1 LYS 73.A O no hydrogen 2.963 N/A THR 77.A OG1 TRP 74.A O no hydrogen 3.277 N/A ARG 78.A N TRP 74.A O no hydrogen 2.937 N/A ARG 78.A NH1.A THR 77.A OG1 no hydrogen 3.062 N/A ARG 78.A NH1.B GLU 141.A OE2 no hydrogen 2.675 N/A ARG 78.A NH2.B GLU 141.A OE2 no hydrogen 2.900 N/A LYS 79.A N ARG 76.A O no hydrogen 3.361 N/A LEU 80.A N ILE 75.A O no hydrogen 2.993 N/A TYR 82.A OH VAL 168.A O no hydrogen 2.715 N/A LYS 87.A N ASP 107.A OD2 no hydrogen 3.006 N/A LYS 87.A NZ GLN 72.A OE1 no hydrogen 3.325 N/A TYR 88.A N ALA 66.A O no hydrogen 2.904 N/A TYR 88.A OH SER 91.A OG no hydrogen 2.790 N/A TRP 89.A N ILE 105.A O no hydrogen 2.885 N/A TRP 89.A NE1 ASP 107.A OD1 no hydrogen 2.890 N/A SER 91.A OG TYR 88.A OH no hydrogen 2.790 N/A GLY 92.A N PHE 103.A O no hydrogen 3.023 N/A HIS 94.A N TYR 101.A O no hydrogen 2.899 N/A HIS 94.A NE2 GLN 3.A O no hydrogen 2.842 N/A LYS 96.A N LYS 99.A O no hydrogen 2.860 N/A LYS 99.A N LYS 96.A O no hydrogen 3.098 N/A SER 100.A OG ASP 95.A OD1 no hydrogen 3.247 N/A TYR 101.A N HIS 94.A O no hydrogen 2.738 N/A ARG 102.A N GLU 48.A O no hydrogen 2.746 N/A ARG 102.A NH2 SER 50.A O no hydrogen 3.053 N/A PHE 103.A N GLY 92.A O no hydrogen 2.978 N/A MET 104.A N LYS 46.A O no hydrogen 3.012 N/A ILE 105.A N GLY 90.A O no hydrogen 2.878 N/A MET 106.A N VAL 44.A O no hydrogen 3.151 N/A ASP 107.A N LYS 87.A O no hydrogen 3.281 N/A ARG 108.A N PRO 42.A O no hydrogen 2.930 N/A ARG 108.A NE PHE 109.A O no hydrogen 3.130 N/A ARG 108.A NH1 SER 39.A O no hydrogen 2.545 N/A ARG 108.A NH1 ALA 41.A O no hydrogen 2.990 N/A ARG 108.A NH2 SER 39.A O no hydrogen 3.335 N/A GLY 110.A N LEU 160.A O no hydrogen 2.793 N/A SER 111.A OG ASP 112.A O no hydrogen 2.721 N/A LEU 113.A N ALA 155.A O no hydrogen 3.196 N/A LEU 113.A N LEU 158.A O no hydrogen 2.833 N/A GLN 114.A NE2 GLU 118.A OE1 no hydrogen 2.733 N/A LYS 115.A N ASP 112.A OD1 no hydrogen 2.927 N/A TYR 117.A N LEU 113.A O no hydrogen 2.747 N/A TYR 117.A OH LYS 122.A O no hydrogen 3.396 N/A TYR 117.A OH GLN 228.A O no hydrogen 2.733 N/A GLU 118.A N GLN 114.A O no hydrogen 2.912 N/A ALA 119.A N LYS 115.A O no hydrogen 2.993 N/A ASN 120.A N ILE 116.A O no hydrogen 3.051 N/A ASN 120.A N TYR 117.A O no hydrogen 3.059 N/A ASN 120.A ND2 ARG 123.A O no hydrogen 2.642 N/A ALA 121.A N GLU 118.A O no hydrogen 3.141 N/A LYS 122.A N TYR 117.A O no hydrogen 2.852 N/A ARG 123.A NH1 LYS 122.A O no hydrogen 3.221 N/A PHE 124.A N TRP 229.A O no hydrogen 2.926 N/A SER 125.A OG THR 128.A OG1 no hydrogen 2.935 N/A ARG 126.A NE GLU 273.A OE2 no hydrogen 2.902 N/A ARG 126.A NH2 GLU 273.A OE1 no hydrogen 2.717 N/A ARG 126.A NH2 GLU 273.A OE2 no hydrogen 3.353 N/A LYS 127.A NZ GLN 131.A OE1 no hydrogen 2.806 N/A LYS 127.A NZ SER 308.A OG no hydrogen 3.074 N/A LYS 127.A NZ ASP 311.A OD1 no hydrogen 2.861 N/A LYS 127.A NZ ASP 311.A OD2 no hydrogen 3.453 N/A THR 128.A N SER 125.A OG no hydrogen 2.963 N/A THR 128.A OG1 SER 125.A OG no hydrogen 2.935 N/A THR 128.A OG1 LEU 314.A O no hydrogen 2.762 N/A THR 128.A OG1 ASP 315.A O no hydrogen 3.392 N/A VAL 129.A N SER 125.A O no hydrogen 2.912 N/A LEU 130.A N ARG 126.A O no hydrogen 2.919 N/A GLN 131.A N LYS 127.A O no hydrogen 3.033 N/A GLN 131.A NE2 ASP 310.A OD1 no hydrogen 2.968 N/A LEU 132.A N THR 128.A O no hydrogen 2.947 N/A SER 133.A N VAL 129.A O no hydrogen 2.972 N/A SER 133.A OG VAL 129.A O no hydrogen 2.778 N/A LEU 134.A N LEU 130.A O no hydrogen 2.947 N/A ARG 135.A N GLN 131.A O no hydrogen 3.476 N/A ARG 135.A NE ASP 138.A OD2 no hydrogen 2.844 N/A ARG 135.A NH1 ASP 310.A OD1 no hydrogen 3.074 N/A ARG 135.A NH1 ASP 310.A OD2 no hydrogen 3.409 N/A ARG 135.A NH2 ASP 138.A OD2 no hydrogen 3.342 N/A ARG 135.A NH2 ASP 310.A OD2 no hydrogen 3.167 N/A ILE 136.A N LEU 132.A O no hydrogen 2.981 N/A LEU 137.A N SER 133.A O no hydrogen 2.919 N/A ASP 138.A N LEU 134.A O no hydrogen 3.087 N/A ILE 139.A N ARG 135.A O no hydrogen 3.005 N/A LEU 140.A N ILE 136.A O no hydrogen 2.720 N/A GLU 141.A N LEU 137.A O no hydrogen 2.974 N/A TYR 142.A N ASP 138.A O no hydrogen 3.159 N/A TYR 142.A OH ALA 65.A O no hydrogen 2.591 N/A ILE 143.A N ILE 139.A O no hydrogen 2.978 N/A HIS 144.A N LEU 140.A O no hydrogen 2.840 N/A HIS 144.A ND1 TYR 292.A OH no hydrogen 2.651 N/A HIS 144.A NE2 ASP 218.A OD2 no hydrogen 2.901 N/A GLU 145.A N GLU 141.A O no hydrogen 2.909 N/A HIS 146.A N TYR 142.A O no hydrogen 3.064 N/A HIS 146.A N ILE 143.A O no hydrogen 3.047 N/A HIS 146.A ND1 TYR 142.A O no hydrogen 2.775 N/A GLU 147.A N HIS 144.A O no hydrogen 3.075 N/A TYR 148.A N ILE 143.A O no hydrogen 2.981 N/A VAL 149.A N TYR 177.A O no hydrogen 2.903 N/A HIS 150.A N ASP 218.A OD2 no hydrogen 2.994 N/A HIS 150.A NE2 VAL 171.A O no hydrogen 2.922 N/A GLY 151.A N ASP 218.A OD1 no hydrogen 2.898 N/A ASP 152.A N HIS 150.A ND1 no hydrogen 3.127 N/A LYS 154.A NZ THR 199.A OG1 no hydrogen 2.923 N/A ASN 157.A N LYS 154.A O no hydrogen 3.007 N/A ASN 157.A ND2 ASP 152.A O no hydrogen 2.949 N/A LEU 158.A N ALA 155.A O no hydrogen 2.994 N/A LEU 159.A N TYR 169.A O no hydrogen 2.929 N/A LEU 160.A N SER 111.A O no hydrogen 2.947 N/A ASN 161.A N GLN 167.A O no hydrogen 2.992 N/A ASN 161.A ND2 GLN 167.A OE1 no hydrogen 3.111 N/A TYR 162.A OH ASP 40.A O no hydrogen 2.717 N/A LYS 163.A N ASN 161.A OD1 no hydrogen 2.885 N/A ASN 164.A N ASN 161.A O no hydrogen 3.168 N/A ASP 166.A N ASN 164.A OD1 no hydrogen 2.996 N/A GLN 167.A N ASN 164.A O no hydrogen 3.114 N/A VAL 168.A N TYR 82.A OH no hydrogen 2.896 N/A TYR 169.A N LEU 159.A O no hydrogen 2.853 N/A LEU 170.A N GLY 84.A O no hydrogen 2.876 N/A VAL 171.A N ASN 157.A O no hydrogen 3.034 N/A TYR 173.A N GLU 58.A OE2 no hydrogen 2.948 N/A TYR 173.A OH LEU 170.A O no hydrogen 2.683 N/A GLY 174.A N ASP 172.A OD1 no hydrogen 3.340 N/A ALA 176.A N TYR 173.A O no hydrogen 3.210 N/A TYR 177.A N VAL 149.A O no hydrogen 2.961 N/A TYR 177.A OH ASP 191.A OD2 no hydrogen 2.580 N/A ARG 178.A NE GLU 147.A OE1 no hydrogen 3.300 N/A ARG 178.A NH2 GLU 147.A OE1 no hydrogen 3.334 N/A TYR 179.A OH HIS 144.A O no hydrogen 2.684 N/A GLY 183.A N CYS 180.A O no hydrogen 3.042 N/A VAL 184.A N PRO 181.A O no hydrogen 3.008 N/A HIS 185.A ND1 LYS 186.A O no hydrogen 2.907 N/A LYS 186.A N TYR 179.A O no hydrogen 3.016 N/A ARG 194.A N ASP 191.A O no hydrogen 3.068 N/A ARG 194.A NH1 LEU 175.A O no hydrogen 2.763 N/A THR 199.A OG1 ASP 152.A OD1 no hydrogen 2.484 N/A THR 199.A OG1 ASP 152.A OD2 no hydrogen 3.388 N/A GLU 201.A N GLU 201.A OE1 no hydrogen 2.766 N/A PHE 202.A N THR 199.A O no hydrogen 2.941 N/A THR 203.A N THR 199.A O no hydrogen 2.885 N/A THR 203.A OG1 ASP 197.A O no hydrogen 2.522 N/A ILE 205.A N GLU 220.A OE1 no hydrogen 3.302 N/A ILE 205.A N GLU 220.A OE2 no hydrogen 3.181 N/A ALA 207.A N SER 204.A OG no hydrogen 2.850 N/A HIS 208.A N SER 204.A O no hydrogen 3.006 N/A ASN 209.A N ILE 205.A O no hydrogen 2.903 N/A GLY 210.A N ALA 207.A O no hydrogen 2.958 N/A VAL 211.A N ASP 206.A O no hydrogen 3.198 N/A ALA 212.A N ALA 189.A O no hydrogen 3.022 N/A SER 214.A OG TYR 286.A O no hydrogen 2.796 N/A ARG 215.A NH2 THR 287.A O no hydrogen 2.999 N/A ARG 216.A NE ASP 206.A OD2 no hydrogen 2.787 N/A ARG 216.A NH1 LEU 284.A O no hydrogen 2.873 N/A ARG 216.A NH2 ASP 206.A OD1 no hydrogen 2.934 N/A ARG 216.A NH2 ASP 206.A OD2 no hydrogen 3.563 N/A ASP 218.A N SER 214.A O no hydrogen 3.435 N/A LEU 219.A N ARG 215.A O no hydrogen 3.285 N/A GLU 220.A N ARG 216.A O no hydrogen 2.942 N/A ILE 221.A N GLY 217.A O no hydrogen 2.935 N/A LEU 222.A N ASP 218.A O no hydrogen 3.095 N/A GLY 223.A N LEU 219.A O no hydrogen 2.983 N/A TYR 224.A N GLU 220.A O no hydrogen 3.088 N/A TYR 224.A OH GLU 220.A OE2 no hydrogen 2.563 N/A CYS 225.A N ILE 221.A O no hydrogen 3.057 N/A CYS 225.A SG ILE 153.A O no hydrogen 3.573 N/A CYS 225.A SG ILE 221.A O no hydrogen 3.530 N/A MET 226.A N LEU 222.A O no hydrogen 2.966 N/A ILE 227.A N GLY 223.A O no hydrogen 3.268 N/A GLN 228.A N TYR 224.A O no hydrogen 2.965 N/A GLN 228.A NE2 TYR 117.A OH no hydrogen 2.879 N/A TRP 229.A N CYS 225.A O no hydrogen 2.682 N/A LEU 230.A N MET 226.A O no hydrogen 2.970 N/A THR 231.A N ILE 227.A O no hydrogen 2.969 N/A THR 231.A OG1 ILE 227.A O no hydrogen 2.769 N/A GLY 232.A N GLN 228.A O no hydrogen 2.918 N/A HIS 233.A N THR 231.A OG1 no hydrogen 3.169 N/A HIS 233.A ND1 GLU 237.A OE1 no hydrogen 2.581 N/A LEU 234.A N GLU 237.A OE2 no hydrogen 3.058 N/A TRP 236.A NE1 GLU 201.A O no hydrogen 2.892 N/A GLU 237.A N LEU 234.A O no hydrogen 3.269 N/A ASN 239.A N TRP 236.A O no hydrogen 3.201 N/A ASP 242.A N ASN 239.A O no hydrogen 3.226 N/A LYS 244.A N ASP 242.A OD1 no hydrogen 3.075 N/A LYS 244.A NZ ASP 242.A OD1 no hydrogen 2.658 N/A LYS 244.A NZ ASP 242.A OD2 no hydrogen 3.438 N/A VAL 246.A N ASP 242.A O no hydrogen 3.190 N/A ARG 247.A N PRO 243.A O no hydrogen 2.995 N/A ARG 247.A NH1 ASN 209.A OD1 no hydrogen 2.858 N/A ASP 248.A N LYS 244.A O no hydrogen 2.992 N/A SER 249.A N TYR 245.A O no hydrogen 2.975 N/A SER 249.A OG TYR 245.A O no hydrogen 3.480 N/A LYS 250.A N VAL 246.A O no hydrogen 3.096 N/A LYS 250.A NZ ILE 200.A O no hydrogen 3.002 N/A LYS 250.A NZ THR 203.A O no hydrogen 2.864 N/A LYS 250.A NZ HIS 208.A NE2 no hydrogen 2.944 N/A ILE 251.A N ARG 247.A O no hydrogen 2.870 N/A ARG 252.A N ASP 248.A O no hydrogen 3.051 N/A ARG 252.A NE ASP 248.A OD2 no hydrogen 3.041 N/A TYR 253.A N SER 249.A O no hydrogen 2.769 N/A ARG 254.A N LYS 250.A O no hydrogen 2.897 N/A GLU 255.A N ILE 251.A O no hydrogen 3.141 N/A ASN 256.A N ARG 252.A O no hydrogen 3.138 N/A SER 259.A N ASN 256.A OD1 no hydrogen 3.291 N/A SER 259.A OG ASN 256.A O no hydrogen 3.179 N/A LEU 260.A N ASN 256.A O no hydrogen 3.374 N/A MET 261.A N ILE 257.A O no hydrogen 2.894 N/A ASP 262.A N.A ALA 258.A O no hydrogen 2.840 N/A ASP 262.A N.B ALA 258.A O no hydrogen 2.821 N/A LYS 263.A N SER 259.A O no hydrogen 2.906 N/A CYS 264.A N LEU 260.A O no hydrogen 2.824 N/A CYS 264.A SG LEU 260.A O no hydrogen 3.339 N/A PHE 265.A N MET 261.A O no hydrogen 2.881 N/A ASN 269.A N PRO 266.A O no hydrogen 3.202 N/A GLU 273.A N GLU 273.A OE1 no hydrogen 2.810 N/A ILE 274.A N PRO 271.A O no hydrogen 3.165 N/A LYS 276.A N GLY 272.A O no hydrogen 2.859 N/A TYR 277.A N GLU 273.A O no hydrogen 2.860 N/A TYR 277.A OH LEU 219.A O no hydrogen 2.644 N/A MET 278.A N ILE 274.A O no hydrogen 3.030 N/A GLU 279.A N ALA 275.A O no hydrogen 2.885 N/A THR 280.A N LYS 276.A O no hydrogen 2.950 N/A THR 280.A OG1 LYS 276.A O no hydrogen 2.730 N/A VAL 281.A N TYR 277.A O no hydrogen 3.011 N/A LYS 282.A N MET 278.A O no hydrogen 2.990 N/A LYS 282.A NZ ARG 254.A O no hydrogen 2.825 N/A LYS 282.A NZ GLU 255.A O no hydrogen 3.326 N/A LEU 283.A N THR 280.A O no hydrogen 3.300 N/A LEU 284.A N VAL 281.A O no hydrogen 2.998 N/A ASP 285.A N GLU 288.A OE1 no hydrogen 2.991 N/A TYR 286.A OH ALA 212.A O no hydrogen 2.524 N/A GLU 288.A N ASP 285.A O no hydrogen 3.072 N/A TYR 292.A OH HIS 144.A ND1 no hydrogen 2.651 N/A LEU 295.A N LEU 291.A O no hydrogen 3.179 N/A ARG 296.A N TYR 292.A O no hydrogen 2.918 N/A ARG 296.A NE GLU 293.A OE1 no hydrogen 2.964 N/A ARG 296.A NH1 GLU 141.A OE1 no hydrogen 2.894 N/A ARG 296.A NH2 GLU 141.A OE1 no hydrogen 2.930 N/A ARG 296.A NH2 GLU 293.A OE1 no hydrogen 2.725 N/A ASP 297.A N.A GLU 293.A O no hydrogen 2.870 N/A ASP 297.A N.B GLU 293.A O no hydrogen 2.845 N/A ILE 298.A N ASN 294.A O no hydrogen 3.007 N/A LEU 299.A N LEU 295.A O no hydrogen 3.200 N/A LEU 300.A N ARG 296.A O no hydrogen 2.745 N/A GLN 301.A N ASP 297.A O.A no hydrogen 3.126 N/A GLN 301.A N ASP 297.A O.B no hydrogen 3.122 N/A GLN 301.A NE2 ASP 297.A O.A no hydrogen 2.846 N/A GLN 301.A NE2 ASP 297.A O.B no hydrogen 2.873 N/A LEU 303.A N LEU 299.A O no hydrogen 3.313 N/A LYS 304.A N LEU 300.A O no hydrogen 2.931 N/A ALA 305.A N GLN 301.A O no hydrogen 2.808 N/A ILE 306.A N GLY 302.A O no hydrogen 3.137 N/A ILE 306.A N LEU 303.A O no hydrogen 3.212 N/A GLY 307.A N LYS 304.A O no hydrogen 3.314 N/A SER 308.A N LEU 303.A O no hydrogen 2.845 N/A LYS 313.A N ASP 311.A OD1 no hydrogen 2.985 N/A LEU 314.A N ASP 166.A OD1 no hydrogen 3.093 N/A