Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ps6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A NE2 LYS 2.A O no hydrogen 3.003 N/A ARG 5.A NE GLU 32.A OE2 no hydrogen 2.658 N/A ARG 5.A NH2 SER 62.A O no hydrogen 2.844 N/A VAL 6.A N GLU 32.A O no hydrogen 3.086 N/A VAL 7.A N ALA 114.A O no hydrogen 2.974 N/A ILE 8.A N VAL 34.A O no hydrogen 2.662 N/A THR 9.A N ILE 116.A O no hydrogen 2.978 N/A GLU 12.A N PRO 119.A O no hydrogen 2.958 N/A ALA 14.A N GLU 12.A OE1 no hydrogen 2.935 N/A GLY 15.A N GLU 12.A O no hydrogen 2.947 N/A ILE 16.A N THR 298.A O no hydrogen 2.855 N/A LEU 20.A N ILE 16.A O no hydrogen 2.879 N/A VAL 21.A N GLY 17.A O no hydrogen 2.967 N/A VAL 22.A N PRO 18.A O no hydrogen 2.972 N/A GLN 23.A N ASP 19.A O no hydrogen 3.100 N/A GLN 23.A NE2 ASP 19.A O no hydrogen 3.225 N/A LEU 24.A N LEU 20.A O no hydrogen 2.807 N/A ALA 25.A N VAL 21.A O no hydrogen 3.132 N/A GLN 26.A N GLN 23.A O no hydrogen 2.958 N/A ARG 27.A N LEU 24.A O no hydrogen 3.329 N/A TRP 29.A N GLN 67.A O no hydrogen 3.018 N/A TRP 29.A NE1 LEU 24.A O no hydrogen 3.108 N/A GLU 32.A N GLN 4.A O no hydrogen 2.969 N/A LEU 33.A N GLN 67.A OE1 no hydrogen 2.948 N/A VAL 34.A N VAL 6.A O no hydrogen 2.790 N/A VAL 35.A N THR 73.A O no hydrogen 2.647 N/A CYS 36.A N ILE 8.A O no hydrogen 2.872 N/A CYS 36.A SG LEU 75.A O no hydrogen 3.931 N/A CYS 36.A SG THR 99.A O no hydrogen 3.608 N/A ASP 38.A N TYR 95.A OH no hydrogen 2.821 N/A LEU 41.A N ASP 38.A OD2 no hydrogen 3.105 N/A LEU 42.A N ASP 38.A O no hydrogen 3.352 N/A THR 43.A N ALA 39.A O no hydrogen 2.932 N/A THR 43.A OG1 ALA 39.A O no hydrogen 3.154 N/A ASN 44.A N THR 40.A O no hydrogen 2.933 N/A ARG 45.A N LEU 41.A O no hydrogen 3.029 N/A ARG 45.A NH1 GLY 15.A O no hydrogen 3.060 N/A ARG 45.A NH1 ASP 19.A OD1 no hydrogen 2.445 N/A ARG 45.A NH2 PRO 13.A O no hydrogen 2.749 N/A ALA 46.A N LEU 42.A O no hydrogen 2.883 N/A ALA 47.A N THR 43.A O no hydrogen 3.161 N/A MET 48.A N ASN 44.A O no hydrogen 3.009 N/A LEU 49.A N ARG 45.A O no hydrogen 3.068 N/A LEU 49.A N ALA 46.A O no hydrogen 2.886 N/A GLY 50.A N ALA 47.A O no hydrogen 2.757 N/A LEU 51.A N ALA 46.A O no hydrogen 3.019 N/A THR 54.A N GLY 70.A O no hydrogen 3.057 N/A ARG 56.A N LEU 72.A O no hydrogen 3.084 N/A ARG 56.A NH1 GLN 65.A O no hydrogen 3.565 N/A ARG 56.A NH2 GLU 32.A OE1 no hydrogen 2.593 N/A TYR 58.A N LEU 74.A O no hydrogen 2.963 N/A TYR 58.A OH GLU 111.A OE1 no hydrogen 2.393 N/A SER 59.A OG PRO 57.A O no hydrogen 3.319 N/A SER 62.A N SER 59.A O no hydrogen 3.240 N/A GLN 65.A N GLU 32.A OE1 no hydrogen 2.844 N/A GLN 67.A N VAL 31.A O no hydrogen 2.967 N/A GLN 67.A NE2 THR 71.A OG1 no hydrogen 2.929 N/A THR 68.A OG1 THR 71.A OG1 no hydrogen 3.245 N/A ALA 69.A N GLU 28.A OE2 no hydrogen 2.716 N/A GLY 70.A N ALA 25.A O no hydrogen 2.649 N/A THR 71.A N THR 68.A O no hydrogen 3.168 N/A THR 71.A OG1 THR 68.A O no hydrogen 2.525 N/A THR 71.A OG1 THR 68.A OG1 no hydrogen 3.245 N/A THR 73.A N LEU 33.A O no hydrogen 2.899 N/A THR 73.A OG1 GLN 67.A OE1 no hydrogen 2.718 N/A LEU 74.A N ARG 56.A O no hydrogen 2.760 N/A LEU 75.A N VAL 35.A O no hydrogen 2.874 N/A VAL 77.A N ALA 37.A O no hydrogen 3.185 N/A LEU 79.A N ASP 38.A OD1 no hydrogen 3.224 N/A ARG 80.A N ASN 92.A OD1 no hydrogen 2.864 N/A ARG 80.A NH2 GLU 98.A OE2 no hydrogen 2.835 N/A ALA 81.A N ASN 92.A OD1 no hydrogen 2.999 N/A GLY 86.A N ALA 14.A O no hydrogen 2.755 N/A GLN 87.A N THR 84.A O no hydrogen 2.848 N/A ASN 92.A N ALA 89.A O no hydrogen 2.837 N/A ASN 92.A ND2 ALA 81.A O no hydrogen 3.049 N/A GLY 93.A N VAL 90.A O no hydrogen 2.846 N/A HIS 94.A N GLU 91.A O no hydrogen 3.235 N/A VAL 96.A N ASN 92.A O no hydrogen 3.145 N/A VAL 97.A N GLY 93.A O no hydrogen 3.172 N/A GLU 98.A N HIS 94.A O no hydrogen 2.936 N/A THR 99.A N TYR 95.A O no hydrogen 3.051 N/A THR 99.A OG1 VAL 96.A O no hydrogen 2.527 N/A LEU 100.A N VAL 96.A O no hydrogen 3.083 N/A ALA 101.A N VAL 97.A O no hydrogen 2.883 N/A ARG 102.A N GLU 98.A O no hydrogen 2.945 N/A ARG 102.A NH1 ARG 102.A O no hydrogen 3.072 N/A ARG 102.A NH1 GLU 111.A OE2 no hydrogen 3.097 N/A ARG 102.A NH2 GLU 111.A OE1 no hydrogen 3.136 N/A ARG 102.A NH2 GLU 111.A OE2 no hydrogen 3.233 N/A ALA 103.A N THR 99.A O no hydrogen 2.904 N/A CYS 104.A N LEU 100.A O no hydrogen 2.822 N/A CYS 104.A SG SER 143.A OG no hydrogen 3.662 N/A ASP 105.A N ALA 101.A O no hydrogen 2.790 N/A GLY 106.A N ARG 102.A O no hydrogen 2.907 N/A CYS 107.A N ALA 103.A O no hydrogen 3.161 N/A CYS 107.A N CYS 104.A O no hydrogen 3.130 N/A CYS 107.A SG ALA 103.A O no hydrogen 3.507 N/A LEU 108.A N CYS 104.A O no hydrogen 3.035 N/A ASN 109.A N ASP 105.A O no hydrogen 2.856 N/A GLY 110.A N CYS 107.A O no hydrogen 3.391 N/A GLU 111.A N GLY 106.A O no hydrogen 2.841 N/A PHE 112.A N GLY 106.A O no hydrogen 3.147 N/A ALA 113.A N ARG 5.A O no hydrogen 2.795 N/A LEU 115.A N ILE 290.A O no hydrogen 2.892 N/A ILE 116.A N VAL 7.A O no hydrogen 2.943 N/A THR 117.A N THR 292.A O no hydrogen 3.295 N/A THR 117.A OG1 THR 292.A O no hydrogen 3.491 N/A GLY 118.A N THR 9.A O no hydrogen 2.538 N/A LYS 122.A NZ THR 133.A O no hydrogen 3.219 N/A VAL 124.A N HIS 121.A ND1 no hydrogen 2.965 N/A ASN 126.A N LYS 122.A O no hydrogen 3.179 N/A ASN 126.A ND2 LYS 122.A O no hydrogen 2.855 N/A ASN 126.A ND2 PHE 132.A O no hydrogen 3.206 N/A ASP 127.A N GLY 123.A O no hydrogen 2.934 N/A ALA 128.A N VAL 124.A O no hydrogen 3.080 N/A ALA 128.A N ILE 125.A O no hydrogen 3.073 N/A GLY 129.A N ASN 126.A O no hydrogen 2.648 N/A ILE 130.A N ILE 125.A O no hydrogen 3.331 N/A PHE 132.A N ASN 126.A OD1 no hydrogen 3.220 N/A PHE 138.A N GLY 134.A O no hydrogen 3.056 N/A PHE 139.A N HIS 135.A O no hydrogen 2.799 N/A GLU 140.A N THR 136.A O no hydrogen 3.056 N/A GLU 141.A N GLU 137.A O no hydrogen 3.001 N/A ARG 142.A N PHE 138.A O no hydrogen 2.989 N/A ARG 142.A NE ASP 105.A OD1 no hydrogen 2.955 N/A ARG 142.A NH2 ASP 105.A OD2 no hydrogen 2.906 N/A SER 143.A N PHE 139.A O no hydrogen 2.716 N/A SER 143.A OG PHE 139.A O no hydrogen 3.014 N/A GLN 144.A N GLU 141.A O no hydrogen 3.051 N/A ALA 145.A N GLU 140.A O no hydrogen 3.031 N/A VAL 148.A N GLU 140.A OE1 no hydrogen 2.950 N/A VAL 149.A N LEU 285.A O no hydrogen 2.766 N/A MET 151.A N ILE 283.A O no hydrogen 2.878 N/A LEU 152.A N VAL 159.A O no hydrogen 2.715 N/A ALA 153.A N VAL 281.A O no hydrogen 2.900 N/A THR 154.A N LEU 157.A O no hydrogen 3.065 N/A ARG 158.A NH1 ASP 258.A O no hydrogen 2.682 N/A VAL 159.A N LEU 152.A O no hydrogen 2.689 N/A ALA 160.A N VAL 260.A O no hydrogen 2.726 N/A LEU 161.A N MET 150.A O no hydrogen 3.075 N/A ALA 162.A N ALA 262.A O no hydrogen 2.822 N/A THR 163.A OG1 MET 263.A O no hydrogen 2.668 N/A LEU 166.A N THR 164.A O no hydrogen 2.886 N/A ASP 170.A N PRO 167.A O no hydrogen 2.876 N/A ILE 171.A N LEU 168.A O no hydrogen 3.249 N/A ALA 174.A N ILE 171.A O no hydrogen 2.834 N/A ILE 175.A N ILE 171.A O no hydrogen 3.222 N/A ILE 175.A N ALA 172.A O no hydrogen 3.229 N/A LEU 179.A N THR 176.A OG1 no hydrogen 3.133 N/A LEU 180.A N THR 176.A O no hydrogen 2.977 N/A HIS 181.A N PRO 177.A O no hydrogen 2.945 N/A HIS 181.A NE2 GLU 231.A OE1 no hydrogen 3.225 N/A GLU 182.A N ALA 178.A O no hydrogen 3.165 N/A VAL 183.A N LEU 179.A O no hydrogen 3.041 N/A ILE 184.A N LEU 180.A O no hydrogen 2.961 N/A ALA 185.A N HIS 181.A O no hydrogen 2.853 N/A ILE 186.A N GLU 182.A O no hydrogen 2.819 N/A LEU 187.A N VAL 183.A O no hydrogen 2.776 N/A HIS 188.A N ILE 184.A O no hydrogen 2.753 N/A HIS 189.A N ALA 185.A O no hydrogen 2.807 N/A ASP 190.A N ILE 186.A O no hydrogen 2.915 N/A LEU 191.A N LEU 187.A O no hydrogen 3.116 N/A ARG 192.A N HIS 189.A O no hydrogen 3.027 N/A THR 193.A N HIS 189.A O no hydrogen 2.895 N/A THR 193.A OG1 HIS 189.A O no hydrogen 3.237 N/A LYS 194.A N ASP 190.A O no hydrogen 2.767 N/A LYS 194.A NZ ASP 190.A OD1 no hydrogen 3.231 N/A LYS 194.A NZ ASP 190.A OD2 no hydrogen 2.994 N/A LYS 194.A NZ LEU 287.A O no hydrogen 3.403 N/A PHE 195.A N ASP 190.A O no hydrogen 3.109 N/A ILE 197.A N LEU 191.A O no hydrogen 3.041 N/A ARG 201.A N ASP 258.A OD1 no hydrogen 2.801 N/A ARG 201.A NE ASP 258.A OD1 no hydrogen 2.908 N/A ARG 201.A NH2 ASP 258.A OD2 no hydrogen 2.753 N/A ILE 202.A N LYS 238.A O no hydrogen 3.059 N/A LEU 203.A N ALA 259.A O no hydrogen 2.790 N/A VAL 204.A N ASN 240.A O no hydrogen 2.894 N/A CYS 205.A N LEU 261.A O no hydrogen 2.871 N/A GLY 206.A N LEU 243.A O no hydrogen 2.932 N/A LEU 207.A N GLU 221.A OE1 no hydrogen 2.551 N/A ASN 208.A N GLU 221.A OE1 no hydrogen 2.816 N/A ASN 208.A ND2 GLU 220.A OE1 no hydrogen 2.913 N/A ASN 208.A ND2 GLU 221.A OE2 no hydrogen 2.893 N/A ALA 211.A N ASN 208.A O no hydrogen 2.997 N/A GLY 212.A N PRO 209.A O no hydrogen 3.126 N/A GLU 213.A N HIS 210.A O no hydrogen 2.809 N/A HIS 216.A N GLU 213.A O no hydrogen 3.271 N/A MET 217.A N GLY 212.A O no hydrogen 3.465 N/A THR 219.A OG1 ASP 223.A OD2 no hydrogen 2.846 N/A GLU 220.A N GLU 220.A OE1 no hydrogen 2.646 N/A GLU 221.A N GLU 221.A OE2 no hydrogen 2.815 N/A ASP 223.A N THR 219.A O no hydrogen 2.759 N/A THR 224.A N GLU 220.A O no hydrogen 2.923 N/A ILE 225.A N GLU 220.A O no hydrogen 3.093 N/A ILE 226.A N GLU 221.A O no hydrogen 2.845 N/A VAL 228.A N THR 224.A O no hydrogen 3.150 N/A LEU 229.A N ILE 225.A O no hydrogen 2.990 N/A ASN 230.A N ILE 226.A O no hydrogen 3.105 N/A GLU 231.A N PRO 227.A O no hydrogen 3.003 N/A LEU 232.A N VAL 228.A O no hydrogen 2.911 N/A ARG 233.A N LEU 229.A O no hydrogen 2.729 N/A ARG 233.A NE LEU 239.A O no hydrogen 2.873 N/A ARG 233.A NH2 LEU 239.A O no hydrogen 2.927 N/A ARG 233.A NH2 GLY 241.A O no hydrogen 2.993 N/A ALA 234.A N ASN 230.A O no hydrogen 3.105 N/A GLN 235.A N LEU 232.A O no hydrogen 2.764 N/A GLY 236.A N ARG 233.A O no hydrogen 2.798 N/A MET 237.A N LEU 232.A O no hydrogen 3.210 N/A ASN 240.A N ILE 202.A O no hydrogen 2.924 N/A LEU 243.A N VAL 204.A O no hydrogen 2.994 N/A THR 247.A N PRO 244.A O no hydrogen 3.129 N/A LEU 248.A N PRO 244.A O no hydrogen 2.860 N/A GLN 250.A N LEU 248.A O no hydrogen 2.788 N/A LYS 252.A NZ GLN 250.A OE1 no hydrogen 2.748 N/A TYR 253.A N GLN 250.A O no hydrogen 2.998 N/A LEU 254.A N GLN 250.A O no hydrogen 2.663 N/A ASP 255.A N PRO 251.A O no hydrogen 2.976 N/A ASN 256.A N TYR 253.A O no hydrogen 3.360 N/A ASN 256.A ND2 LYS 252.A O no hydrogen 3.408 N/A ALA 257.A N LEU 254.A O no hydrogen 2.936 N/A ASP 258.A N ARG 201.A O no hydrogen 2.764 N/A VAL 260.A N ARG 158.A O no hydrogen 2.869 N/A LEU 261.A N LEU 203.A O no hydrogen 2.683 N/A ALA 262.A N ALA 160.A O no hydrogen 2.824 N/A HIS 265.A ND1 ASP 266.A OD1 no hydrogen 2.974 N/A GLN 267.A N TYR 264.A O no hydrogen 2.897 N/A GLY 268.A N HIS 265.A O no hydrogen 3.326 N/A LEU 269.A N HIS 265.A O no hydrogen 3.195 N/A LYS 273.A N LEU 269.A O no hydrogen 2.830 N/A TYR 274.A N PRO 270.A O no hydrogen 2.869 N/A GLN 275.A N LEU 272.A O no hydrogen 2.906 N/A GLY 276.A N LYS 273.A O no hydrogen 3.228 N/A VAL 281.A N ALA 153.A O no hydrogen 2.766 N/A ASN 282.A N SER 293.A O no hydrogen 3.079 N/A ILE 283.A N MET 151.A O no hydrogen 2.792 N/A THR 284.A N ARG 291.A O no hydrogen 2.985 N/A LEU 285.A N VAL 149.A O no hydrogen 2.768 N/A GLY 286.A N ASP 190.A OD2 no hydrogen 2.921 N/A ARG 291.A NH1 THR 284.A OG1 no hydrogen 2.773 N/A ARG 291.A NH2 THR 117.A OG1 no hydrogen 2.792 N/A THR 292.A N LEU 115.A O no hydrogen 3.067 N/A THR 292.A OG1 ALA 316.A O no hydrogen 2.939 N/A SER 293.A OG THR 117.A OG1 no hydrogen 3.012 N/A SER 293.A OG VAL 294.A O no hydrogen 2.837 N/A VAL 294.A N THR 117.A O no hydrogen 3.425 N/A ASP 295.A N SER 312.A OG no hydrogen 3.042 N/A LEU 302.A N ALA 299.A O no hydrogen 2.776 N/A ALA 303.A N LEU 300.A O no hydrogen 3.094 N/A GLY 304.A N ASP 19.A OD2 no hydrogen 2.621 N/A ARG 305.A N LEU 302.A O no hydrogen 2.912 N/A SER 312.A OG GLY 280.A O no hydrogen 2.927 N/A SER 312.A OG ASP 295.A OD1 no hydrogen 3.061 N/A ILE 314.A N VAL 310.A O no hydrogen 2.844 N/A THR 315.A N GLY 311.A O no hydrogen 3.071 N/A THR 315.A OG1 GLY 311.A O no hydrogen 2.702 N/A ALA 316.A N SER 312.A O no hydrogen 2.936 N/A LEU 317.A N PHE 313.A O no hydrogen 3.050 N/A ASN 318.A N ILE 314.A O no hydrogen 2.910 N/A LEU 319.A N THR 315.A O no hydrogen 2.970 N/A ALA 320.A N ALA 316.A O no hydrogen 3.103 N/A ILE 321.A N LEU 317.A O no hydrogen 3.011 N/A LYS 322.A N ASN 318.A O no hydrogen 2.878 N/A MET 323.A N LEU 319.A O no hydrogen 2.797 N/A ILE 324.A N ALA 320.A O no hydrogen 3.019 N/A ILE 324.A N ILE 321.A O no hydrogen 3.049 N/A ASN 326.A ND2 LYS 194.A O no hydrogen 2.694 N/A THR 327.A N ILE 324.A O no hydrogen 3.071 N/A THR 327.A OG1 ILE 324.A O no hydrogen 3.023 N/A GLN 328.A N ILE 324.A O no hydrogen 2.805 N/A