Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2hcr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N ASP 50.A O no hydrogen 2.997 N/A LYS 3.A NZ GLU 44.A OE1 no hydrogen 3.160 N/A PHE 5.A N TYR 52.A O no hydrogen 2.820 N/A SER 6.A OG HIS 10.A O no hydrogen 3.085 N/A SER 6.A OG SER 14.A OG no hydrogen 2.934 N/A GLY 7.A N VAL 54.A O no hydrogen 3.012 N/A SER 8.A OG SER 56.A OG no hydrogen 2.357 N/A SER 8.A OG GLU 67.A OE1 no hydrogen 3.472 N/A LEU 13.A N HIS 10.A NE2 no hydrogen 3.466 N/A SER 14.A OG SER 6.A OG no hydrogen 2.934 N/A GLN 15.A N GLN 11.A O no hydrogen 2.594 N/A GLN 15.A NE2 GLN 15.A O no hydrogen 3.499 N/A GLN 15.A NE2 ASP 19.A OD1 no hydrogen 2.987 N/A LYS 16.A N ASP 12.A O no hydrogen 3.053 N/A LYS 16.A NZ ASP 12.A OD1 no hydrogen 2.799 N/A ILE 17.A N LEU 13.A O no hydrogen 2.942 N/A ALA 18.A N SER 14.A O no hydrogen 3.007 N/A ASP 19.A N GLN 15.A O no hydrogen 2.734 N/A ARG 20.A N LYS 16.A O no hydrogen 3.054 N/A ARG 20.A NE SER 285.A OG no hydrogen 2.948 N/A ARG 20.A NH2 SER 285.A OG no hydrogen 3.281 N/A LEU 21.A N ILE 17.A O no hydrogen 3.276 N/A LEU 21.A N ALA 18.A O no hydrogen 3.368 N/A GLY 22.A N ASP 19.A O no hydrogen 3.103 N/A LEU 23.A N ALA 18.A O no hydrogen 2.843 N/A GLY 26.A N ILE 4.A O no hydrogen 2.684 N/A LYS 27.A N GLU 44.A OE2 no hydrogen 2.978 N/A VAL 29.A N GLU 41.A O no hydrogen 2.811 N/A LYS 31.A N CYS 39.A O no hydrogen 2.882 N/A LYS 32.A NZ GLN 36.A OE1 no hydrogen 3.111 N/A LYS 32.A NZ ASP 63.A OD2 no hydrogen 3.339 N/A PHE 33.A N GLU 37.A O no hydrogen 2.731 N/A ASN 35.A ND2 GLU 37.A OE2 no hydrogen 3.261 N/A GLN 36.A N PHE 33.A O no hydrogen 3.054 N/A GLU 37.A N ASN 35.A OD1 no hydrogen 3.409 N/A CYS 39.A N LYS 31.A O no hydrogen 2.822 N/A GLU 41.A N VAL 29.A O no hydrogen 2.902 N/A GLY 43.A N LYS 27.A O no hydrogen 2.703 N/A ARG 47.A N SER 45.A OG no hydrogen 3.369 N/A GLY 48.A N SER 79.A O no hydrogen 2.909 N/A GLU 49.A N VAL 46.A O no hydrogen 3.032 N/A ASP 50.A N ASN 1.A O no hydrogen 2.507 N/A VAL 51.A N ARG 82.A O no hydrogen 2.874 N/A TYR 52.A N LYS 3.A O no hydrogen 2.728 N/A TYR 52.A OH ASP 50.A OD2 no hydrogen 2.662 N/A ILE 53.A N THR 84.A O no hydrogen 2.963 N/A VAL 54.A N PHE 5.A O no hydrogen 2.870 N/A GLN 55.A N VAL 86.A O no hydrogen 2.908 N/A GLN 55.A NE2 GLN 55.A O no hydrogen 2.709 N/A GLN 55.A NE2 SER 56.A O no hydrogen 2.852 N/A SER 56.A OG GLY 7.A O no hydrogen 2.759 N/A SER 56.A OG SER 8.A OG no hydrogen 2.357 N/A CYS 58.A SG SER 8.A OG no hydrogen 3.399 N/A GLU 60.A N CYS 58.A O no hydrogen 2.654 N/A ASP 63.A N GLU 60.A OE1 no hydrogen 3.036 N/A ASN 64.A N GLU 60.A O no hydrogen 2.937 N/A LEU 65.A N ILE 61.A O no hydrogen 2.858 N/A MET 66.A N ASN 62.A O no hydrogen 2.923 N/A GLU 67.A N ASP 63.A O no hydrogen 2.876 N/A LEU 68.A N ASN 64.A O no hydrogen 2.955 N/A LEU 69.A N LEU 65.A O no hydrogen 3.010 N/A ILE 70.A N MET 66.A O no hydrogen 2.939 N/A MET 71.A N GLU 67.A O no hydrogen 2.997 N/A ILE 72.A N LEU 68.A O no hydrogen 3.006 N/A ASN 73.A N LEU 69.A O no hydrogen 2.967 N/A ALA 74.A N ILE 70.A O no hydrogen 2.874 N/A CYS 75.A N MET 71.A O no hydrogen 2.972 N/A CYS 75.A SG MET 71.A O no hydrogen 3.437 N/A LYS 76.A N ILE 72.A O no hydrogen 2.911 N/A LYS 76.A NZ GLY 118.A O no hydrogen 2.624 N/A LYS 76.A NZ ASP 120.A OD1 no hydrogen 3.264 N/A LYS 76.A NZ ASP 120.A OD2 no hydrogen 2.799 N/A ILE 77.A N ASN 73.A O no hydrogen 2.976 N/A ALA 78.A N ALA 74.A O no hydrogen 3.089 N/A ALA 78.A N CYS 75.A O no hydrogen 3.260 N/A SER 79.A N LYS 76.A O no hydrogen 3.263 N/A ALA 80.A N CYS 75.A O no hydrogen 3.155 N/A SER 81.A N GLU 49.A O no hydrogen 2.901 N/A ARG 82.A N GLU 49.A O no hydrogen 3.354 N/A ARG 82.A NE ASP 50.A OD1 no hydrogen 2.690 N/A ARG 82.A NH2 ASP 50.A OD1 no hydrogen 3.137 N/A ARG 82.A NH2 ASP 50.A OD2 no hydrogen 2.764 N/A ARG 82.A NH2 THR 295.A O no hydrogen 3.353 N/A VAL 83.A N ASP 120.A OD1 no hydrogen 2.806 N/A THR 84.A N VAL 51.A O no hydrogen 2.856 N/A ALA 85.A N HIS 121.A O no hydrogen 3.000 N/A VAL 86.A N ILE 53.A O no hydrogen 2.858 N/A ILE 87.A N ILE 123.A O no hydrogen 2.741 N/A TYR 92.A OH ASN 62.A OD1 no hydrogen 2.522 N/A ARG 94.A NH1 ASP 216.A OD2 no hydrogen 3.542 N/A ARG 94.A NH2 ASP 216.A OD2 no hydrogen 2.826 N/A GLN 95.A N TYR 92.A O no hydrogen 2.960 N/A SER 101.A N LYS 98.A O no hydrogen 3.160 N/A ALA 107.A N GLN 95.A O no hydrogen 2.990 N/A LYS 108.A N ILE 105.A O no hydrogen 3.022 N/A LEU 109.A N ILE 105.A O no hydrogen 3.180 N/A VAL 110.A N SER 106.A O no hydrogen 2.934 N/A ALA 111.A N ALA 107.A O no hydrogen 3.036 N/A ASN 112.A N LYS 108.A O no hydrogen 2.781 N/A MET 113.A N LEU 109.A O no hydrogen 2.751 N/A LEU 114.A N VAL 110.A O no hydrogen 2.911 N/A SER 115.A N ALA 111.A O no hydrogen 3.024 N/A SER 115.A OG ALA 111.A O no hydrogen 2.775 N/A VAL 116.A N ASN 112.A O no hydrogen 2.949 N/A ALA 117.A N MET 113.A O no hydrogen 2.835 N/A GLY 118.A N LEU 114.A O no hydrogen 3.207 N/A GLY 118.A N SER 115.A O no hydrogen 3.041 N/A ALA 119.A N LEU 114.A O no hydrogen 3.094 N/A ASP 120.A N VAL 83.A O no hydrogen 2.730 N/A ILE 122.A N PRO 139.A O no hydrogen 3.054 N/A ILE 123.A N ALA 85.A O no hydrogen 2.915 N/A THR 124.A N ASP 141.A O no hydrogen 3.068 N/A THR 124.A OG1 ILE 87.A O no hydrogen 2.559 N/A MET 125.A N PRO 88.A O no hydrogen 3.205 N/A ASP 126.A N LEU 143.A O no hydrogen 2.736 N/A LEU 127.A N ASN 142.A OD1 no hydrogen 3.008 N/A HIS 128.A ND1 ASP 213.A OD1 no hydrogen 2.755 N/A GLN 131.A N GLN 131.A OE1 no hydrogen 2.814 N/A ILE 132.A N ALA 129.A O no hydrogen 3.037 N/A GLN 133.A N SER 130.A O no hydrogen 3.297 N/A GLY 134.A N GLN 131.A O no hydrogen 2.905 N/A PHE 135.A N ILE 132.A O no hydrogen 2.881 N/A PHE 136.A N GLN 133.A O no hydrogen 3.396 N/A ASP 141.A N ILE 122.A O no hydrogen 2.898 N/A LEU 143.A N THR 124.A O no hydrogen 2.887 N/A ALA 145.A N ASP 126.A OD1 no hydrogen 2.868 N/A VAL 149.A N ALA 145.A O no hydrogen 2.868 N/A LEU 150.A N GLU 146.A O no hydrogen 2.800 N/A LYS 151.A N PRO 147.A O no hydrogen 3.017 N/A LYS 151.A NZ GLU 155.A OE2 no hydrogen 3.260 N/A TRP 152.A N ALA 148.A O no hydrogen 3.025 N/A ILE 153.A N VAL 149.A O no hydrogen 2.938 N/A ARG 154.A N LEU 150.A O no hydrogen 3.169 N/A GLU 155.A N LYS 151.A O no hydrogen 2.991 N/A ASN 156.A N TRP 152.A O no hydrogen 2.896 N/A ASN 156.A N ILE 153.A O no hydrogen 3.384 N/A ILE 157.A N ILE 153.A O no hydrogen 3.000 N/A SER 158.A OG GLU 159.A OE1 no hydrogen 2.969 N/A GLU 159.A N GLU 159.A OE1 no hydrogen 2.711 N/A TRP 160.A N ILE 157.A O no hydrogen 3.351 N/A ASN 162.A N GLU 159.A O no hydrogen 3.250 N/A CYS 163.A SG TRP 160.A O no hydrogen 3.237 N/A THR 164.A N VAL 207.A O no hydrogen 2.935 N/A THR 164.A OG1 ASP 202.A O no hydrogen 3.033 N/A ILE 165.A N ASP 186.A O no hydrogen 2.930 N/A VAL 166.A N ILE 209.A O no hydrogen 2.722 N/A SER 167.A N ALA 188.A O no hydrogen 2.973 N/A SER 167.A OG ASP 169.A O no hydrogen 2.706 N/A GLY 172.A N ASP 169.A OD2 no hydrogen 3.081 N/A ALA 173.A N ALA 170.A O no hydrogen 3.430 N/A VAL 176.A N GLY 172.A O no hydrogen 3.330 N/A THR 177.A N ALA 173.A O no hydrogen 3.116 N/A THR 177.A OG1 ALA 173.A O no hydrogen 3.372 N/A THR 177.A OG1 LYS 174.A O no hydrogen 3.271 N/A SER 178.A N LYS 174.A O no hydrogen 3.186 N/A SER 178.A OG GLU 146.A OE2 no hydrogen 3.095 N/A ALA 180.A N VAL 176.A O no hydrogen 2.771 N/A ASP 181.A N THR 177.A O no hydrogen 2.881 N/A ARG 182.A N SER 178.A O no hydrogen 3.156 N/A LEU 183.A N ILE 179.A O no hydrogen 3.087 N/A ASN 184.A N ASP 181.A O no hydrogen 3.329 N/A VAL 185.A N ALA 180.A O no hydrogen 2.758 N/A ALA 188.A N ILE 165.A O no hydrogen 3.087 N/A LEU 189.A N VAL 200.A O no hydrogen 2.791 N/A ILE 190.A N SER 167.A O no hydrogen 2.920 N/A HIS 191.A N VAL 198.A O no hydrogen 2.825 N/A GLU 193.A N ARG 196.A O no hydrogen 2.861 N/A ARG 196.A NE GLU 193.A OE2 no hydrogen 3.316 N/A ARG 196.A NH2 GLU 193.A OE2 no hydrogen 3.115 N/A VAL 198.A N HIS 191.A O no hydrogen 2.801 N/A VAL 200.A N LEU 189.A O no hydrogen 2.814 N/A ASP 205.A N GLY 232.A O no hydrogen 2.637 N/A ARG 206.A N VAL 203.A O no hydrogen 3.258 N/A ARG 206.A NE THR 164.A OG1 no hydrogen 3.013 N/A ARG 206.A NH2 CYS 163.A O no hydrogen 3.093 N/A ALA 208.A N ARG 235.A O no hydrogen 2.896 N/A ILE 209.A N THR 164.A O no hydrogen 2.767 N/A LEU 210.A N TYR 237.A O no hydrogen 2.683 N/A VAL 211.A N VAL 166.A O no hydrogen 2.943 N/A ASP 212.A N ILE 239.A O no hydrogen 3.108 N/A ALA 215.A N HIS 242.A O no hydrogen 3.094 N/A CYS 218.A SG ASP 216.A O no hydrogen 3.610 N/A CYS 222.A N CYS 218.A O no hydrogen 3.015 N/A CYS 222.A SG CYS 218.A O no hydrogen 3.203 N/A HIS 223.A N GLY 219.A O no hydrogen 3.034 N/A ALA 224.A N THR 220.A O no hydrogen 2.886 N/A ALA 225.A N ILE 221.A O no hydrogen 3.113 N/A ASP 226.A N CYS 222.A O no hydrogen 3.262 N/A LYS 227.A N HIS 223.A O no hydrogen 3.117 N/A LEU 228.A N ALA 224.A O no hydrogen 2.931 N/A LEU 229.A N ALA 225.A O no hydrogen 3.000 N/A SER 230.A N ASP 226.A O no hydrogen 2.968 N/A SER 230.A OG ASP 226.A O no hydrogen 2.930 N/A ALA 231.A N LYS 227.A O no hydrogen 3.093 N/A GLY 232.A N LEU 229.A O no hydrogen 3.078 N/A ALA 233.A N LEU 228.A O no hydrogen 3.117 N/A THR 234.A N ARG 206.A O no hydrogen 2.974 N/A ARG 235.A NH1 TYR 237.A OH no hydrogen 2.427 N/A ARG 235.A NH2 GLU 159.A OE2 no hydrogen 2.932 N/A TYR 237.A N ALA 208.A O no hydrogen 2.872 N/A ALA 238.A N ALA 260.A O no hydrogen 3.156 N/A ILE 239.A N LEU 210.A O no hydrogen 2.630 N/A LEU 240.A N VAL 262.A O no hydrogen 2.835 N/A THR 241.A OG1 ASP 126.A OD1 no hydrogen 3.538 N/A HIS 242.A N ASP 213.A O no hydrogen 2.887 N/A HIS 242.A ND1 THR 266.A OG1 no hydrogen 2.853 N/A HIS 242.A NE2 ASP 126.A O no hydrogen 3.178 N/A ILE 244.A N ALA 215.A O no hydrogen 3.162 N/A PHE 245.A N ALA 215.A O no hydrogen 3.146 N/A SER 246.A N ASP 216.A O no hydrogen 3.220 N/A SER 246.A OG ASP 216.A OD1 no hydrogen 2.357 N/A ALA 249.A N SER 246.A O no hydrogen 3.451 N/A SER 251.A OG PRO 248.A O no hydrogen 2.747 N/A ARG 252.A N PRO 248.A O no hydrogen 2.937 N/A ARG 252.A NH1 THR 217.A O no hydrogen 3.118 N/A ILE 253.A N ALA 249.A O no hydrogen 2.993 N/A ASN 254.A N ILE 250.A O no hydrogen 3.211 N/A ASN 254.A ND2 HIS 275.A O no hydrogen 3.187 N/A ASN 255.A N SER 251.A O no hydrogen 3.130 N/A ALA 256.A N ARG 252.A O no hydrogen 2.951 N/A ALA 256.A N ILE 253.A O no hydrogen 2.989 N/A CYS 257.A SG ALA 225.A O no hydrogen 4.017 N/A GLU 259.A N VAL 236.A O no hydrogen 2.997 N/A VAL 261.A N LYS 278.A O no hydrogen 2.943 N/A VAL 262.A N ALA 238.A O no hydrogen 2.787 N/A VAL 263.A N GLN 280.A O no hydrogen 2.955 N/A THR 264.A N THR 241.A O no hydrogen 3.156 N/A THR 264.A OG1 THR 241.A O no hydrogen 2.588 N/A ASN 265.A ND2 ASP 283.A OD1 no hydrogen 2.988 N/A THR 266.A N THR 264.A OG1 no hydrogen 3.253 N/A THR 266.A OG1 THR 241.A O no hydrogen 3.401 N/A THR 266.A OG1 HIS 242.A ND1 no hydrogen 2.853 N/A THR 266.A OG1 THR 264.A OG1 no hydrogen 3.357 N/A GLN 269.A N GLU 270.A OE1 no hydrogen 3.414 N/A LYS 272.A NZ PHE 245.A O no hydrogen 2.630 N/A MET 273.A N GLN 269.A O no hydrogen 2.809 N/A HIS 275.A N LYS 272.A O no hydrogen 3.317 N/A CYS 276.A SG ASN 254.A OD1 no hydrogen 3.488 N/A LYS 278.A NZ PHE 258.A O no hydrogen 3.397 N/A GLN 280.A N VAL 261.A O no hydrogen 2.869 N/A ILE 282.A N VAL 263.A O no hydrogen 2.774 N/A SER 285.A N ASP 283.A OD1 no hydrogen 3.126 N/A SER 285.A OG ASP 283.A OD1 no hydrogen 2.590 N/A SER 285.A OG ASP 283.A OD2 no hydrogen 3.044 N/A LEU 288.A N ILE 284.A O no hydrogen 3.192 N/A ALA 289.A N SER 285.A O no hydrogen 2.795 N/A GLU 290.A N MET 286.A O no hydrogen 2.994 N/A ALA 291.A N ILE 287.A O no hydrogen 2.972 N/A ILE 292.A N LEU 288.A O no hydrogen 2.970 N/A ARG 293.A N ALA 289.A O no hydrogen 2.945 N/A ARG 293.A NH1 GLU 290.A OE2 no hydrogen 2.836 N/A ARG 294.A N GLU 290.A O no hydrogen 2.996 N/A ARG 294.A NE GLU 290.A OE2 no hydrogen 2.662 N/A ARG 294.A NH1 SER 300.A O no hydrogen 2.644 N/A ARG 294.A NH2 GLU 290.A OE2 no hydrogen 3.326 N/A THR 295.A N ALA 291.A O no hydrogen 2.864 N/A THR 295.A OG1 ALA 291.A O no hydrogen 2.637 N/A HIS 296.A N ILE 292.A O no hydrogen 2.910 N/A HIS 296.A ND1 ASP 50.A OD2 no hydrogen 2.644 N/A ASN 297.A N ARG 293.A O no hydrogen 2.878 N/A GLU 299.A N ARG 294.A O no hydrogen 2.858 N/A SER 300.A N GLU 299.A OE1 no hydrogen 3.247 N/A SER 300.A OG SER 302.A OG no hydrogen 3.104 N/A SER 302.A OG SER 300.A OG no hydrogen 3.104 N/A LEU 304.A N VAL 301.A O no hydrogen 3.322 N/A PHE 305.A N SER 302.A O no hydrogen 3.038 N/A