Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a3n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A NE2 ASP 236.A O no hydrogen 2.781 N/A GLN 5.A N ASP 88.A O no hydrogen 2.944 N/A GLN 5.A NE2 ASN 86.A OD1 no hydrogen 2.907 N/A THR 6.A N GLY 90.A O no hydrogen 2.793 N/A TRP 9.A NE1 ASP 228.A O no hydrogen 2.923 N/A ILE 11.A N PRO 8.A O no hydrogen 3.084 N/A GLU 12.A N PRO 8.A O no hydrogen 3.510 N/A ARG 13.A N TRP 9.A O no hydrogen 2.758 N/A ARG 13.A NE ASP 210.A OD1 no hydrogen 2.944 N/A ARG 13.A NH1 ARG 13.A O no hydrogen 3.019 N/A ARG 13.A NH2 ASP 210.A OD1 no hydrogen 3.443 N/A ARG 13.A NH2 ASP 210.A OD2 no hydrogen 2.936 N/A ARG 13.A NH2 ASP 292.A OD2 no hydrogen 2.939 N/A VAL 14.A N GLY 10.A O no hydrogen 3.105 N/A LYS 15.A N GLU 12.A O no hydrogen 3.024 N/A ALA 16.A N ILE 11.A O no hydrogen 3.455 N/A VAL 19.A N ALA 16.A O no hydrogen 2.877 N/A TRP 20.A N PRO 17.A O no hydrogen 3.163 N/A TRP 20.A NE1 VAL 94.A O no hydrogen 2.905 N/A ILE 22.A N VAL 19.A O no hydrogen 2.813 N/A THR 23.A N VAL 19.A O no hydrogen 3.041 N/A GLY 25.A N THR 23.A OG1 no hydrogen 2.969 N/A SER 26.A N ASP 24.A OD1 no hydrogen 3.251 N/A SER 26.A OG ASP 24.A OD1 no hydrogen 2.612 N/A VAL 27.A N GLY 25.A O no hydrogen 2.914 N/A ILE 30.A N VAL 27.A O no hydrogen 2.813 N/A GLN 31.A N GLU 150.A OE2 no hydrogen 2.951 N/A GLN 31.A NE2 SER 28.A O no hydrogen 3.083 N/A GLN 31.A NE2 GLN 99.A OE1 no hydrogen 3.240 N/A VAL 32.A N GLN 99.A O no hydrogen 2.866 N/A ALA 33.A N VAL 151.A O no hydrogen 2.899 N/A VAL 34.A N TYR 101.A O no hydrogen 2.797 N/A LEU 35.A N SER 153.A O no hydrogen 2.963 N/A ASP 36.A N VAL 103.A O no hydrogen 2.959 N/A THR 37.A N ASP 36.A OD1 no hydrogen 2.840 N/A THR 37.A OG1 ASP 36.A OD1 no hydrogen 3.466 N/A THR 37.A OG1 ASP 70.A OD2 no hydrogen 2.743 N/A ASP 40.A N THR 76.A OG1 no hydrogen 2.835 N/A HIS 43.A N ASP 40.A O no hydrogen 2.937 N/A HIS 43.A NE2 TYR 238.A OH no hydrogen 3.372 N/A LEU 46.A N HIS 43.A O no hydrogen 2.856 N/A ALA 47.A N HIS 43.A O no hydrogen 2.725 N/A ASN 49.A N LEU 46.A O no hydrogen 3.087 N/A ASN 49.A ND2 ALA 83.A O no hydrogen 2.702 N/A ASN 49.A ND2 PRO 96.A O no hydrogen 2.892 N/A ILE 50.A N ALA 47.A O no hydrogen 3.288 N/A ALA 51.A N ILE 100.A O no hydrogen 2.710 N/A TRP 52.A N ILE 100.A O no hydrogen 3.362 N/A VAL 54.A N SER 102.A O no hydrogen 2.839 N/A SER 55.A N SER 62.A O no hydrogen 2.650 N/A SER 55.A OG ASP 67.A O no hydrogen 3.549 N/A THR 56.A N ARG 104.A O no hydrogen 2.955 N/A THR 56.A OG1 ASP 116.A O no hydrogen 2.753 N/A ARG 58.A N ASP 116.A OD2 no hydrogen 2.769 N/A GLY 59.A N THR 56.A O no hydrogen 3.194 N/A SER 62.A N SER 55.A O no hydrogen 2.857 N/A SER 62.A OG ASP 67.A OD2 no hydrogen 2.619 N/A LYS 64.A N SER 62.A OG no hydrogen 3.058 N/A ASP 67.A N LYS 64.A O no hydrogen 3.087 N/A CYS 68.A N LYS 64.A O no hydrogen 2.958 N/A ALA 69.A N LEU 65.A O no hydrogen 3.068 N/A ASP 70.A N VAL 39.A O no hydrogen 3.215 N/A ASN 72.A N ASP 70.A OD2 no hydrogen 3.117 N/A ASN 72.A ND2 ALA 108.A O no hydrogen 3.043 N/A GLY 73.A N ASP 70.A OD2 no hydrogen 2.909 N/A HIS 74.A N ASN 72.A OD1 no hydrogen 2.858 N/A HIS 74.A ND1 ASP 36.A OD1 no hydrogen 2.619 N/A GLY 75.A N THR 37.A OG1 no hydrogen 2.715 N/A THR 76.A N ASP 70.A OD1 no hydrogen 2.940 N/A THR 76.A OG1 ASP 70.A OD1 no hydrogen 2.509 N/A HIS 77.A N GLY 73.A O no hydrogen 3.023 N/A HIS 77.A NE2 ILE 229.A O no hydrogen 2.971 N/A HIS 77.A NE2 GLU 239.A O no hydrogen 3.089 N/A VAL 78.A N HIS 74.A O no hydrogen 3.034 N/A ILE 79.A N GLY 75.A O no hydrogen 2.907 N/A GLY 80.A N THR 76.A O no hydrogen 3.048 N/A THR 81.A N HIS 77.A O no hydrogen 3.197 N/A THR 81.A N VAL 78.A O no hydrogen 3.045 N/A THR 81.A OG1 HIS 77.A O no hydrogen 3.467 N/A ILE 82.A N VAL 78.A O no hydrogen 3.381 N/A ALA 83.A N ILE 79.A O no hydrogen 2.899 N/A ALA 84.A N GLY 80.A O no hydrogen 3.014 N/A LEU 85.A N ASP 45.A O no hydrogen 2.873 N/A ASN 87.A N GLN 5.A OE1 no hydrogen 3.120 N/A ASN 87.A ND2 ASP 45.A OD1 no hydrogen 2.795 N/A ILE 89.A N ASN 87.A OD1 no hydrogen 3.267 N/A GLY 90.A N PRO 3.A O no hydrogen 2.900 N/A VAL 91.A N ASP 45.A OD2 no hydrogen 2.942 N/A GLY 93.A N ALA 84.A O no hydrogen 2.990 N/A VAL 94.A N THR 81.A O no hydrogen 2.847 N/A ALA 95.A N ILE 82.A O no hydrogen 2.790 N/A GLY 97.A N ASP 24.A O no hydrogen 2.817 N/A VAL 98.A N ALA 95.A O no hydrogen 3.253 N/A GLN 99.A NE2 SER 28.A O no hydrogen 2.999 N/A ILE 100.A N ASN 49.A O no hydrogen 2.667 N/A TYR 101.A N VAL 32.A O no hydrogen 2.848 N/A TYR 101.A OH ASP 147.A O no hydrogen 2.592 N/A SER 102.A N TRP 52.A O no hydrogen 2.888 N/A VAL 103.A N VAL 34.A O no hydrogen 2.876 N/A ARG 104.A N VAL 54.A O no hydrogen 2.927 N/A ARG 104.A NE LEU 106.A O no hydrogen 3.279 N/A ARG 104.A NH1 ASP 67.A O no hydrogen 2.776 N/A ARG 104.A NH1 GLN 71.A OE1 no hydrogen 3.062 N/A ARG 104.A NH2 GLN 71.A OE1 no hydrogen 2.705 N/A VAL 105.A N ASP 36.A O no hydrogen 2.862 N/A LEU 106.A N ASP 36.A O no hydrogen 2.952 N/A ASP 107.A N SER 111.A O no hydrogen 2.896 N/A ARG 109.A N ASP 107.A OD1 no hydrogen 2.839 N/A GLY 110.A N ASP 107.A O no hydrogen 3.091 N/A SER 111.A N ASP 107.A OD1 no hydrogen 3.361 N/A TYR 114.A OH ALA 160.A O no hydrogen 2.788 N/A ILE 117.A N SER 113.A O no hydrogen 3.017 N/A ALA 118.A N TYR 114.A O no hydrogen 2.904 N/A ILE 119.A N SER 115.A O no hydrogen 3.131 N/A GLY 120.A N ASP 116.A O no hydrogen 2.978 N/A ILE 121.A N ILE 117.A O no hydrogen 3.018 N/A GLU 122.A N ALA 118.A O no hydrogen 3.181 N/A GLN 123.A N ILE 119.A O no hydrogen 2.896 N/A ALA 124.A N GLY 120.A O no hydrogen 3.053 N/A ALA 124.A N ILE 121.A O no hydrogen 2.955 N/A ILE 125.A N ILE 121.A O no hydrogen 3.086 N/A ILE 125.A N GLU 122.A O no hydrogen 3.165 N/A LEU 126.A N GLU 122.A O no hydrogen 2.861 N/A GLY 127.A N GLN 123.A O no hydrogen 2.921 N/A ASP 129.A N ASP 147.A OD1 no hydrogen 2.949 N/A GLY 130.A N GLY 127.A O no hydrogen 2.946 N/A VAL 131.A N ASP 129.A OD1 no hydrogen 3.151 N/A LYS 134.A N ASP 146.A OD1 no hydrogen 2.760 N/A GLY 136.A N ASP 133.A O no hydrogen 3.194 N/A GLY 138.A N ASP 133.A OD2 no hydrogen 2.692 N/A ILE 139.A N ASP 137.A OD1 no hydrogen 3.075 N/A ALA 141.A N ALA 175.A O no hydrogen 2.890 N/A GLY 142.A N GLU 150.A OE1 no hydrogen 2.602 N/A ASP 143.A N ILE 140.A O no hydrogen 3.182 N/A ASP 145.A N ASP 143.A OD2 no hydrogen 2.819 N/A ASP 146.A N ASP 143.A O no hydrogen 3.045 N/A ALA 149.A N ALA 124.A O no hydrogen 3.129 N/A GLU 150.A N GLN 31.A O no hydrogen 2.940 N/A ILE 152.A N VAL 178.A O no hydrogen 2.816 N/A SER 153.A N ALA 33.A O no hydrogen 2.865 N/A SER 153.A OG SER 252.A OG no hydrogen 2.669 N/A MET 154.A N VAL 180.A O no hydrogen 2.776 N/A SER 155.A OG ALA 245.A O no hydrogen 2.691 N/A GLY 158.A N TYR 193.A O no hydrogen 2.773 N/A TYR 166.A N ASP 162.A O no hydrogen 2.805 N/A TYR 166.A OH GLU 199.A OE2 no hydrogen 2.872 N/A ASP 167.A N SER 163.A O no hydrogen 2.630 N/A MET 168.A N TYR 164.A O no hydrogen 3.160 N/A ILE 169.A N LEU 165.A O no hydrogen 3.139 N/A ILE 170.A N TYR 166.A O no hydrogen 2.987 N/A GLN 171.A N ASP 167.A O no hydrogen 2.933 N/A ALA 172.A N MET 168.A O no hydrogen 3.065 N/A TYR 173.A N ILE 169.A O no hydrogen 2.827 N/A TYR 173.A OH GLY 273.A O no hydrogen 2.758 N/A ASN 174.A N ILE 170.A O no hydrogen 2.848 N/A ASN 174.A ND2 ILE 170.A O no hydrogen 3.402 N/A ALA 175.A N GLN 171.A O no hydrogen 2.984 N/A ALA 175.A N ALA 172.A O no hydrogen 3.072 N/A GLY 176.A N TYR 173.A O no hydrogen 3.109 N/A ILE 177.A N ALA 172.A O no hydrogen 3.206 N/A VAL 178.A N GLU 150.A O no hydrogen 2.991 N/A VAL 180.A N ILE 152.A O no hydrogen 2.844 N/A ALA 181.A N ILE 201.A O no hydrogen 2.850 N/A ALA 182.A N MET 154.A O no hydrogen 3.109 N/A SER 183.A N VAL 203.A O no hydrogen 2.809 N/A SER 183.A OG VAL 203.A O no hydrogen 3.365 N/A SER 183.A OG ASN 217.A O no hydrogen 2.985 N/A GLY 184.A N THR 244.A OG1 no hydrogen 3.265 N/A GLY 187.A N PHE 215.A O no hydrogen 2.896 N/A SER 192.A N SER 183.A O no hydrogen 2.813 N/A TYR 193.A N GLY 158.A O no hydrogen 2.891 N/A ALA 196.A N SER 192.A O no hydrogen 2.837 N/A TYR 197.A N PRO 194.A O no hydrogen 2.917 N/A TYR 197.A OH ASP 161.A OD2 no hydrogen 2.704 N/A GLU 199.A N GLU 199.A OE1 no hydrogen 2.546 N/A VAL 200.A N TYR 197.A O no hydrogen 3.149 N/A ILE 201.A N ILE 179.A O no hydrogen 2.805 N/A VAL 203.A N ALA 181.A O no hydrogen 2.656 N/A GLY 204.A N VAL 222.A O no hydrogen 2.976 N/A ALA 205.A N SER 216.A OG no hydrogen 2.944 N/A ILE 206.A N ALA 224.A O no hydrogen 2.932 N/A ASP 207.A N ASN 211.A O no hydrogen 2.928 N/A ASN 209.A N ASP 207.A OD2 no hydrogen 2.959 N/A ASP 210.A N ASP 207.A O no hydrogen 3.053 N/A ASN 211.A N ASP 207.A OD2 no hydrogen 2.856 N/A ALA 213.A N ALA 205.A O no hydrogen 2.909 N/A SER 216.A N ALA 213.A O no hydrogen 3.049 N/A ASN 217.A N GLY 184.A O no hydrogen 2.936 N/A ARG 218.A N ALA 188.A O no hydrogen 2.877 N/A ARG 218.A NE ASP 302.A OD1 no hydrogen 2.912 N/A ARG 218.A NH1 SER 214.A O no hydrogen 3.264 N/A ARG 218.A NH1 SER 216.A O no hydrogen 2.666 N/A GLN 219.A N ALA 301.A O no hydrogen 2.572 N/A GLN 219.A NE2 PRO 189.A O no hydrogen 2.706 N/A GLU 221.A N ALA 202.A O no hydrogen 2.763 N/A VAL 222.A N ALA 202.A O no hydrogen 3.318 N/A SER 223.A N GLY 306.A O no hydrogen 3.034 N/A SER 223.A OG TYR 303.A O no hydrogen 2.943 N/A ALA 224.A N GLY 204.A O no hydrogen 2.831 N/A GLY 226.A N ILE 206.A O no hydrogen 2.866 N/A ILE 229.A N LEU 241.A O no hydrogen 2.724 N/A SER 231.A N GLU 239.A O no hydrogen 3.012 N/A SER 231.A OG HIS 77.A O no hydrogen 2.862 N/A THR 232.A N SER 231.A OG no hydrogen 2.562 N/A THR 232.A OG1 THR 76.A O no hydrogen 2.681 N/A TYR 233.A N SER 237.A O no hydrogen 3.067 N/A ASP 236.A N ASP 40.A OD1 no hydrogen 2.668 N/A SER 237.A N TYR 233.A O no hydrogen 2.812 N/A TYR 238.A N SER 237.A OG no hydrogen 2.689 N/A TYR 238.A OH GLN 2.A OE1 no hydrogen 2.485 N/A GLU 239.A N SER 231.A O no hydrogen 2.955 N/A THR 240.A N GLU 239.A OE2 no hydrogen 2.907 N/A LEU 241.A N ILE 229.A O no hydrogen 2.872 N/A GLY 243.A N GLY 226.A O no hydrogen 2.879 N/A THR 244.A N ASN 185.A OD1 no hydrogen 2.983 N/A THR 244.A OG1 ASN 185.A OD1 no hydrogen 2.891 N/A MET 246.A N GLY 243.A O no hydrogen 3.073 N/A ALA 247.A N THR 244.A O no hydrogen 3.257 N/A THR 248.A N THR 244.A O no hydrogen 3.065 N/A THR 248.A OG1 THR 244.A O no hydrogen 2.670 N/A HIS 250.A ND1 MET 246.A O no hydrogen 2.746 N/A VAL 251.A N THR 248.A O no hydrogen 3.053 N/A SER 252.A N THR 248.A O no hydrogen 3.108 N/A SER 252.A OG SER 153.A OG no hydrogen 2.669 N/A SER 252.A OG THR 248.A O no hydrogen 3.321 N/A GLY 253.A N PRO 249.A O no hydrogen 2.833 N/A VAL 254.A N HIS 250.A O no hydrogen 3.099 N/A VAL 255.A N VAL 251.A O no hydrogen 3.080 N/A ALA 256.A N SER 252.A O no hydrogen 3.025 N/A LEU 257.A N GLY 253.A O no hydrogen 3.086 N/A ILE 258.A N VAL 254.A O no hydrogen 2.963 N/A GLN 259.A N VAL 255.A O no hydrogen 3.061 N/A ALA 260.A N ALA 256.A O no hydrogen 2.722 N/A ALA 261.A N LEU 257.A O no hydrogen 2.940 N/A TYR 262.A N ILE 258.A O no hydrogen 2.815 N/A TYR 263.A N GLN 259.A O no hydrogen 3.009 N/A GLN 264.A N ALA 260.A O no hydrogen 3.142 N/A GLN 264.A NE2 ILE 22.A O no hydrogen 3.234 N/A LYS 265.A N ALA 261.A O no hydrogen 3.103 N/A LYS 265.A NZ LEU 318.A O no hydrogen 2.847 N/A TYR 266.A N TYR 262.A O no hydrogen 2.713 N/A GLY 267.A N TYR 263.A O no hydrogen 2.500 N/A THR 274.A N ASP 277.A OD1 no hydrogen 3.033 N/A ASP 277.A N THR 274.A O no hydrogen 3.245 N/A SER 279.A N ASP 277.A OD2 no hydrogen 3.092 N/A SER 279.A OG ASP 277.A OD2 no hydrogen 2.548 N/A THR 282.A OG1 ASP 277.A OD1 no hydrogen 2.943 N/A VAL 283.A N PRO 271.A O no hydrogen 2.782 N/A ARG 284.A N VAL 272.A O no hydrogen 2.949 N/A ARG 284.A NE GLU 221.A OE2 no hydrogen 3.025 N/A ARG 284.A NH1 PRO 198.A O no hydrogen 2.849 N/A ARG 284.A NH1 GLY 273.A O no hydrogen 3.111 N/A ARG 284.A NH2 PRO 198.A O no hydrogen 2.811 N/A ARG 284.A NH2 GLU 221.A OE1 no hydrogen 2.868 N/A GLY 285.A N THR 282.A OG1 no hydrogen 2.884 N/A ILE 286.A N THR 282.A O no hydrogen 3.164 N/A LEU 287.A N VAL 283.A O no hydrogen 2.907 N/A HIS 288.A N ARG 284.A O no hydrogen 3.017 N/A ILE 289.A N GLY 285.A O no hydrogen 3.007 N/A THR 290.A N ILE 286.A O no hydrogen 3.117 N/A THR 290.A OG1 ILE 286.A O no hydrogen 2.591 N/A ALA 291.A N HIS 288.A O no hydrogen 3.380 N/A ASP 292.A N VAL 307.A O no hydrogen 2.781 N/A GLY 298.A N ASP 293.A OD2 no hydrogen 2.830 N/A TRP 299.A NE1 PRO 220.A O no hydrogen 2.900 N/A ASP 300.A N GLY 304.A O no hydrogen 3.088 N/A ASP 302.A N ASP 300.A OD2 no hydrogen 3.038 N/A TYR 303.A N ASP 300.A OD2 no hydrogen 2.886 N/A TYR 303.A OH ASP 210.A O no hydrogen 2.752 N/A GLY 304.A N ASP 300.A O no hydrogen 2.679 N/A TYR 305.A N GLU 221.A O no hydrogen 2.825 N/A GLY 306.A N TYR 303.A O no hydrogen 3.128 N/A VAL 307.A N ASP 292.A O no hydrogen 3.107 N/A VAL 308.A N SER 223.A O no hydrogen 3.402 N/A ARG 309.A NE THR 290.A O no hydrogen 2.943 N/A ARG 309.A NH2 THR 290.A O no hydrogen 3.094 N/A ALA 310.A N VAL 14.A O no hydrogen 2.707 N/A ALA 313.A N ARG 309.A O no hydrogen 3.079 N/A VAL 314.A N ALA 310.A O no hydrogen 2.923 N/A GLN 315.A N ALA 311.A O no hydrogen 3.218 N/A ALA 316.A N LEU 312.A O no hydrogen 2.827 N/A ALA 317.A N ALA 313.A O no hydrogen 2.755 N/A LEU 318.A N VAL 314.A O no hydrogen 3.073 N/A GLY 319.A N ALA 316.A O no hydrogen 3.238 N/A