Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4i9u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N ALA 2.A O no hydrogen 2.807 N/A GLN 6.A N ALA 2.A O no hydrogen 2.880 N/A LEU 7.A N LEU 3.A O no hydrogen 2.817 N/A ILE 8.A N LYS 4.A O no hydrogen 2.822 N/A ASN 10.A ND2 LEU 12.A O no hydrogen 2.660 N/A LYS 13.A NZ GLU 15.A OE2 no hydrogen 3.523 N/A GLN 19.A N ASP 45.A OD2 no hydrogen 2.935 N/A GLN 19.A NE2 VAL 17.A O no hydrogen 2.828 N/A ASN 20.A N ASP 45.A OD1 no hydrogen 2.735 N/A ASN 20.A N ASP 45.A OD2 no hydrogen 3.183 N/A LYS 21.A NZ GLU 46.A OE2 no hydrogen 3.103 N/A LYS 21.A NZ VAL 84.A O no hydrogen 2.616 N/A LYS 21.A NZ ALA 86.A O no hydrogen 2.661 N/A ILE 22.A N GLU 46.A O no hydrogen 2.668 N/A THR 23.A N LEU 90.A O no hydrogen 2.983 N/A THR 23.A OG1 SER 88.A OG no hydrogen 2.615 N/A VAL 24.A N ALA 48.A O no hydrogen 2.951 N/A VAL 25.A N ILE 92.A O no hydrogen 2.650 N/A GLY 26.A N VAL 50.A O no hydrogen 2.689 N/A VAL 27.A N ASP 51.A OD2 no hydrogen 2.894 N/A MET 32.A N GLY 28.A O no hydrogen 3.040 N/A ALA 33.A N ALA 29.A O no hydrogen 3.182 N/A CYS 34.A N VAL 30.A O no hydrogen 3.022 N/A CYS 34.A SG VAL 30.A O no hydrogen 3.571 N/A ALA 35.A N GLY 31.A O no hydrogen 2.923 N/A ILE 36.A N MET 32.A O no hydrogen 2.825 N/A SER 37.A N ALA 33.A O no hydrogen 3.108 N/A SER 37.A OG ALA 33.A O no hydrogen 2.976 N/A ILE 38.A N CYS 34.A O no hydrogen 3.057 N/A LEU 39.A N ALA 35.A O no hydrogen 2.886 N/A MET 40.A N ILE 36.A O no hydrogen 3.199 N/A MET 40.A N SER 37.A O no hydrogen 3.191 N/A LYS 41.A N SER 37.A O no hydrogen 3.148 N/A LYS 41.A N ILE 38.A O no hydrogen 3.312 N/A LYS 41.A NZ GLU 252.A OE1 no hydrogen 2.911 N/A ASP 42.A N LEU 39.A O no hydrogen 3.321 N/A ASP 45.A N ASN 20.A O no hydrogen 3.099 N/A LEU 47.A N LYS 75.A O no hydrogen 3.058 N/A ALA 48.A N ILE 22.A O no hydrogen 2.965 N/A LEU 49.A N VAL 77.A O no hydrogen 2.974 N/A VAL 50.A N VAL 24.A O no hydrogen 3.382 N/A VAL 52.A N ASP 51.A OD1 no hydrogen 2.392 N/A LYS 56.A NZ GLU 60.A OE2 no hydrogen 2.918 N/A LEU 57.A N MET 53.A O no hydrogen 2.958 N/A LYS 58.A N GLU 54.A O no hydrogen 2.903 N/A GLY 59.A N ASP 55.A O no hydrogen 2.784 N/A GLU 60.A N LYS 56.A O no hydrogen 3.115 N/A GLU 60.A N LEU 57.A O no hydrogen 3.253 N/A MET 61.A N LEU 57.A O no hydrogen 3.131 N/A MET 62.A N LYS 58.A O no hydrogen 3.126 N/A ASP 63.A N GLY 59.A O no hydrogen 3.025 N/A LEU 64.A N GLU 60.A O no hydrogen 3.050 N/A GLN 65.A N MET 61.A O no hydrogen 2.904 N/A GLN 65.A NE2 ILE 76.A O no hydrogen 2.677 N/A HIS 66.A N MET 62.A O no hydrogen 3.036 N/A GLY 67.A N LEU 64.A O no hydrogen 3.115 N/A SER 68.A N GLN 65.A O no hydrogen 2.829 N/A SER 68.A OG GLN 65.A O no hydrogen 2.653 N/A PHE 70.A N GLY 67.A O no hydrogen 2.853 N/A LEU 71.A N SER 68.A O no hydrogen 2.810 N/A THR 73.A OG1 ALA 44.A O no hydrogen 2.943 N/A LYS 75.A NZ GLU 46.A OE1 no hydrogen 3.534 N/A VAL 77.A N LEU 47.A O no hydrogen 2.930 N/A GLY 79.A N LEU 49.A O no hydrogen 3.212 N/A LYS 80.A NZ GLU 54.A OE1 no hydrogen 3.356 N/A LYS 80.A NZ GLU 54.A OE2 no hydrogen 3.438 N/A SER 83.A N ASP 81.A OD1 no hydrogen 2.841 N/A SER 83.A OG ASP 81.A OD1 no hydrogen 2.747 N/A VAL 84.A N ASP 81.A O no hydrogen 3.352 N/A THR 85.A N TYR 82.A O no hydrogen 2.957 N/A THR 85.A OG1 TYR 82.A O no hydrogen 2.828 N/A ALA 86.A N SER 83.A O no hydrogen 3.077 N/A ASN 87.A N TYR 118.A O no hydrogen 3.217 N/A SER 88.A N THR 85.A O no hydrogen 3.273 N/A SER 88.A N SER 119.A OG no hydrogen 2.914 N/A SER 88.A OG THR 23.A OG1 no hydrogen 2.615 N/A SER 88.A OG THR 85.A O no hydrogen 3.041 N/A LYS 89.A N LYS 21.A O no hydrogen 2.942 N/A LYS 89.A NZ GLN 19.A O no hydrogen 2.578 N/A VAL 91.A N LYS 123.A O no hydrogen 2.837 N/A ILE 92.A N THR 23.A O no hydrogen 2.646 N/A ILE 93.A N LEU 125.A O no hydrogen 2.896 N/A THR 94.A N VAL 25.A O no hydrogen 2.823 N/A THR 94.A OG1 VAL 25.A O no hydrogen 2.639 N/A THR 94.A OG1 GLY 26.A O no hydrogen 3.029 N/A GLN 102.A NE2 GLN 102.A O no hydrogen 3.381 N/A GLN 102.A NE2 ASN 106.A OD1 no hydrogen 3.336 N/A GLN 102.A NE2 GLN 322.A O no hydrogen 3.312 N/A ARG 103.A N LEU 100.A O no hydrogen 2.433 N/A VAL 105.A N VAL 101.A O no hydrogen 2.333 N/A ASN 106.A N GLN 102.A O no hydrogen 2.696 N/A ILE 107.A N ARG 103.A O no hydrogen 2.846 N/A PHE 108.A N ASN 104.A O no hydrogen 2.910 N/A LYS 109.A N VAL 105.A O no hydrogen 2.779 N/A LYS 109.A NZ LYS 109.A O no hydrogen 2.781 N/A PHE 110.A N ILE 107.A O no hydrogen 2.895 N/A ILE 111.A N ILE 107.A O no hydrogen 2.906 N/A ILE 112.A N PHE 108.A O no hydrogen 2.945 N/A VAL 115.A N ILE 111.A O no hydrogen 2.975 N/A VAL 116.A N ILE 112.A O no hydrogen 2.953 N/A LYS 117.A N PRO 113.A O no hydrogen 2.961 N/A LYS 117.A N ASN 114.A O no hydrogen 3.062 N/A LYS 117.A NZ TYR 118.A OH no hydrogen 3.373 N/A TYR 118.A N ASN 114.A O no hydrogen 3.250 N/A SER 119.A N VAL 115.A O no hydrogen 2.978 N/A CYS 122.A SG SER 119.A O no hydrogen 3.536 N/A LYS 123.A N LYS 89.A O no hydrogen 2.975 N/A LYS 123.A NZ LYS 89.A O no hydrogen 3.370 N/A LYS 123.A NZ GLN 288.A O no hydrogen 3.051 N/A LEU 124.A N ARG 148.A O no hydrogen 3.000 N/A LEU 125.A N VAL 91.A O no hydrogen 2.936 N/A VAL 126.A N ILE 150.A O no hydrogen 2.814 N/A VAL 127.A N ILE 93.A O no hydrogen 2.979 N/A SER 128.A OG ILE 93.A O no hydrogen 3.461 N/A SER 128.A OG ALA 95.A O no hydrogen 2.972 N/A LEU 134.A N PRO 130.A O no hydrogen 2.942 N/A THR 135.A N VAL 131.A O no hydrogen 3.053 N/A THR 135.A OG1 VAL 131.A O no hydrogen 2.650 N/A TYR 136.A N ASP 132.A O no hydrogen 3.174 N/A VAL 137.A N ILE 133.A O no hydrogen 2.765 N/A ALA 138.A N LEU 134.A O no hydrogen 2.885 N/A TRP 139.A N THR 135.A O no hydrogen 3.139 N/A LYS 140.A N TYR 136.A O no hydrogen 2.933 N/A ILE 141.A N VAL 137.A O no hydrogen 2.896 N/A SER 142.A N ALA 138.A O no hydrogen 2.836 N/A SER 142.A OG TRP 139.A O no hydrogen 3.103 N/A GLY 143.A N TRP 139.A O no hydrogen 3.394 N/A PHE 144.A N SER 142.A OG no hydrogen 2.688 N/A ASN 147.A ND2 ASN 289.A O no hydrogen 3.160 N/A ARG 148.A N PRO 145.A O no hydrogen 3.137 N/A ARG 148.A NH1 PRO 120.A O no hydrogen 3.048 N/A ARG 148.A NH1 CYS 122.A O no hydrogen 2.850 N/A ARG 148.A NH2 PRO 120.A O no hydrogen 3.492 N/A VAL 149.A N LYS 146.A O no hydrogen 2.870 N/A ILE 150.A N LEU 124.A O no hydrogen 2.825 N/A GLY 151.A N SER 265.A O no hydrogen 2.966 N/A SER 152.A N VAL 126.A O no hydrogen 2.824 N/A SER 152.A OG VAL 126.A O no hydrogen 3.476 N/A CYS 154.A N SER 281.A OG no hydrogen 2.957 N/A CYS 154.A SG GLY 182.A O no hydrogen 3.825 N/A ASN 155.A N SER 152.A O no hydrogen 3.210 N/A SER 158.A N CYS 154.A O no hydrogen 2.765 N/A SER 158.A OG CYS 154.A O no hydrogen 3.128 N/A ALA 159.A N ASN 155.A O no hydrogen 3.004 N/A ARG 160.A N LEU 156.A O no hydrogen 2.772 N/A PHE 161.A N ASP 157.A O no hydrogen 2.986 N/A ARG 162.A N SER 158.A O no hydrogen 3.232 N/A ARG 162.A NE ALA 173.A O no hydrogen 3.358 N/A ARG 162.A NE CYS 176.A O no hydrogen 2.811 N/A ARG 162.A NH2 ALA 173.A O no hydrogen 3.321 N/A ARG 162.A NH2 CYS 176.A O no hydrogen 3.425 N/A TYR 163.A N ALA 159.A O no hydrogen 3.055 N/A TYR 163.A OH GLU 167.A OE1 no hydrogen 3.360 N/A LEU 164.A N ARG 160.A O no hydrogen 2.964 N/A MET 165.A N PHE 161.A O no hydrogen 2.678 N/A GLY 166.A N ARG 162.A O no hydrogen 2.832 N/A GLU 167.A N LEU 164.A O no hydrogen 3.186 N/A ARG 168.A N LEU 164.A O no hydrogen 3.307 N/A ARG 168.A N MET 165.A O no hydrogen 3.027 N/A ARG 168.A NH1 GLU 216.A O no hydrogen 3.072 N/A LEU 169.A N MET 165.A O no hydrogen 3.153 N/A GLY 170.A N GLY 166.A O no hydrogen 3.103 N/A LEU 174.A N HIS 172.A ND1 no hydrogen 2.760 N/A SER 175.A N HIS 172.A O no hydrogen 2.924 N/A CYS 176.A N ALA 173.A O no hydrogen 3.047 N/A CYS 176.A SG VAL 171.A O no hydrogen 3.718 N/A CYS 176.A SG HIS 172.A O no hydrogen 3.753 N/A HIS 177.A N ASN 196.A O no hydrogen 2.968 N/A ILE 180.A N SER 158.A OG no hydrogen 3.018 N/A LEU 181.A N VAL 189.A O no hydrogen 3.061 N/A GLY 182.A N SER 281.A O no hydrogen 2.877 N/A HIS 184.A N ASP 132.A OD2 no hydrogen 2.989 N/A SER 188.A N GLY 185.A O no hydrogen 3.070 N/A SER 188.A OG GLY 185.A O no hydrogen 2.948 N/A VAL 189.A N LEU 181.A O no hydrogen 2.762 N/A VAL 191.A N TRP 179.A O no hydrogen 3.080 N/A GLY 194.A N VAL 191.A O no hydrogen 3.351 N/A MET 195.A N TRP 192.A O no hydrogen 3.230 N/A ASN 196.A N HIS 177.A O no hydrogen 2.968 N/A VAL 200.A N VAL 197.A O no hydrogen 2.575 N/A SER 201.A OG THR 204.A OG1 no hydrogen 3.409 N/A LEU 202.A N MET 195.A O no hydrogen 2.910 N/A LYS 203.A NZ PRO 207.A O no hydrogen 2.906 N/A LYS 203.A NZ LEU 209.A O no hydrogen 2.727 N/A THR 204.A N SER 201.A O no hydrogen 3.230 N/A THR 204.A OG1 SER 201.A OG no hydrogen 3.409 N/A LEU 205.A N SER 201.A O no hydrogen 3.208 N/A HIS 206.A N LEU 202.A O no hydrogen 2.763 N/A HIS 206.A NE2 ASP 214.A OD1 no hydrogen 2.798 N/A LEU 209.A N HIS 206.A O no hydrogen 2.830 N/A GLY 210.A N ASP 214.A OD2 no hydrogen 3.228 N/A THR 211.A N GLU 208.A O no hydrogen 2.780 N/A THR 211.A OG1 GLU 208.A O no hydrogen 2.712 N/A THR 211.A OG1 GLU 208.A OE2 no hydrogen 3.438 N/A ASP 214.A N THR 211.A O no hydrogen 3.053 N/A GLU 216.A N ASP 214.A OD1 no hydrogen 2.893 N/A GLN 217.A N ASP 214.A O no hydrogen 2.850 N/A GLN 217.A NE2 ASP 212.A O no hydrogen 3.593 N/A GLN 217.A NE2 ASP 214.A O no hydrogen 3.162 N/A TRP 218.A N ASP 214.A OD2 no hydrogen 3.136 N/A TRP 218.A NE1 GLU 216.A OE2 no hydrogen 3.099 N/A LYS 219.A NZ ASP 212.A OD2 no hydrogen 3.384 N/A GLN 220.A N GLN 217.A O no hydrogen 2.997 N/A VAL 221.A N TRP 218.A O no hydrogen 2.915 N/A HIS 222.A NE2 SER 188.A O no hydrogen 3.117 N/A LYS 223.A N LYS 219.A O no hydrogen 3.067 N/A LYS 223.A NZ ASP 227.A OD2 no hydrogen 2.692 N/A GLN 224.A N GLN 220.A O no hydrogen 2.706 N/A VAL 225.A N VAL 221.A O no hydrogen 3.098 N/A VAL 226.A N HIS 222.A O no hydrogen 3.012 N/A ASP 227.A N LYS 223.A O no hydrogen 2.822 N/A SER 228.A OG GLN 224.A O no hydrogen 3.058 N/A SER 228.A OG VAL 225.A O no hydrogen 2.941 N/A GLU 231.A N ASP 227.A O no hydrogen 2.854 N/A VAL 232.A N SER 228.A O no hydrogen 2.706 N/A ILE 233.A N ALA 229.A O no hydrogen 2.957 N/A LYS 234.A N TYR 230.A O no hydrogen 3.131 N/A LEU 235.A N VAL 232.A O no hydrogen 3.014 N/A LYS 236.A N VAL 232.A O no hydrogen 3.045 N/A LYS 236.A NZ THR 240.A OG1 no hydrogen 3.179 N/A GLY 237.A N ILE 233.A O no hydrogen 2.608 N/A GLY 244.A N THR 240.A O no hydrogen 2.880 N/A LEU 245.A N TRP 241.A O no hydrogen 3.116 N/A SER 246.A N ALA 242.A O no hydrogen 3.125 N/A SER 246.A OG ALA 242.A O no hydrogen 3.296 N/A SER 246.A OG ILE 243.A O no hydrogen 2.871 N/A VAL 247.A N ILE 243.A O no hydrogen 2.893 N/A ALA 248.A N GLY 244.A O no hydrogen 2.933 N/A ASP 249.A N LEU 245.A O no hydrogen 3.056 N/A LEU 250.A N SER 246.A O no hydrogen 3.200 N/A ALA 251.A N VAL 247.A O no hydrogen 2.782 N/A GLU 252.A N ALA 248.A O no hydrogen 2.721 N/A SER 253.A N ASP 249.A O no hydrogen 3.164 N/A SER 253.A OG ASP 249.A O no hydrogen 3.426 N/A SER 253.A OG HIS 262.A NE2 no hydrogen 2.727 N/A ILE 254.A N LEU 250.A O no hydrogen 3.122 N/A MET 255.A N ALA 251.A O no hydrogen 2.982 N/A LYS 256.A N GLU 252.A O no hydrogen 3.132 N/A LYS 256.A NZ GLU 252.A OE2 no hydrogen 2.713 N/A ASN 257.A N ILE 254.A O no hydrogen 3.293 N/A LEU 258.A N SER 253.A O no hydrogen 2.963 N/A ARG 259.A NH1 SER 292.A OG no hydrogen 3.308 N/A ARG 259.A NH2 ASP 293.A OD1 no hydrogen 3.104 N/A ARG 260.A NE SER 253.A OG no hydrogen 2.590 N/A ARG 260.A NH1 SER 253.A OG no hydrogen 2.567 N/A HIS 262.A N CYS 284.A O no hydrogen 2.926 N/A HIS 262.A NE2 SER 253.A OG no hydrogen 2.727 N/A ILE 264.A N HIS 262.A O no hydrogen 2.961 N/A SER 265.A N GLY 151.A O no hydrogen 2.976 N/A SER 265.A OG ASP 132.A OD1 no hydrogen 2.777 N/A THR 266.A N LEU 280.A O no hydrogen 3.047 N/A LEU 268.A N VAL 278.A O no hydrogen 3.136 N/A GLY 270.A N ILE 274.A O no hydrogen 2.973 N/A LEU 271.A N LEU 268.A O no hydrogen 2.930 N/A TYR 272.A OH VAL 295.A O no hydrogen 2.470 N/A ILE 274.A N LEU 271.A O no hydrogen 3.087 N/A VAL 278.A N GLU 276.A O no hydrogen 2.945 N/A LEU 280.A N THR 266.A O no hydrogen 3.226 N/A SER 281.A N GLY 182.A O no hydrogen 3.078 N/A VAL 282.A N ILE 264.A O no hydrogen 3.280 N/A CYS 284.A N HIS 262.A O no hydrogen 2.841 N/A CYS 284.A SG ILE 264.A O no hydrogen 3.615 N/A CYS 284.A SG VAL 282.A O no hydrogen 3.297 N/A VAL 285.A N ASP 293.A O no hydrogen 2.661 N/A LEU 286.A N ARG 260.A O no hydrogen 2.772 N/A GLY 287.A N GLY 290.A O no hydrogen 3.328 N/A GLN 288.A N ASN 257.A OD1 no hydrogen 2.809 N/A GLY 290.A N GLY 287.A O no hydrogen 3.050 N/A ILE 291.A N ASN 147.A O no hydrogen 2.880 N/A SER 292.A N VAL 285.A O no hydrogen 3.237 N/A SER 292.A OG ASP 293.A OD1 no hydrogen 2.685 N/A VAL 295.A N PRO 283.A O no hydrogen 2.681 N/A VAL 297.A N TYR 272.A OH no hydrogen 2.660 N/A THR 300.A N GLU 303.A OE2 no hydrogen 2.873 N/A GLU 303.A N THR 300.A OG1 no hydrogen 3.129 N/A GLU 304.A N THR 300.A O no hydrogen 2.835 N/A ALA 305.A N SER 301.A O no hydrogen 3.061 N/A HIS 306.A N GLU 302.A O no hydrogen 2.726 N/A HIS 306.A N GLU 303.A O no hydrogen 2.993 N/A LEU 307.A N GLU 303.A O no hydrogen 3.050 N/A LYS 308.A N GLU 304.A O no hydrogen 3.280 N/A LYS 309.A N ALA 305.A O no hydrogen 2.959 N/A SER 310.A N HIS 306.A O no hydrogen 2.992 N/A SER 310.A OG GLU 183.A OE1 no hydrogen 2.590 N/A ALA 311.A N LEU 307.A O no hydrogen 2.909 N/A ASP 312.A N LYS 308.A O no hydrogen 3.142 N/A THR 313.A N LYS 309.A O no hydrogen 3.015 N/A THR 313.A OG1 LYS 309.A O no hydrogen 2.665 N/A LEU 314.A N SER 310.A O no hydrogen 2.815 N/A TRP 315.A N ALA 311.A O no hydrogen 2.686 N/A GLY 316.A N ASP 312.A O no hydrogen 2.804 N/A ILE 317.A N THR 313.A O no hydrogen 3.297 N/A GLN 318.A N LEU 314.A O no hydrogen 3.019 N/A GLN 318.A NE2 ASP 277.A O no hydrogen 3.006 N/A LYS 319.A N TRP 315.A O no hydrogen 2.949 N/A GLU 320.A N ILE 317.A O no hydrogen 3.109 N/A GLN 322.A N GLN 102.A OE1 no hydrogen 2.949 N/A