Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3v0e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N ASP 4.A OD2 no hydrogen 2.721 N/A ASP 9.A N SER 21.A O no hydrogen 2.743 N/A THR 11.A N ALA 19.A O no hydrogen 2.884 N/A VAL 13.A N VAL 17.A O no hydrogen 2.811 N/A THR 14.A N VAL 17.A O no hydrogen 3.219 N/A HIS 16.A N THR 14.A OG1 no hydrogen 3.088 N/A VAL 17.A N THR 14.A O no hydrogen 3.370 N/A ILE 18.A N ILE 105.A O no hydrogen 2.820 N/A ALA 19.A N THR 11.A O no hydrogen 2.854 N/A MET 20.A N ILE 107.A O no hydrogen 2.901 N/A SER 21.A N ASP 9.A O no hydrogen 2.965 N/A SER 21.A OG.A SER 109.A O no hydrogen 3.551 N/A SER 21.A OG.A LYS 110.A O no hydrogen 2.975 N/A SER 29.A OG ASP 4.A OD1 no hydrogen 3.487 N/A SER 29.A OG ASP 4.A OD2 no hydrogen 2.709 N/A SER 29.A OG SER 25.A O no hydrogen 3.286 N/A LEU 30.A N ASP 4.A OD1 no hydrogen 2.917 N/A PHE 31.A N SER 29.A OG no hydrogen 3.207 N/A GLU 37.A N PRO 34.A O no hydrogen 3.187 N/A VAL 38.A N PRO 34.A O no hydrogen 3.027 N/A SER 39.A N ILE 35.A O no hydrogen 2.822 N/A SER 39.A OG ASP 67.A OD1 no hydrogen 3.004 N/A ARG 40.A N GLY 36.A O no hydrogen 3.050 N/A PHE 41.A N GLU 37.A O no hydrogen 2.975 N/A PHE 42.A N VAL 38.A O no hydrogen 3.098 N/A LYS 43.A N SER 39.A O no hydrogen 3.022 N/A LYS 43.A NZ ASP 67.A OD1 no hydrogen 3.438 N/A LYS 43.A NZ ASP 67.A OD2 no hydrogen 3.112 N/A THR 44.A N ARG 40.A O no hydrogen 3.184 N/A THR 44.A OG1 ARG 40.A O no hydrogen 2.719 N/A LYS 45.A N PHE 41.A O no hydrogen 2.859 N/A HIS 46.A N PHE 42.A O no hydrogen 3.013 N/A LYS 49.A NZ ASP 102.A O no hydrogen 2.736 N/A ARG 51.A N VAL 104.A O no hydrogen 3.014 N/A ARG 51.A NE ASP 92.A OD1 no hydrogen 2.698 N/A ARG 51.A NH2 ASP 92.A OD1 no hydrogen 3.568 N/A ARG 51.A NH2 ASP 92.A OD2 no hydrogen 3.107 N/A ILE 52.A N HIS 69.A O no hydrogen 3.253 N/A TYR 53.A N ALA 106.A O no hydrogen 2.816 N/A TYR 53.A OH ASP 92.A OD1 no hydrogen 2.677 N/A ASN 54.A N TYR 71.A O no hydrogen 2.861 N/A LEU 55.A N HIS 108.A O no hydrogen 2.916 N/A CYS 56.A N VAL 73.A O no hydrogen 2.994 N/A CYS 56.A SG ASN 54.A O no hydrogen 3.938 N/A GLU 58.A N ASP 76.A OD1 no hydrogen 3.183 N/A ARG 59.A NH1 ASP 76.A OD1 no hydrogen 2.789 N/A GLY 60.A N SER 57.A OG no hydrogen 3.053 N/A TYR 61.A N SER 57.A O no hydrogen 2.838 N/A ASP 62.A N ARG 59.A O no hydrogen 3.417 N/A GLU 63.A N GLY 60.A O no hydrogen 3.321 N/A THR 64.A N TYR 61.A O no hydrogen 3.244 N/A THR 64.A OG1 TYR 61.A O no hydrogen 2.590 N/A HIS 69.A N ASP 67.A OD2 no hydrogen 2.989 N/A VAL 70.A N ASP 67.A O no hydrogen 3.228 N/A TYR 71.A N ILE 52.A O no hydrogen 2.842 N/A ARG 72.A NH1 THR 64.A OG1 no hydrogen 2.844 N/A VAL 73.A N ASN 54.A O no hydrogen 2.910 N/A ILE 75.A N CYS 56.A O no hydrogen 2.879 N/A ASN 79.A N ASP 76.A O no hydrogen 2.981 N/A ASN 79.A ND2 ASP 77.A O no hydrogen 2.895 N/A ASN 79.A ND2 ASP 269.A OD1 no hydrogen 3.168 N/A LEU 83.A N ASP 252.A OD1 no hydrogen 3.171 N/A LEU 83.A N ASP 252.A OD2 no hydrogen 3.416 N/A ASP 85.A N THR 82.A OG1 no hydrogen 3.051 N/A LEU 86.A N THR 82.A O no hydrogen 2.914 N/A LEU 87.A N LEU 83.A O no hydrogen 2.993 N/A LYS 88.A N VAL 84.A O no hydrogen 2.944 N/A PHE 89.A N ASP 85.A O no hydrogen 2.966 N/A ILE 90.A N LEU 86.A O no hydrogen 3.018 N/A ASP 91.A N LEU 87.A O no hydrogen 3.002 N/A ASP 92.A N LYS 88.A O no hydrogen 3.039 N/A ALA 93.A N PHE 89.A O no hydrogen 2.876 N/A LYS 94.A N ILE 90.A O no hydrogen 2.882 N/A LYS 94.A NZ GLU 126.A OE1 no hydrogen 2.689 N/A VAL 95.A N ASP 91.A O no hydrogen 3.083 N/A TRP 96.A N ASP 92.A O no hydrogen 3.081 N/A TRP 96.A NE1 VAL 104.A O no hydrogen 3.047 N/A MET 97.A N ALA 93.A O no hydrogen 2.818 N/A THR 98.A N LYS 94.A O no hydrogen 2.977 N/A THR 98.A OG1.A LYS 94.A O no hydrogen 2.540 N/A THR 98.A OG1.B LYS 94.A O no hydrogen 2.871 N/A THR 98.A OG1.B VAL 95.A O no hydrogen 3.459 N/A SER 99.A N VAL 95.A O no hydrogen 3.199 N/A SER 99.A OG VAL 95.A O no hydrogen 3.404 N/A SER 99.A OG TRP 96.A O no hydrogen 3.198 N/A SER 99.A OG HIS 103.A ND1 no hydrogen 3.157 N/A ASP 102.A N ASP 100.A OD2 no hydrogen 2.980 N/A HIS 103.A N ASP 100.A O no hydrogen 2.971 N/A HIS 103.A ND1 TRP 96.A O no hydrogen 2.747 N/A VAL 104.A N LYS 49.A O no hydrogen 2.822 N/A ILE 105.A N HIS 16.A O no hydrogen 3.022 N/A ALA 106.A N ARG 51.A O no hydrogen 2.844 N/A ILE 107.A N ILE 18.A O no hydrogen 2.800 N/A HIS 108.A N TYR 53.A O no hydrogen 2.819 N/A SER 109.A OG THR 116.A OG1 no hydrogen 2.618 N/A LYS 110.A NZ ASP 77.A OD1 no hydrogen 3.343 N/A GLY 112.A N SER 109.A O no hydrogen 3.308 N/A LYS 113.A NZ PHE 153.A O no hydrogen 3.297 N/A ARG 115.A NH1 ILE 75.A O no hydrogen 2.933 N/A THR 116.A OG1 SER 109.A OG no hydrogen 2.618 N/A GLY 117.A N LYS 113.A O no hydrogen 2.665 N/A THR 118.A N GLY 114.A O no hydrogen 3.033 N/A THR 118.A OG1 GLY 114.A O no hydrogen 2.802 N/A LEU 119.A N ARG 115.A O no hydrogen 3.370 N/A VAL 120.A N THR 116.A O no hydrogen 2.806 N/A SER 121.A N GLY 117.A O no hydrogen 2.940 N/A SER 121.A OG GLY 117.A O no hydrogen 2.815 N/A SER 122.A N THR 118.A O no hydrogen 3.194 N/A SER 122.A OG THR 118.A O no hydrogen 2.883 N/A TRP 123.A N LEU 119.A O no hydrogen 2.907 N/A LEU 124.A N VAL 120.A O no hydrogen 2.926 N/A LEU 125.A N SER 121.A O no hydrogen 3.146 N/A GLU 126.A N SER 122.A O no hydrogen 2.943 N/A ASP 127.A N TRP 123.A O no hydrogen 2.890 N/A GLY 128.A N LEU 125.A O no hydrogen 3.078 N/A LYS 129.A N LEU 124.A O no hydrogen 3.080 N/A LYS 129.A NZ ASP 127.A OD2 no hydrogen 2.740 N/A THR 132.A OG1 GLU 135.A OE1 no hydrogen 3.087 N/A ALA 133.A N GLU 169.A OE1 no hydrogen 2.783 N/A GLU 135.A N THR 132.A OG1 no hydrogen 3.206 N/A ALA 136.A N THR 132.A O no hydrogen 3.149 N/A LEU 137.A N ALA 133.A O no hydrogen 2.869 N/A GLU 138.A N LYS 134.A O no hydrogen 2.958 N/A TYR 139.A N GLU 135.A O no hydrogen 2.980 N/A TYR 139.A OH VAL 13.A O no hydrogen 2.680 N/A PHE 140.A N ALA 136.A O no hydrogen 2.967 N/A GLY 141.A N LEU 137.A O no hydrogen 2.925 N/A SER 142.A N GLU 138.A O no hydrogen 2.921 N/A SER 142.A OG TYR 139.A O no hydrogen 2.616 N/A ARG 143.A N TYR 139.A O no hydrogen 3.008 N/A ARG 143.A NE TYR 12.A O no hydrogen 2.987 N/A ARG 143.A NH2 TYR 12.A O no hydrogen 2.795 N/A ARG 144.A N PHE 140.A O no hydrogen 2.891 N/A ARG 144.A NE GLY 112.A O no hydrogen 3.406 N/A ARG 144.A NH1 GLN 154.A O no hydrogen 2.850 N/A THR 145.A N GLY 141.A O no hydrogen 3.054 N/A THR 145.A OG1 GLY 141.A O no hydrogen 2.812 N/A PHE 147.A N THR 145.A OG1 no hydrogen 3.282 N/A PHE 153.A N ASP 151.A OD2 no hydrogen 2.934 N/A GLN 154.A N ASP 151.A O no hydrogen 2.951 N/A GLN 154.A NE2 VAL 149.A O no hydrogen 2.804 N/A GLY 155.A N VAL 152.A O no hydrogen 3.047 N/A VAL 156.A N VAL 152.A O no hydrogen 3.068 N/A GLU 157.A N GLN 161.A OE1 no hydrogen 2.847 N/A THR 158.A N GLN 161.A OE1 no hydrogen 3.021 N/A SER 160.A N ASP 295.A OD2 no hydrogen 2.857 N/A SER 160.A OG ASP 295.A OD1 no hydrogen 2.630 N/A SER 160.A OG ASP 295.A OD2 no hydrogen 3.469 N/A GLN 161.A N THR 158.A OG1 no hydrogen 3.095 N/A GLN 161.A NE2 ASN 79.A O no hydrogen 3.052 N/A ILE 162.A N THR 158.A O no hydrogen 3.210 N/A ARG 163.A N ALA 159.A O no hydrogen 2.841 N/A ARG 163.A NH1 TRP 276.A O no hydrogen 3.059 N/A ARG 163.A NH2 GLU 293.A O no hydrogen 2.799 N/A TYR 164.A N SER 160.A O no hydrogen 2.859 N/A TYR 164.A OH ASP 252.A OD2 no hydrogen 2.783 N/A VAL 165.A N GLN 161.A O no hydrogen 3.176 N/A GLY 166.A N ILE 162.A O no hydrogen 3.049 N/A TYR 167.A N ARG 163.A O no hydrogen 2.761 N/A PHE 168.A N TYR 164.A O no hydrogen 3.004 N/A GLU 169.A N VAL 165.A O no hydrogen 2.970 N/A LYS 170.A N GLY 166.A O no hydrogen 2.969 N/A ILE 171.A N TYR 167.A O no hydrogen 2.910 N/A LYS 172.A N PHE 168.A O no hydrogen 2.848 N/A LYS 172.A NZ GLU 126.A O no hydrogen 3.349 N/A LYS 172.A NZ GLU 126.A OE2 no hydrogen 3.145 N/A LYS 173.A N GLU 169.A O no hydrogen 2.967 N/A LYS 173.A NZ ASP 131.A O no hydrogen 3.162 N/A LYS 173.A NZ GLU 169.A OE2 no hydrogen 2.772 N/A ASN 174.A N LYS 170.A O no hydrogen 2.750 N/A TYR 175.A N ILE 171.A O no hydrogen 3.007 N/A GLY 177.A N ILE 171.A O no hydrogen 2.951 N/A GLN 178.A N TYR 175.A O no hydrogen 2.947 N/A LYS 183.A NZ VAL 282.A O no hydrogen 2.848 N/A LEU 185.A N LEU 249.A O no hydrogen 2.905 N/A LYS 186.A N SER 317.A O no hydrogen 2.990 N/A THR 188.A N THR 315.A O no hydrogen 2.814 N/A THR 188.A OG1 THR 315.A O no hydrogen 3.343 N/A GLY 189.A N THR 315.A O no hydrogen 3.378 N/A VAL 190.A N CYS 241.A O no hydrogen 2.972 N/A THR 191.A N LYS 313.A O no hydrogen 2.851 N/A ILE 192.A N VAL 239.A O no hydrogen 2.830 N/A THR 193.A N THR 311.A O no hydrogen 3.014 N/A THR 193.A OG1 ASN 309.A O no hydrogen 2.715 N/A THR 193.A OG1 THR 311.A O no hydrogen 3.569 N/A THR 193.A OG1 THR 311.A OG1 no hydrogen 2.584 N/A ILE 195.A N ASP 237.A O no hydrogen 3.269 N/A GLN 196.A N ASP 237.A OD2 no hydrogen 2.854 N/A VAL 198.A N ILE 195.A O no hydrogen 2.931 N/A ARG 200.A N ASP 205.A OD1 no hydrogen 3.015 N/A ARG 200.A NH1 SER 204.A OG no hydrogen 3.312 N/A GLY 201.A N VAL 198.A O no hydrogen 2.915 N/A SER 204.A N ASN 202.A OD1 no hydrogen 2.960 N/A SER 204.A OG ASN 202.A OD1 no hydrogen 2.791 N/A LEU 206.A N GLY 203.A O no hydrogen 3.146 N/A SER 207.A N MET 258.A O no hydrogen 2.934 N/A MET 208.A N CYS 220.A O no hydrogen 2.789 N/A GLN 209.A N ARG 256.A O no hydrogen 2.753 N/A GLN 209.A NE2 GLU 216.A OE2 no hydrogen 2.712 N/A ILE 210.A N LEU 218.A O no hydrogen 2.835 N/A VAL 211.A N LYS 254.A O no hydrogen 2.808 N/A SER 212.A N GLN 215.A O no hydrogen 2.790 N/A GLU 213.A N ASP 252.A O no hydrogen 3.149 N/A ARG 214.A NH2 MET 74.A O no hydrogen 3.401 N/A GLN 215.A N SER 212.A O no hydrogen 3.095 N/A VAL 217.A N ILE 210.A O no hydrogen 2.844 N/A LEU 218.A N ILE 210.A O no hydrogen 3.346 N/A CYS 220.A N MET 208.A O no hydrogen 2.804 N/A CYS 220.A SG ASN 227.A O no hydrogen 3.458 N/A LYS 221.A N TYR 226.A O no hydrogen 3.085 N/A PHE 222.A N LEU 206.A O no hydrogen 3.052 N/A GLU 224.A N GLU 224.A OE1 no hydrogen 2.723 N/A GLY 225.A N PHE 222.A O no hydrogen 3.349 N/A TYR 226.A N LYS 221.A O no hydrogen 3.130 N/A ASN 227.A ND2 LEU 219.A O no hydrogen 2.926 N/A CYS 228.A SG LYS 221.A O no hydrogen 3.214 N/A CYS 228.A SG TYR 226.A O no hydrogen 3.464 N/A ALA 229.A N GLU 242.A O no hydrogen 2.973 N/A GLN 231.A N THR 240.A O no hydrogen 2.767 N/A ASP 233.A N CYS 238.A O no hydrogen 2.856 N/A THR 235.A OG1 ASP 233.A OD2 no hydrogen 2.627 N/A ASP 236.A N ASP 233.A OD2 no hydrogen 3.388 N/A ASP 237.A N ALA 234.A O no hydrogen 3.208 N/A CYS 238.A N ASP 233.A O no hydrogen 3.145 N/A CYS 238.A SG.B ILE 192.A O no hydrogen 3.390 N/A CYS 238.A SG.B VAL 239.A O no hydrogen 3.534 N/A VAL 239.A N ILE 192.A O no hydrogen 2.911 N/A THR 240.A N GLN 231.A O no hydrogen 2.870 N/A CYS 241.A N VAL 190.A O no hydrogen 2.773 N/A GLU 242.A N ALA 229.A O no hydrogen 2.918 N/A VAL 243.A N THR 188.A O no hydrogen 2.919 N/A LYS 244.A N ASN 227.A O no hydrogen 2.935 N/A CYS 246.A SG PRO 247.A O no hydrogen 3.315 N/A LEU 249.A N LEU 185.A O no hydrogen 2.703 N/A GLY 251.A N THR 279.A OG1 no hydrogen 2.868 N/A ILE 253.A N PHE 277.A O no hydrogen 2.820 N/A LYS 254.A N VAL 211.A O no hydrogen 2.922 N/A LYS 254.A NZ ASN 79.A OD1 no hydrogen 3.170 N/A LYS 254.A NZ ASP 269.A OD1 no hydrogen 2.897 N/A LYS 254.A NZ ASP 269.A OD2 no hydrogen 2.924 N/A VAL 255.A N PHE 275.A O no hydrogen 2.814 N/A ARG 256.A N GLN 209.A O no hydrogen 2.930 N/A ARG 256.A NE ASP 269.A OD2 no hydrogen 2.851 N/A ARG 256.A NH1 GLN 209.A OE1 no hydrogen 2.828 N/A ARG 256.A NH2 ASP 269.A O no hydrogen 2.835 N/A PHE 257.A N PHE 273.A O no hydrogen 2.887 N/A MET 258.A N SER 207.A O no hydrogen 2.895 N/A SER 259.A OG ASP 205.A OD2 no hydrogen 2.619 N/A THR 260.A N ASP 205.A O no hydrogen 3.072 N/A THR 260.A OG1 ASP 205.A O no hydrogen 3.514 N/A SER 261.A N SER 259.A OG no hydrogen 2.915 N/A SER 263.A OG.B SER 261.A OG.B no hydrogen 2.736 N/A LEU 264.A N SER 261.A O no hydrogen 3.317 N/A ARG 266.A NH1 ASN 270.A OD1 no hydrogen 2.860 N/A GLY 267.A N CYS 271.A O no hydrogen 2.940 N/A TYR 268.A N ASN 296.A OD1 no hydrogen 2.887 N/A CYS 271.A SG ASP 269.A O no hydrogen 3.804 N/A CYS 271.A SG PHE 273.A O no hydrogen 3.713 N/A TYR 274.A N ASP 295.A O no hydrogen 3.172 N/A TYR 274.A OH HIS 78.A O no hydrogen 2.716 N/A PHE 275.A N VAL 255.A O no hydrogen 2.910 N/A TRP 276.A N SER 160.A OG no hydrogen 2.883 N/A TRP 276.A NE1 ASN 79.A OD1 no hydrogen 2.723 N/A PHE 277.A N ILE 253.A O no hydrogen 2.906 N/A ASN 278.A N TYR 167.A OH no hydrogen 2.999 N/A ASN 278.A ND2 ASP 252.A OD2 no hydrogen 2.872 N/A THR 279.A N GLY 251.A O no hydrogen 3.000 N/A THR 279.A OG1 LYS 183.A O no hydrogen 2.609 N/A SER 280.A N ASN 278.A OD1 no hydrogen 2.941 N/A SER 280.A OG.A PRO 181.A O no hydrogen 2.906 N/A SER 280.A OG.A ASN 278.A OD1 no hydrogen 3.451 N/A SER 280.A OG.B ASN 278.A OD1 no hydrogen 2.585 N/A LEU 281.A N ASN 278.A O no hydrogen 3.058 N/A VAL 282.A N THR 279.A O no hydrogen 3.260 N/A HIS 286.A ND1 ASP 285.A OD1 no hydrogen 2.941 N/A VAL 287.A N LEU 314.A O no hydrogen 3.003 N/A LEU 289.A N VAL 312.A O no hydrogen 2.861 N/A LYS 290.A N GLU 293.A OE2 no hydrogen 2.896 N/A ARG 291.A NH1 TYR 306.A O no hydrogen 2.853 N/A GLU 293.A N LYS 290.A O no hydrogen 2.879 N/A ILE 294.A N ARG 291.A O no hydrogen 3.282 N/A ASP 295.A N TYR 274.A O no hydrogen 2.888 N/A ASN 296.A N HIS 298.A ND1 no hydrogen 2.924 N/A ASN 296.A ND2 TYR 268.A O no hydrogen 3.108 N/A ASN 296.A ND2 PRO 272.A O no hydrogen 3.088 N/A LYS 299.A N ASN 296.A O no hydrogen 3.219 N/A LYS 299.A NZ TYR 268.A OH no hydrogen 3.152 N/A THR 302.A N LYS 299.A O no hydrogen 3.035 N/A THR 302.A OG1 ASN 296.A O no hydrogen 3.539 N/A THR 302.A OG1 LYS 299.A O no hydrogen 2.809 N/A TRP 303.A N LYS 300.A O no hydrogen 3.044 N/A TRP 303.A NE1 PRO 297.A O no hydrogen 2.862 N/A ILE 305.A N THR 302.A O no hydrogen 2.925 N/A TYR 306.A N THR 302.A O no hydrogen 2.899 N/A ARG 307.A NE GLN 196.A O no hydrogen 3.455 N/A ARG 307.A NH2 GLN 196.A O no hydrogen 3.020 N/A ARG 307.A NH2 ASP 237.A OD1 no hydrogen 2.832 N/A PHE 310.A N ARG 307.A O no hydrogen 2.973 N/A THR 311.A OG1 THR 193.A OG1 no hydrogen 2.584 N/A VAL 312.A N LEU 289.A O no hydrogen 3.053 N/A LYS 313.A N THR 191.A O no hydrogen 2.824 N/A LEU 314.A N VAL 287.A O no hydrogen 2.931 N/A THR 315.A N GLY 189.A O no hydrogen 2.884 N/A PHE 316.A N ASP 285.A O no hydrogen 2.752 N/A SER 317.A N LYS 186.A O no hydrogen 2.853 N/A ALA 319.A N LYS 184.A O no hydrogen 3.078 N/A