Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vwx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N ASP 59.A OD1 no hydrogen 2.911 N/A VAL 3.A N GLU 57.A O no hydrogen 2.935 N/A LEU 4.A N GLU 28.A O no hydrogen 2.873 N/A TYR 5.A N THR 55.A O no hydrogen 2.876 N/A TYR 5.A OH GLU 57.A OE2 no hydrogen 2.733 N/A GLY 6.A N LYS 30.A O no hydrogen 3.096 N/A SER 10.A N ILE 7.A O no hydrogen 3.261 N/A VAL 13.A N SER 10.A OG no hydrogen 3.413 N/A ARG 14.A N SER 10.A O no hydrogen 3.044 N/A ARG 14.A NE ASP 8.A O no hydrogen 2.958 N/A ARG 14.A NH1 PRO 9.A O no hydrogen 2.836 N/A ARG 14.A NH1 SER 168.A OG no hydrogen 2.964 N/A ARG 14.A NH2 THR 164.A O no hydrogen 3.210 N/A ALA 15.A N PRO 11.A O no hydrogen 2.978 N/A CYS 16.A N PRO 12.A O no hydrogen 3.276 N/A CYS 16.A SG PRO 12.A O no hydrogen 3.589 N/A CYS 16.A SG SER 66.A O no hydrogen 4.020 N/A LEU 17.A N VAL 13.A O no hydrogen 2.859 N/A LEU 18.A N ARG 14.A O no hydrogen 2.791 N/A THR 19.A N ALA 15.A O no hydrogen 3.073 N/A THR 19.A OG1 ALA 15.A O no hydrogen 2.933 N/A LEU 20.A N CYS 16.A O no hydrogen 2.875 N/A LYS 21.A N LEU 17.A O no hydrogen 3.041 N/A LYS 21.A NZ GLU 198.A OE2 no hydrogen 3.456 N/A ALA 22.A N LEU 18.A O no hydrogen 2.936 N/A LEU 23.A N THR 19.A O no hydrogen 2.978 N/A ASN 24.A N LYS 21.A O no hydrogen 3.033 N/A LEU 25.A N LEU 20.A O no hydrogen 2.956 N/A GLU 28.A N LEU 2.A O no hydrogen 2.881 N/A TYR 29.A OH ASP 8.A OD1 no hydrogen 2.651 N/A LYS 30.A N LEU 4.A O no hydrogen 2.890 N/A VAL 32.A N GLY 6.A O no hydrogen 2.854 N/A ASN 33.A N GLU 38.A OE1 no hydrogen 2.892 N/A PHE 35.A N ASN 33.A OD1 no hydrogen 3.038 N/A ALA 36.A N ASN 33.A O no hydrogen 3.003 N/A LYS 37.A N LEU 34.A O no hydrogen 2.917 N/A GLU 38.A N ASN 33.A O no hydrogen 3.086 N/A HIS 39.A N HIS 39.A ND1 no hydrogen 2.888 N/A LEU 40.A N LYS 37.A O no hydrogen 3.125 N/A TYR 44.A N SER 41.A OG no hydrogen 3.080 N/A TYR 44.A OH THR 52.A O no hydrogen 2.638 N/A LEU 45.A N SER 41.A O no hydrogen 3.005 N/A LYS 46.A N GLU 42.A O no hydrogen 3.137 N/A ASN 48.A N TYR 44.A O no hydrogen 2.796 N/A ASN 48.A ND2 THR 52.A OG1 no hydrogen 3.087 N/A ASN 48.A ND2 THR 55.A OG1 no hydrogen 3.260 N/A GLN 50.A N ASN 48.A OD1 no hydrogen 2.905 N/A HIS 51.A N ASN 48.A O no hydrogen 2.828 N/A HIS 51.A ND1 HIS 51.A O no hydrogen 2.833 N/A THR 55.A N TYR 5.A O no hydrogen 3.305 N/A THR 55.A OG1 TYR 44.A OH no hydrogen 2.762 N/A THR 55.A OG1 THR 52.A O no hydrogen 3.551 N/A LEU 56.A N ILE 63.A O no hydrogen 2.768 N/A GLU 57.A N VAL 3.A O no hydrogen 2.774 N/A GLU 58.A N HIS 61.A O no hydrogen 2.820 N/A ASP 59.A N LYS 1.A O no hydrogen 3.123 N/A HIS 61.A N GLU 58.A O no hydrogen 2.769 N/A ILE 63.A N LEU 56.A O no hydrogen 2.807 N/A TRP 64.A NE1 GLN 50.A OE1 no hydrogen 2.878 N/A HIS 67.A N ASP 65.A OD2 no hydrogen 3.050 N/A HIS 67.A ND1 ASP 65.A OD2 no hydrogen 2.790 N/A HIS 67.A NE2 GLU 101.A OE1 no hydrogen 2.684 N/A ILE 69.A N ASP 65.A O no hydrogen 2.877 N/A MET 70.A N SER 66.A O no hydrogen 2.791 N/A ALA 71.A N HIS 67.A O no hydrogen 3.095 N/A TYR 72.A N ALA 68.A O no hydrogen 2.955 N/A TYR 72.A OH GLU 58.A OE1 no hydrogen 3.426 N/A TYR 72.A OH GLU 58.A OE2 no hydrogen 2.419 N/A LEU 73.A N ILE 69.A O no hydrogen 2.829 N/A VAL 74.A N MET 70.A O no hydrogen 3.093 N/A SER 75.A N ALA 71.A O no hydrogen 2.945 N/A SER 75.A OG ALA 71.A O no hydrogen 2.884 N/A LYS 76.A N TYR 72.A O no hydrogen 2.810 N/A LYS 76.A NZ GLU 58.A OE1 no hydrogen 3.265 N/A LYS 76.A NZ GLU 58.A OE2 no hydrogen 3.559 N/A TYR 77.A N LEU 73.A O no hydrogen 2.778 N/A TYR 77.A OH GLU 58.A OE1 no hydrogen 2.436 N/A GLY 78.A N VAL 74.A O no hydrogen 2.829 N/A SER 82.A N ASP 80.A OD2 no hydrogen 3.104 N/A SER 82.A OG ASP 80.A OD2 no hydrogen 3.335 N/A TYR 84.A N ASP 81.A O no hydrogen 2.941 N/A TYR 84.A OH ASP 95.A OD1 no hydrogen 2.583 N/A LYS 86.A N ASP 81.A OD1 no hydrogen 2.852 N/A LYS 90.A N ASP 87.A OD2 no hydrogen 2.848 N/A ARG 91.A N ASP 87.A O no hydrogen 2.711 N/A ARG 91.A NE PRO 85.A O no hydrogen 2.913 N/A ARG 91.A NH2 TYR 84.A O no hydrogen 3.143 N/A ARG 91.A NH2 PRO 85.A O no hydrogen 3.405 N/A ALA 92.A N LEU 88.A O no hydrogen 2.890 N/A VAL 93.A N LEU 89.A O no hydrogen 3.362 N/A VAL 93.A N LYS 90.A O no hydrogen 3.145 N/A VAL 94.A N LYS 90.A O no hydrogen 3.262 N/A ASP 95.A N ARG 91.A O no hydrogen 2.799 N/A GLN 96.A N ALA 92.A O no hydrogen 2.980 N/A ARG 97.A N VAL 93.A O no hydrogen 2.969 N/A ARG 97.A NE MET 150.A O no hydrogen 2.562 N/A ARG 97.A NH2 MET 150.A O no hydrogen 3.034 N/A MET 98.A N VAL 94.A O no hydrogen 3.003 N/A TYR 99.A N ASP 95.A O no hydrogen 2.869 N/A PHE 100.A N GLN 96.A O no hydrogen 2.862 N/A GLU 101.A N ARG 97.A O no hydrogen 2.997 N/A ALA 102.A N MET 98.A O no hydrogen 2.875 N/A GLY 103.A N TYR 99.A O no hydrogen 3.001 N/A VAL 104.A N PHE 100.A O no hydrogen 2.869 N/A LEU 105.A N PHE 100.A O no hydrogen 3.304 N/A PHE 106.A N GLU 101.A O no hydrogen 2.678 N/A GLN 107.A N ALA 102.A O no hydrogen 3.194 N/A GLY 108.A N GLY 103.A O no hydrogen 2.822 N/A GLY 109.A N LEU 105.A O no hydrogen 3.140 N/A LEU 110.A N LEU 105.A O no hydrogen 2.927 N/A ARG 111.A N PHE 106.A O no hydrogen 2.790 N/A ASN 112.A N GLN 107.A O no hydrogen 2.980 N/A ASN 112.A ND2 GLN 129.A OE1 no hydrogen 2.533 N/A ILE 113.A N LEU 110.A O no hydrogen 2.977 N/A THR 114.A N LEU 110.A O no hydrogen 2.840 N/A THR 114.A OG1 LEU 110.A O no hydrogen 3.338 N/A ALA 115.A N ARG 111.A O no hydrogen 2.983 N/A LEU 117.A N ILE 113.A O no hydrogen 3.013 N/A PHE 118.A N THR 114.A O no hydrogen 2.833 N/A PHE 119.A N ALA 115.A O no hydrogen 2.803 N/A ARG 120.A N PRO 116.A O no hydrogen 2.910 N/A GLN 122.A N PRO 116.A O no hydrogen 3.014 N/A ILE 125.A N THR 217.A O no hydrogen 2.903 N/A GLN 129.A N PRO 126.A O no hydrogen 2.668 N/A GLN 129.A NE2 GLY 108.A O no hydrogen 3.017 N/A GLN 129.A NE2 GLY 109.A O no hydrogen 2.790 N/A ASP 131.A N GLN 127.A O no hydrogen 2.934 N/A SER 132.A N HIS 128.A O no hydrogen 3.134 N/A ILE 133.A N GLN 129.A O no hydrogen 3.051 N/A VAL 134.A N ILE 130.A O no hydrogen 2.991 N/A GLU 135.A N ASP 131.A O no hydrogen 2.840 N/A SER 136.A N SER 132.A O no hydrogen 2.926 N/A SER 136.A OG SER 132.A O no hydrogen 3.129 N/A TYR 137.A N ILE 133.A O no hydrogen 2.987 N/A TYR 137.A OH ALA 173.A O no hydrogen 2.718 N/A GLY 138.A N VAL 134.A O no hydrogen 3.121 N/A PHE 139.A N GLU 135.A O no hydrogen 3.004 N/A LEU 140.A N SER 136.A O no hydrogen 2.980 N/A GLU 141.A N TYR 137.A O no hydrogen 2.775 N/A SER 142.A N GLY 138.A O no hydrogen 3.011 N/A SER 142.A OG GLY 138.A O no hydrogen 3.332 N/A PHE 143.A N PHE 139.A O no hydrogen 2.918 N/A LEU 144.A N LEU 140.A O no hydrogen 3.081 N/A LYS 145.A N SER 142.A O no hydrogen 3.054 N/A ASN 147.A N LEU 144.A O no hydrogen 3.504 N/A LYS 148.A NZ ASP 153.A OD1 no hydrogen 2.435 N/A TYR 149.A N GLY 152.A O no hydrogen 3.129 N/A TYR 149.A OH SER 189.A OG no hydrogen 3.349 N/A MET 150.A N ASP 159.A OD1 no hydrogen 2.756 N/A GLY 152.A N TYR 149.A O no hydrogen 3.452 N/A THR 156.A N ASP 159.A OD2 no hydrogen 2.886 N/A ILE 157.A N LEU 83.A O no hydrogen 2.910 N/A ALA 158.A N THR 156.A OG1 no hydrogen 3.274 N/A PHE 160.A N THR 156.A O no hydrogen 3.410 N/A SER 161.A N ILE 157.A O no hydrogen 2.863 N/A SER 161.A OG HIS 67.A NE2 no hydrogen 3.177 N/A ILE 162.A N ALA 158.A O no hydrogen 3.058 N/A VAL 163.A N ASP 159.A O no hydrogen 2.880 N/A THR 164.A N PHE 160.A O no hydrogen 3.410 N/A THR 164.A OG1 PRO 11.A O no hydrogen 3.216 N/A THR 164.A OG1 SER 161.A O no hydrogen 2.713 N/A SER 165.A OG GLU 101.A OE2 no hydrogen 2.595 N/A VAL 166.A N ILE 162.A O no hydrogen 2.894 N/A THR 167.A N VAL 163.A O no hydrogen 2.947 N/A THR 167.A OG1 VAL 163.A O no hydrogen 2.767 N/A THR 167.A OG1 THR 164.A O no hydrogen 3.338 N/A THR 167.A OG1 ASN 200.A OD1 no hydrogen 3.068 N/A SER 168.A N SER 165.A O no hydrogen 2.978 N/A SER 168.A OG THR 164.A O no hydrogen 2.778 N/A LEU 169.A N SER 165.A O no hydrogen 2.810 N/A VAL 170.A N VAL 166.A O no hydrogen 2.946 N/A ALA 171.A N SER 168.A O no hydrogen 3.047 N/A PHE 172.A N LEU 169.A O no hydrogen 2.811 N/A ALA 173.A N LEU 169.A O no hydrogen 2.927 N/A SER 178.A N ASP 176.A OD2 no hydrogen 2.919 N/A SER 178.A OG ASP 176.A OD2 no hydrogen 2.701 N/A LYS 179.A N ASP 176.A O no hydrogen 3.027 N/A PHE 180.A N ASP 176.A O no hydrogen 2.890 N/A LYS 182.A N GLU 141.A OE1 no hydrogen 2.785 N/A LYS 182.A NZ LYS 145.A O no hydrogen 3.324 N/A LEU 183.A N GLU 141.A OE2 no hydrogen 2.844 N/A SER 184.A N PHE 180.A O no hydrogen 3.031 N/A SER 184.A OG PHE 180.A O no hydrogen 2.989 N/A ALA 185.A N PRO 181.A O no hydrogen 3.001 N/A TRP 186.A N LYS 182.A O no hydrogen 2.907 N/A TRP 186.A NE1 ASP 159.A OD1 no hydrogen 2.885 N/A LEU 187.A N LEU 183.A O no hydrogen 2.920 N/A LYS 188.A N SER 184.A O no hydrogen 3.286 N/A SER 189.A N ALA 185.A O no hydrogen 3.067 N/A SER 189.A OG TYR 149.A OH no hydrogen 3.349 N/A LEU 190.A N TRP 186.A O no hydrogen 3.121 N/A LEU 190.A N LEU 187.A O no hydrogen 3.218 N/A GLN 191.A N LEU 187.A O no hydrogen 2.800 N/A SER 192.A OG SER 189.A O no hydrogen 3.116 N/A LEU 193.A N LEU 190.A O no hydrogen 3.021 N/A TYR 196.A N LEU 193.A O no hydrogen 3.087 N/A ALA 199.A N PHE 195.A O no hydrogen 3.166 N/A ASN 200.A N TYR 196.A O no hydrogen 2.804 N/A GLY 201.A N TYR 196.A O no hydrogen 2.996 N/A ALA 202.A N GLU 197.A O no hydrogen 3.054 N/A ALA 204.A N ASN 200.A O no hydrogen 2.942 N/A LYS 205.A N GLY 201.A O no hydrogen 2.846 N/A LYS 205.A NZ GLU 197.A OE1 no hydrogen 2.667 N/A LYS 205.A NZ GLU 197.A OE2 no hydrogen 3.540 N/A GLN 206.A N ALA 202.A O no hydrogen 3.069 N/A GLN 206.A NE2 ASP 8.A OD2 no hydrogen 3.419 N/A GLN 206.A NE2 ALA 202.A O no hydrogen 3.663 N/A LEU 207.A N GLY 203.A O no hydrogen 2.956 N/A VAL 208.A N ALA 204.A O no hydrogen 3.015 N/A ALA 209.A N LYS 205.A O no hydrogen 2.968 N/A MET 210.A N GLN 206.A O no hydrogen 2.957 N/A VAL 211.A N LEU 207.A O no hydrogen 2.837 N/A LYS 212.A N VAL 208.A O no hydrogen 2.810 N/A SER 213.A N ALA 209.A O no hydrogen 3.022 N/A SER 213.A OG ALA 209.A O no hydrogen 3.491 N/A SER 213.A OG MET 210.A O no hydrogen 2.744 N/A LYS 214.A N VAL 211.A O no hydrogen 3.213 N/A ASN 215.A N LYS 212.A O no hydrogen 3.085 N/A THR 217.A N THR 123.A O no hydrogen 2.941 N/A