Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4w6j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N GLU 6.A OE2 no hydrogen 3.060 N/A GLY 4.A N MET 85.A O no hydrogen 2.979 N/A GLU 6.A N LYS 3.A O no hydrogen 2.997 N/A LEU 7.A N GLY 4.A O no hydrogen 3.024 N/A PHE 8.A N GLU 5.A O no hydrogen 3.018 N/A VAL 12.A N GLY 35.A O no hydrogen 2.893 N/A ILE 14.A N GLY 33.A O no hydrogen 2.881 N/A LEU 15.A N LEU 116.A O no hydrogen 2.963 N/A ILE 16.A N GLY 31.A O no hydrogen 2.856 N/A GLU 17.A N ASN 118.A O no hydrogen 2.929 N/A LEU 18.A N VAL 29.A O no hydrogen 2.833 N/A ASP 19.A N ILE 120.A O no hydrogen 2.915 N/A GLY 20.A N PHE 27.A O no hydrogen 2.867 N/A ASP 21.A N LEU 122.A O no hydrogen 3.099 N/A VAL 22.A N HIS 25.A O no hydrogen 3.081 N/A ASN 23.A N GLY 124.A O no hydrogen 2.906 N/A ASN 23.A ND2 PHE 127.A O no hydrogen 2.951 N/A GLY 24.A N ASP 21.A OD1 no hydrogen 2.866 N/A HIS 25.A N VAL 22.A O no hydrogen 2.869 N/A LYS 26.A NZ ASP 21.A OD2 no hydrogen 2.753 N/A PHE 27.A N GLY 20.A O no hydrogen 2.851 N/A PHE 28.A N THR 50.A OG1 no hydrogen 2.959 N/A VAL 29.A N LEU 18.A O no hydrogen 2.907 N/A ARG 30.A N ILE 47.A O no hydrogen 2.952 N/A ARG 30.A NE GLU 17.A OE2 no hydrogen 2.895 N/A ARG 30.A NH2 GLU 17.A OE2 no hydrogen 2.834 N/A GLY 31.A N ILE 16.A O no hydrogen 2.748 N/A GLU 32.A N LYS 45.A O no hydrogen 3.038 N/A GLY 33.A N ILE 14.A O no hydrogen 3.147 N/A GLU 34.A N SER 43.A O no hydrogen 2.929 N/A GLY 35.A N VAL 12.A O no hydrogen 2.937 N/A ASP 36.A N LYS 41.A O no hydrogen 2.923 N/A THR 38.A N ASP 36.A OD1 no hydrogen 3.061 N/A THR 38.A OG1 ASP 36.A OD1 no hydrogen 2.466 N/A ILE 39.A N ASP 36.A O no hydrogen 3.233 N/A GLY 40.A N ASP 36.A O no hydrogen 2.861 N/A LYS 41.A N ASP 36.A O no hydrogen 3.059 N/A LEU 42.A N GLU 219.A O no hydrogen 2.892 N/A SER 43.A N GLU 34.A O no hydrogen 2.891 N/A LEU 44.A N LEU 217.A O no hydrogen 3.033 N/A LYS 45.A N GLU 32.A O no hydrogen 3.033 N/A LYS 45.A NZ ASP 207.A OD2 no hydrogen 2.701 N/A LYS 45.A NZ GLU 210.A OE2 no hydrogen 2.707 N/A PHE 46.A N MET 215.A O no hydrogen 2.725 N/A ILE 47.A N ARG 30.A O no hydrogen 2.768 N/A ALA 48.A N ASP 213.A O no hydrogen 2.887 N/A THR 49.A N PHE 28.A O no hydrogen 2.968 N/A THR 49.A OG1 PHE 28.A O no hydrogen 3.453 N/A LEU 53.A N ASP 213.A OD2 no hydrogen 2.932 N/A TRP 57.A NE1 ASP 213.A OD1 no hydrogen 2.874 N/A THR 59.A N PRO 56.A O no hydrogen 3.058 N/A THR 59.A OG1 PRO 56.A O no hydrogen 2.795 N/A THR 59.A OG1 TYR 103.A OH no hydrogen 2.862 N/A LEU 60.A N TRP 57.A O no hydrogen 2.914 N/A VAL 61.A N PRO 58.A O no hydrogen 3.320 N/A THR 62.A OG1 HIS 178.A NE2 no hydrogen 2.769 N/A LEU 64.A N LEU 60.A O no hydrogen 2.883 N/A PHE 68.A N VAL 65.A O no hydrogen 3.136 N/A SER 69.A N GLN 66.A O no hydrogen 3.104 N/A SER 69.A OG GLN 66.A O no hydrogen 2.837 N/A ARG 70.A N.A VAL 221.A O no hydrogen 2.854 N/A ARG 70.A N.B VAL 221.A O no hydrogen 2.877 N/A ARG 70.A NH2.B THR 38.A O no hydrogen 2.594 N/A TYR 71.A OH HIS 196.A NE2 no hydrogen 2.764 N/A MET 75.A N PRO 72.A O no hydrogen 2.752 N/A LYS 76.A N ASP 73.A O no hydrogen 3.302 N/A LYS 76.A NZ TYR 71.A O no hydrogen 2.750 N/A HIS 78.A N MET 75.A O no hydrogen 2.872 N/A ASP 79.A N LYS 76.A O no hydrogen 3.152 N/A PHE 80.A N HIS 78.A O no hydrogen 3.114 N/A LYS 82.A N ASP 79.A OD1 no hydrogen 3.147 N/A LYS 82.A NZ ALA 67.A O no hydrogen 2.937 N/A LYS 82.A NZ SER 69.A O no hydrogen 2.862 N/A LYS 82.A NZ ASP 79.A OD2 no hydrogen 2.794 N/A SER 83.A N ASP 79.A O no hydrogen 3.348 N/A SER 83.A OG PHE 80.A O no hydrogen 2.676 N/A ALA 84.A N PHE 80.A O no hydrogen 3.167 N/A MET 85.A N LYS 82.A O no hydrogen 2.928 N/A GLU 87.A N GLU 87.A OE1 no hydrogen 2.733 N/A GLY 88.A N ALA 84.A O no hydrogen 2.750 N/A TYR 89.A N VAL 109.A O no hydrogen 2.945 N/A VAL 90.A N THR 183.A O.A no hydrogen 2.784 N/A VAL 90.A N THR 183.A O.B no hydrogen 2.766 N/A GLN 91.A N ALA 107.A O no hydrogen 2.798 N/A GLU 92.A N GLN 181.A O no hydrogen 2.923 N/A ARG 93.A N THR 105.A O no hydrogen 2.974 N/A ARG 93.A NE GLN 180.A OE1 no hydrogen 2.911 N/A ARG 93.A NH1 THR 62.A O no hydrogen 2.771 N/A ARG 93.A NH2 GLN 180.A OE1 no hydrogen 2.894 N/A THR 94.A N TYR 179.A O no hydrogen 2.969 N/A ILE 95.A N TYR 103.A O no hydrogen 2.843 N/A TYR 96.A N ASP 177.A O no hydrogen 2.873 N/A PHE 97.A N GLY 101.A O no hydrogen 2.979 N/A LYS 98.A N LEU 175.A O no hydrogen 2.977 N/A LYS 98.A NZ ASP 99.A OD2 no hydrogen 3.182 N/A ASP 100.A N PHE 97.A O no hydrogen 2.823 N/A THR 102.A N ILE 125.A O no hydrogen 2.975 N/A TYR 103.A N ILE 95.A O no hydrogen 2.888 N/A TYR 103.A OH THR 59.A OG1 no hydrogen 2.862 N/A LYS 104.A N LYS 123.A O no hydrogen 2.728 N/A LYS 104.A NZ THR 94.A OG1 no hydrogen 2.668 N/A THR 105.A N ARG 93.A O no hydrogen 2.926 N/A ARG 106.A N GLU 121.A O no hydrogen 3.035 N/A ARG 106.A NH1 GLU 108.A OE2 no hydrogen 3.060 N/A ARG 106.A NH2 GLU 108.A OE2 no hydrogen 3.258 N/A ALA 107.A N GLN 91.A O no hydrogen 2.754 N/A GLU 108.A N ARG 119.A O no hydrogen 2.979 N/A VAL 109.A N TYR 89.A O no hydrogen 2.901 N/A LYS 110.A N VAL 117.A O no hydrogen 3.016 N/A LYS 110.A NZ GLU 112.A OE2 no hydrogen 2.811 N/A PHE 111.A N PRO 86.A O no hydrogen 3.175 N/A GLU 112.A N THR 115.A O no hydrogen 2.898 N/A THR 115.A N GLU 112.A O no hydrogen 3.176 N/A LEU 116.A N PRO 13.A O no hydrogen 2.944 N/A VAL 117.A N LYS 110.A O no hydrogen 2.861 N/A ASN 118.A N LEU 15.A O no hydrogen 2.934 N/A ASN 118.A ND2 THR 63.A O no hydrogen 3.408 N/A ASN 118.A ND2 LEU 64.A O no hydrogen 3.015 N/A ARG 119.A N GLU 108.A O no hydrogen 2.963 N/A ARG 119.A NE GLU 112.A OE1 no hydrogen 3.396 N/A ARG 119.A NE GLU 112.A OE2 no hydrogen 2.745 N/A ARG 119.A NH2 GLU 112.A OE1 no hydrogen 2.865 N/A ILE 120.A N GLU 17.A O no hydrogen 2.893 N/A GLU 121.A N ARG 106.A O no hydrogen 2.898 N/A LEU 122.A N ASP 19.A O no hydrogen 2.894 N/A LYS 123.A N LYS 104.A O no hydrogen 2.893 N/A GLY 124.A N ASP 21.A O no hydrogen 2.762 N/A ILE 125.A N THR 102.A O no hydrogen 2.908 N/A PHE 127.A N ASN 23.A OD1 no hydrogen 3.040 N/A LYS 128.A N ASP 100.A OD1 no hydrogen 2.832 N/A LYS 128.A NZ ASP 99.A O no hydrogen 2.965 N/A GLY 131.A N LYS 128.A O no hydrogen 2.991 N/A ASN 132.A ND2 GLN 174.A OE1 no hydrogen 3.036 N/A GLY 135.A N GLY 131.A O no hydrogen 2.945 N/A LYS 137.A N ASN 132.A O no hydrogen 2.967 N/A LYS 137.A NZ ASP 130.A O no hydrogen 2.952 N/A GLU 139.A N ASN 167.A O no hydrogen 2.971 N/A TYR 140.A OH SER 205.A O no hydrogen 2.772 N/A ASN 141.A N GLU 139.A O no hydrogen 2.988 N/A ASN 141.A ND2 GLU 139.A OE1 no hydrogen 2.948 N/A ASN 143.A ND2 ARG 165.A O no hydrogen 2.929 N/A ASN 143.A ND2 ASN 167.A OD1 no hydrogen 3.126 N/A HIS 145.A N THR 200.A O.A no hydrogen 3.075 N/A HIS 145.A N THR 200.A O.B no hydrogen 3.055 N/A HIS 145.A N THR 200.A OG1.A no hydrogen 3.235 N/A LYS 146.A NZ TYR 148.A OH no hydrogen 3.039 N/A VAL 147.A N LEU 198.A O no hydrogen 2.861 N/A ILE 149.A N.A HIS 196.A O no hydrogen 2.770 N/A ILE 149.A N.B HIS 196.A O no hydrogen 2.775 N/A THR 150.A N LYS 159.A O no hydrogen 3.056 N/A THR 150.A OG1 ASP 195.A OD1 no hydrogen 2.874 N/A ASP 152.A N GLY 157.A O no hydrogen 2.757 N/A ASN 155.A N ASP 152.A O no hydrogen 3.041 N/A ASN 155.A ND2 ASP 152.A OD2 no hydrogen 2.797 N/A ASN 156.A N LYS 153.A O no hydrogen 2.891 N/A GLY 157.A N ASP 152.A O no hydrogen 3.030 N/A ILE 158.A N ASN 182.A O no hydrogen 3.133 N/A LYS 159.A N THR 150.A O no hydrogen 2.869 N/A LYS 159.A NZ ALA 151.A O no hydrogen 3.126 N/A ALA 160.A N GLN 180.A O no hydrogen 2.981 N/A PHE 162.A N HIS 178.A O no hydrogen 3.015 N/A THR 163.A OG1 ASP 177.A OD1 no hydrogen 2.638 N/A ILE 164.A N ALA 176.A O no hydrogen 2.890 N/A ARG 165.A N HIS 145.A NE2 no hydrogen 2.995 N/A ARG 165.A NH2 SER 144.A O no hydrogen 2.866 N/A HIS 166.A N GLN 174.A O no hydrogen 2.833 N/A VAL 168.A N SER 172.A O no hydrogen 2.987 N/A GLU 169.A N LYS 137.A O no hydrogen 2.754 N/A GLY 171.A N VAL 168.A O no hydrogen 3.073 N/A SER 172.A N ASP 170.A OD1 no hydrogen 3.039 N/A SER 172.A OG ASP 170.A OD1 no hydrogen 2.620 N/A GLN 174.A N HIS 166.A O no hydrogen 2.748 N/A GLN 174.A NE2 LYS 98.A O no hydrogen 2.987 N/A GLN 174.A NE2 LEU 175.A O no hydrogen 3.058 N/A ALA 176.A N ILE 164.A O no hydrogen 2.877 N/A ASP 177.A N TYR 96.A O no hydrogen 2.882 N/A HIS 178.A N PHE 162.A O no hydrogen 2.698 N/A HIS 178.A ND1 ALA 176.A O no hydrogen 2.998 N/A HIS 178.A NE2 THR 62.A OG1 no hydrogen 2.769 N/A TYR 179.A N THR 94.A O no hydrogen 2.936 N/A GLN 180.A N ALA 160.A O no hydrogen 2.760 N/A GLN 180.A NE2 GLN 66.A OE1 no hydrogen 2.937 N/A GLN 180.A NE2 ASN 182.A OD1 no hydrogen 2.908 N/A GLN 181.A N GLU 92.A O no hydrogen 2.945 N/A GLN 181.A NE2 GLU 92.A OE1 no hydrogen 2.932 N/A ASN 182.A N ILE 158.A O no hydrogen 2.947 N/A ASN 182.A ND2 GLN 91.A OE1 no hydrogen 2.837 N/A THR 183.A N.A VAL 90.A O no hydrogen 3.039 N/A THR 183.A N.B VAL 90.A O no hydrogen 3.039 N/A THR 183.A OG1.A ASN 155.A O no hydrogen 3.153 N/A ILE 185.A N GLY 88.A O no hydrogen 2.850 N/A ASP 191.A N SER 83.A OG no hydrogen 2.970 N/A ASP 194.A N HIS 78.A ND1 no hydrogen 3.075 N/A HIS 196.A N ILE 149.A O.A no hydrogen 3.134 N/A HIS 196.A N ILE 149.A O.B no hydrogen 3.128 N/A HIS 196.A ND1 ASP 194.A O no hydrogen 2.869 N/A HIS 196.A NE2 TYR 71.A OH no hydrogen 2.764 N/A TYR 197.A N ALA 224.A O no hydrogen 2.847 N/A LEU 198.A N VAL 147.A O no hydrogen 2.791 N/A SER 199.A N THR 222.A O no hydrogen 2.753 N/A THR 200.A N.A HIS 145.A O no hydrogen 2.864 N/A THR 200.A N.B HIS 145.A O no hydrogen 2.885 N/A THR 200.A OG1.A HIS 145.A O no hydrogen 2.931 N/A GLN 201.A N TYR 220.A O no hydrogen 2.932 N/A THR 202.A OG1 GLU 219.A OE2 no hydrogen 3.537 N/A ILE 203.A N LEU 218.A O no hydrogen 2.850 N/A SER 205.A N VAL 216.A O no hydrogen 2.863 N/A LYS 206.A NZ HIS 214.A O no hydrogen 2.774 N/A ASP 207.A N HIS 214.A NE2 no hydrogen 2.832 N/A ASN 209.A N ASP 207.A OD1 no hydrogen 3.192 N/A GLU 210.A N ASP 207.A O no hydrogen 2.834 N/A ARG 212.A N GLU 210.A OE1 no hydrogen 3.226 N/A ARG 212.A NE GLU 210.A OE1 no hydrogen 2.422 N/A ARG 212.A NH2 GLU 210.A OE1 no hydrogen 3.136 N/A ARG 212.A NH2 GLU 210.A OE2 no hydrogen 3.102 N/A HIS 214.A ND1 ARG 212.A O no hydrogen 2.813 N/A MET 215.A N PHE 46.A O no hydrogen 2.891 N/A VAL 216.A N SER 205.A O no hydrogen 3.036 N/A LEU 217.A N LEU 44.A O no hydrogen 2.815 N/A LEU 218.A N ILE 203.A O no hydrogen 3.021 N/A GLU 219.A N LEU 42.A O no hydrogen 3.046 N/A TYR 220.A N GLN 201.A O no hydrogen 2.810 N/A VAL 221.A N GLY 40.A O no hydrogen 2.905 N/A THR 222.A N SER 199.A O no hydrogen 3.169 N/A ALA 223.A N ARG 70.A O.A no hydrogen 2.886 N/A ALA 223.A N ARG 70.A O.B no hydrogen 2.911 N/A ALA 224.A N TYR 197.A O no hydrogen 2.983 N/A