Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4z3t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N VAL 2.A O no hydrogen 3.054 N/A GLY 9.A N ILE 6.A O no hydrogen 3.395 N/A ALA 11.A N GLN 45.A OE1 no hydrogen 2.957 N/A ASP 12.A N ALA 8.A O no hydrogen 3.200 N/A ALA 13.A N GLY 9.A O no hydrogen 2.817 N/A LEU 14.A N LEU 10.A O no hydrogen 3.204 N/A THR 15.A N ASP 12.A O no hydrogen 3.083 N/A THR 15.A OG1 ALA 11.A O no hydrogen 2.755 N/A ALA 16.A N ASP 12.A O no hydrogen 2.927 N/A LYS 21.A N ASP 19.A OD1 no hydrogen 3.135 N/A ASP 22.A N ASP 19.A O no hydrogen 2.919 N/A LYS 23.A NZ SER 24.A O no hydrogen 2.815 N/A LYS 23.A NZ ASP 96.A OD1 no hydrogen 2.650 N/A SER 24.A OG ASP 96.A O no hydrogen 2.746 N/A LEU 25.A N GLN 95.A O no hydrogen 2.951 N/A GLN 26.A N GLN 26.A OE1 no hydrogen 2.675 N/A GLN 26.A NE2 HIS 20.A O no hydrogen 2.997 N/A LEU 28.A N LEU 57.A O no hydrogen 3.110 N/A LEU 30.A N ASP 55.A O no hydrogen 2.875 N/A ASP 31.A N ASP 127.A OD1 no hydrogen 2.930 N/A ASP 31.A N ASP 127.A OD2 no hydrogen 3.318 N/A GLN 32.A N ASP 127.A OD1 no hydrogen 2.734 N/A GLN 32.A NE2 ASP 31.A OD2.B no hydrogen 2.947 N/A SER 33.A N ASP 127.A OD2 no hydrogen 2.876 N/A SER 33.A OG.A ASP 127.A OD2 no hydrogen 2.588 N/A SER 33.A OG.B SER 126.A OG.A no hydrogen 2.614 N/A SER 33.A OG.B SER 126.A OG.B no hydrogen 2.930 N/A SER 33.A OG.B ASP 127.A OD2 no hydrogen 2.476 N/A ARG 35.A N GLU 38.A OE1 no hydrogen 2.894 N/A ARG 35.A NH2 GLN 32.A OE1 no hydrogen 3.210 N/A LYS 36.A NZ ASN 53.A OD1 no hydrogen 3.486 N/A ASN 37.A N ASN 37.A OD1.A no hydrogen 2.538 N/A GLU 38.A N ARG 35.A O no hydrogen 2.833 N/A LYS 39.A N GLN 75.A O no hydrogen 2.931 N/A LEU 40.A N TYR 51.A O no hydrogen 2.823 N/A LYS 41.A N ILE 73.A O no hydrogen 2.886 N/A LYS 41.A NZ GLN 75.A OE1 no hydrogen 2.871 N/A LEU 42.A N LYS 49.A O no hydrogen 2.921 N/A ALA 43.A N ASP 71.A O no hydrogen 2.815 N/A ALA 44.A N ALA 47.A O no hydrogen 3.078 N/A GLN 45.A NE2 GLY 7.A O no hydrogen 2.961 N/A ALA 47.A N ALA 44.A O no hydrogen 2.961 N/A LYS 49.A N LEU 42.A O no hydrogen 2.925 N/A TYR 51.A N LEU 40.A O no hydrogen 2.676 N/A GLY 52.A N ASP 55.A OD2 no hydrogen 2.701 N/A ASN 53.A ND2 ASP 31.A OD1.B no hydrogen 2.804 N/A ASN 53.A ND2 VAL 34.A O no hydrogen 2.991 N/A GLY 54.A N LEU 30.A O no hydrogen 2.742 N/A ASP 55.A N GLY 52.A O no hydrogen 3.012 N/A LEU 57.A N LEU 28.A O no hydrogen 2.745 N/A ASN 58.A ND2 ALA 16.A O no hydrogen 3.058 N/A ASN 58.A ND2 PRO 17.A O no hydrogen 2.965 N/A THR 59.A N LEU 57.A O no hydrogen 2.907 N/A THR 59.A OG1 LEU 25.A O no hydrogen 2.742 N/A GLY 60.A N GLN 26.A O no hydrogen 2.881 N/A LYS 61.A N ASN 58.A O no hydrogen 3.253 N/A LYS 61.A NZ ASP 22.A OD2 no hydrogen 2.820 N/A LEU 62.A N THR 59.A O no hydrogen 2.945 N/A LYS 63.A NZ ASP 5.A OD2 no hydrogen 3.458 N/A ASP 65.A N LYS 94.A O no hydrogen 2.745 N/A LYS 66.A NZ VAL 2.A O no hydrogen 2.723 N/A LYS 66.A NZ ASP 5.A O no hydrogen 2.762 N/A SER 68.A N ILE 92.A O no hydrogen 2.829 N/A ARG 69.A NH2 GLU 89.A OE1 no hydrogen 2.874 N/A PHE 70.A N PHE 90.A O no hydrogen 2.941 N/A ASP 71.A N ALA 43.A O no hydrogen 2.875 N/A PHE 72.A N GLY 88.A O no hydrogen 2.922 N/A ILE 73.A N LYS 41.A O no hydrogen 3.000 N/A ARG 74.A N GLU 86.A O no hydrogen 2.876 N/A ARG 74.A NE GLU 86.A OE1 no hydrogen 2.753 N/A ARG 74.A NH1 SER 33.A O no hydrogen 3.149 N/A ARG 74.A NH1 GLU 86.A OE1 no hydrogen 3.161 N/A ARG 74.A NH2 SER 33.A O no hydrogen 2.596 N/A ARG 74.A NH2 GLU 38.A OE1 no hydrogen 3.145 N/A GLN 75.A N LYS 39.A O no hydrogen 2.831 N/A GLN 75.A NE2 THR 84.A OG1 no hydrogen 3.219 N/A ILE 76.A N ILE 83.A O no hydrogen 2.861 N/A VAL 78.A N GLN 81.A O no hydrogen 2.821 N/A GLN 81.A N VAL 78.A O no hydrogen 2.950 N/A ILE 83.A N ILE 76.A O no hydrogen 2.783 N/A LEU 85.A N ARG 74.A O no hydrogen 2.761 N/A SER 87.A N LYS 107.A O no hydrogen 2.886 N/A GLY 88.A N PHE 72.A O no hydrogen 3.075 N/A GLU 89.A N GLN 104.A O no hydrogen 2.847 N/A PHE 90.A N PHE 70.A O no hydrogen 2.755 N/A GLN 91.A N ALA 102.A O no hydrogen 2.816 N/A GLN 91.A NE2 GLU 89.A OE1 no hydrogen 3.032 N/A ILE 92.A N SER 68.A O no hydrogen 2.903 N/A TYR 93.A N VAL 100.A O no hydrogen 2.902 N/A LYS 94.A N LYS 66.A O no hydrogen 3.484 N/A LYS 94.A NZ.A SER 24.A O no hydrogen 2.649 N/A LYS 94.A NZ.A ASN 64.A OD1 no hydrogen 2.637 N/A LYS 94.A NZ.A GLN 95.A O no hydrogen 2.699 N/A LYS 94.A NZ.B LYS 23.A O no hydrogen 2.839 N/A LYS 94.A NZ.B THR 59.A O no hydrogen 3.041 N/A LYS 94.A NZ.B LEU 62.A O no hydrogen 2.882 N/A GLN 95.A N SER 98.A O no hydrogen 2.834 N/A GLN 95.A NE2 SER 98.A OG no hydrogen 2.991 N/A GLN 95.A NE2 ILE 227.A O no hydrogen 3.496 N/A GLN 95.A NE2 GLY 246.A O no hydrogen 3.172 N/A ASP 96.A N GLU 226.A OE2 no hydrogen 2.752 N/A HIS 97.A N GLU 226.A OE1 no hydrogen 2.722 N/A HIS 97.A ND1 GLU 131.A OE1.A no hydrogen 2.760 N/A SER 98.A OG GLU 226.A OE1 no hydrogen 2.758 N/A ALA 99.A N GLY 129.A O no hydrogen 2.946 N/A VAL 100.A N TYR 93.A O no hydrogen 3.099 N/A VAL 101.A N ASP 127.A O no hydrogen 2.785 N/A ALA 102.A N GLN 91.A O no hydrogen 2.811 N/A LEU 103.A N ARG 124.A O no hydrogen 2.742 N/A GLN 104.A N GLU 89.A O no hydrogen 2.814 N/A GLN 104.A NE2 ILE 105.A O no hydrogen 3.107 N/A ILE 105.A N SER 122.A O no hydrogen 2.770 N/A GLU 106.A N SER 87.A O no hydrogen 2.824 N/A LYS 107.A N SER 87.A O no hydrogen 3.117 N/A LYS 107.A NZ ASN 119.A OD1 no hydrogen 2.594 N/A ILE 108.A N ILE 118.A O no hydrogen 2.890 N/A ASN 109.A N LEU 85.A O no hydrogen 3.059 N/A ASN 109.A ND2 ASN 110.A O no hydrogen 3.124 N/A ASN 110.A N SER 116.A O no hydrogen 2.747 N/A ASP 112.A N ASN 110.A OD1 no hydrogen 2.887 N/A LYS 113.A N ASN 110.A O no hydrogen 3.130 N/A LYS 113.A NZ ASP 115.A OD1 no hydrogen 3.143 N/A LYS 113.A NZ SER 116.A OG.B no hydrogen 2.750 N/A SER 116.A N LYS 113.A O no hydrogen 2.994 N/A SER 116.A OG.A LYS 113.A O no hydrogen 2.947 N/A ILE 118.A N ILE 108.A O no hydrogen 2.803 N/A GLN 120.A N GLU 106.A O no hydrogen 2.944 N/A ARG 121.A NE GLU 106.A OE1 no hydrogen 2.883 N/A ARG 121.A NE GLU 106.A OE2 no hydrogen 3.374 N/A ARG 121.A NH1 GLU 106.A OE2 no hydrogen 2.956 N/A ARG 121.A NH1 ASP 153.A OD1 no hydrogen 2.981 N/A ARG 121.A NH2 ASP 153.A OD2 no hydrogen 2.842 N/A SER 122.A N ILE 105.A O no hydrogen 3.290 N/A ARG 124.A N LEU 103.A O no hydrogen 3.107 N/A ARG 124.A NH1 GLU 86.A OE2 no hydrogen 2.926 N/A ARG 124.A NH2 GLU 86.A OE1 no hydrogen 2.914 N/A ARG 124.A NH2 GLU 86.A OE2 no hydrogen 3.407 N/A VAL 125.A N GLU 241.A OE1 no hydrogen 2.896 N/A SER 126.A N VAL 101.A O no hydrogen 2.784 N/A SER 126.A OG.A SER 33.A OG.B no hydrogen 2.614 N/A SER 126.A OG.A ASP 127.A OD2 no hydrogen 3.437 N/A SER 126.A OG.B SER 33.A OG.B no hydrogen 2.930 N/A SER 126.A OG.B VAL 101.A O no hydrogen 3.460 N/A GLY 129.A N ALA 99.A O no hydrogen 3.082 N/A GLU 131.A N HIS 97.A O no hydrogen 2.935 N/A HIS 132.A N GLY 130.A O no hydrogen 3.115 N/A THR 133.A N LEU 219.A O no hydrogen 2.830 N/A THR 133.A OG1 GLY 221.A O no hydrogen 2.714 N/A PHE 135.A N SER 197.A O no hydrogen 2.989 N/A GLN 137.A N ALA 134.A O no hydrogen 2.892 N/A GLN 137.A NE2 ASN 136.A OD1 no hydrogen 3.607 N/A ALA 143.A N ILE 163.A O no hydrogen 2.906 N/A TYR 145.A N TYR 161.A O no hydrogen 2.752 N/A TYR 145.A OH ALA 224.A O no hydrogen 2.675 N/A HIS 146.A N LYS 247.A O no hydrogen 2.926 N/A HIS 146.A NE2 GLU 144.A OE2.B no hydrogen 2.808 N/A GLY 147.A N LEU 159.A O no hydrogen 2.937 N/A LYS 148.A N ALA 245.A O no hydrogen 2.847 N/A LYS 148.A NZ PRO 155.A O no hydrogen 2.787 N/A ALA 149.A N GLY 157.A O no hydrogen 2.968 N/A PHE 150.A N GLY 243.A O no hydrogen 2.862 N/A SER 151.A N ASP 154.A O no hydrogen 2.898 N/A SER 151.A OG GLN 182.A OE1 no hydrogen 2.877 N/A SER 152.A OG GLN 104.A OE1 no hydrogen 2.734 N/A ASP 154.A N SER 151.A O no hydrogen 2.929 N/A ASN 156.A N ASP 154.A OD1 no hydrogen 3.285 N/A ARG 158.A N GLU 175.A O no hydrogen 2.747 N/A LEU 159.A N GLY 147.A O no hydrogen 2.777 N/A HIS 160.A N ARG 173.A O no hydrogen 3.060 N/A TYR 161.A N TYR 145.A O no hydrogen 3.089 N/A TYR 161.A OH TYR 215.A OH no hydrogen 2.773 N/A SER 162.A N TYR 171.A O no hydrogen 2.845 N/A ILE 163.A N ALA 143.A O no hydrogen 2.951 N/A ASP 164.A N GLN 169.A O no hydrogen 2.739 N/A PHE 165.A N GLY 141.A O no hydrogen 2.735 N/A LYS 167.A N ASP 164.A OD1 no hydrogen 2.947 N/A LYS 168.A N PHE 165.A O no hydrogen 3.233 N/A LYS 168.A NZ PHE 165.A O no hydrogen 3.274 N/A GLN 169.A N ASP 164.A O no hydrogen 3.083 N/A GLN 169.A NE2 SER 188.A OG.A no hydrogen 2.650 N/A GLY 170.A N ALA 189.A O no hydrogen 2.933 N/A TYR 171.A N SER 162.A O no hydrogen 2.994 N/A GLY 172.A N LEU 186.A O no hydrogen 2.820 N/A ARG 173.A N HIS 160.A O no hydrogen 2.734 N/A ARG 173.A NE GLU 175.A OE2 no hydrogen 2.844 N/A ARG 173.A NH1 GLU 175.A OE2 no hydrogen 2.951 N/A ILE 174.A N VAL 184.A O no hydrogen 3.009 N/A GLU 175.A N ARG 158.A O no hydrogen 2.919 N/A LEU 177.A N ASN 183.A OD1 no hydrogen 2.789 N/A LYS 178.A N ASP 154.A OD2 no hydrogen 2.697 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.708 N/A GLN 182.A N THR 179.A O no hydrogen 2.971 N/A GLN 182.A NE2 HIS 240.A ND1 no hydrogen 3.233 N/A ASN 183.A N PRO 180.A O no hydrogen 3.027 N/A ASN 183.A ND2 LEU 177.A O no hydrogen 3.005 N/A ASN 183.A ND2 PRO 180.A O no hydrogen 3.268 N/A VAL 184.A N GLN 182.A O no hydrogen 2.854 N/A GLU 185.A N ARG 206.A O no hydrogen 2.837 N/A LEU 186.A N GLY 172.A O no hydrogen 2.752 N/A ALA 187.A N ASP 204.A O no hydrogen 2.976 N/A ALA 189.A N GLY 170.A O no hydrogen 2.854 N/A LEU 191.A N LYS 168.A O no hydrogen 2.824 N/A LYS 192.A N VAL 200.A O no hydrogen 2.993 N/A ASP 194.A N HIS 198.A O no hydrogen 2.829 N/A SER 197.A N ASP 194.A O no hydrogen 2.923 N/A HIS 198.A N ASP 194.A OD1 no hydrogen 2.764 N/A ALA 199.A N THR 133.A O no hydrogen 2.839 N/A VAL 200.A N LYS 192.A O no hydrogen 2.855 N/A ILE 201.A N LEU 217.A O no hydrogen 2.657 N/A GLY 203.A N TYR 215.A O no hydrogen 3.005 N/A THR 205.A N GLY 213.A O no hydrogen 2.927 N/A THR 205.A OG1 THR 232.A O no hydrogen 2.909 N/A ARG 206.A N GLU 185.A O no hydrogen 2.981 N/A ARG 206.A NE GLU 185.A OE1 no hydrogen 2.674 N/A ARG 206.A NH1 GLU 185.A OE1 no hydrogen 2.893 N/A ARG 206.A NH1 GLU 185.A OE2 no hydrogen 3.310 N/A TYR 207.A N GLU 210.A O no hydrogen 3.026 N/A GLU 210.A N TYR 207.A O no hydrogen 3.107 N/A LYS 212.A N THR 205.A O no hydrogen 2.784 N/A THR 214.A N THR 232.A OG1 no hydrogen 3.154 N/A TYR 215.A N GLY 203.A O no hydrogen 2.782 N/A TYR 215.A OH TYR 161.A OH no hydrogen 2.773 N/A TYR 215.A OH ALA 187.A O no hydrogen 2.664 N/A HIS 216.A N SER 230.A O no hydrogen 2.800 N/A LEU 217.A N ILE 201.A O no hydrogen 2.873 N/A ALA 218.A N ALA 228.A O no hydrogen 2.929 N/A LEU 219.A N ALA 199.A O no hydrogen 3.114 N/A PHE 220.A N GLU 226.A O no hydrogen 2.824 N/A GLY 221.A N GLU 131.A O no hydrogen 2.749 N/A ARG 223.A N GLN 225.A OE1 no hydrogen 2.852 N/A ALA 224.A N GLY 221.A O no hydrogen 3.046 N/A GLN 225.A N GLN 225.A OE1 no hydrogen 2.688 N/A GLN 225.A NE2 ASP 222.A OD1 no hydrogen 2.799 N/A GLU 226.A N PHE 220.A O no hydrogen 3.099 N/A ILE 227.A N GLY 246.A O no hydrogen 2.920 N/A ALA 228.A N ALA 218.A O no hydrogen 3.055 N/A GLY 229.A N ILE 244.A O no hydrogen 2.776 N/A SER 230.A N HIS 216.A O no hydrogen 2.953 N/A ALA 231.A N ILE 242.A O no hydrogen 2.925 N/A THR 232.A N THR 214.A O no hydrogen 2.792 N/A THR 232.A OG1 THR 214.A O no hydrogen 3.456 N/A VAL 233.A N HIS 240.A O no hydrogen 2.856 N/A LYS 234.A N LYS 212.A O no hydrogen 2.835 N/A ILE 235.A N LYS 238.A O no hydrogen 2.847 N/A LYS 238.A N ILE 235.A O no hydrogen 3.086 N/A HIS 240.A N VAL 233.A O no hydrogen 2.752 N/A ILE 242.A N ALA 231.A O no hydrogen 2.887 N/A GLY 243.A N PHE 150.A O no hydrogen 2.764 N/A ILE 244.A N GLY 229.A O no hydrogen 3.026 N/A ALA 245.A N LYS 148.A O no hydrogen 3.061 N/A GLY 246.A N ILE 227.A O no hydrogen 2.847 N/A LYS 247.A N HIS 146.A O no hydrogen 2.984 N/A LYS 247.A NZ ASP 65.A OD1 no hydrogen 3.315 N/A LYS 247.A NZ ASP 65.A OD2 no hydrogen 2.978 N/A GLN 248.A N GLN 225.A O no hydrogen 2.901 N/A GLN 248.A NE2 ARG 223.A O no hydrogen 3.683 N/A GLN 248.A NE2 ALA 224.A O no hydrogen 2.999 N/A