Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a0k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ASN 211.A OD1 no hydrogen 2.795 N/A VAL 5.A N ILE 209.A O no hydrogen 2.924 N/A ALA 6.A N ASP 28.A O no hydrogen 2.810 N/A VAL 7.A N PHE 207.A O no hydrogen 2.766 N/A GLU 8.A N GLY 26.A O no hydrogen 2.710 N/A LEU 9.A N ILE 205.A O no hydrogen 2.622 N/A ASP 10.A N HIS 24.A O no hydrogen 2.790 N/A SER 11.A N ASP 203.A O no hydrogen 3.012 N/A SER 11.A OG GLU 102.A OE1 no hydrogen 2.621 N/A SER 11.A OG GLU 102.A OE2 no hydrogen 3.384 N/A TYR 12.A N ASP 10.A OD1 no hydrogen 3.110 N/A ASN 14.A N ASP 19.A OD2 no hydrogen 2.593 N/A ILE 17.A N ASN 14.A O no hydrogen 2.893 N/A GLY 18.A N THR 15.A O no hydrogen 3.220 N/A ASP 19.A N ASN 14.A O no hydrogen 3.091 N/A HIS 24.A N ASP 10.A O no hydrogen 2.880 N/A HIS 24.A ND1 TYR 22.A O no hydrogen 2.733 N/A ILE 25.A N ALA 38.A O no hydrogen 2.868 N/A GLY 26.A N GLU 8.A O no hydrogen 2.757 N/A ILE 27.A N SER 36.A O no hydrogen 2.897 N/A ASP 28.A N ALA 6.A O no hydrogen 2.675 N/A LYS 30.A N ILE 4.A O no hydrogen 2.664 N/A SER 31.A OG ASN 232.A O no hydrogen 2.529 N/A SER 31.A OG ASN 232.A OXT no hydrogen 3.457 N/A ARG 33.A N SER 31.A OG no hydrogen 3.000 N/A ARG 33.A NE ALA 231.A O no hydrogen 2.546 N/A ARG 33.A NH2 ALA 231.A O no hydrogen 3.438 N/A SER 34.A OG ASP 28.A OD1 no hydrogen 2.513 N/A LYS 35.A N ILE 27.A O no hydrogen 2.628 N/A SER 36.A OG SER 76.A O no hydrogen 3.343 N/A ALA 38.A N ILE 25.A O no hydrogen 2.831 N/A TRP 40.A N PRO 23.A O no hydrogen 2.872 N/A GLN 43.A N TYR 67.A OH no hydrogen 3.058 N/A GLY 45.A N ILE 194.A O no hydrogen 2.617 N/A LYS 46.A N GLN 43.A O no hydrogen 2.878 N/A GLY 48.A N PHE 192.A O no hydrogen 2.665 N/A THR 49.A N SER 66.A O no hydrogen 2.770 N/A ALA 50.A N PHE 190.A O no hydrogen 2.832 N/A HIS 51.A N VAL 64.A O no hydrogen 2.790 N/A HIS 51.A ND1 THR 189.A OG1 no hydrogen 3.008 N/A ILE 52.A N ALA 188.A O no hydrogen 2.685 N/A SER 53.A N THR 62.A O no hydrogen 2.876 N/A SER 53.A OG ASP 187.A OD2 no hydrogen 2.226 N/A TYR 54.A N PHE 186.A O no hydrogen 2.838 N/A SER 56.A N ALA 184.A O no hydrogen 2.782 N/A SER 56.A OG ALA 184.A O no hydrogen 3.210 N/A VAL 57.A N ASN 55.A OD1 no hydrogen 2.850 N/A ALA 58.A N ASN 55.A OD1 no hydrogen 2.878 N/A LYS 59.A N ASN 55.A O no hydrogen 2.589 N/A LYS 59.A NZ SER 56.A O no hydrogen 2.619 N/A ARG 60.A NE ASP 78.A OD1 no hydrogen 2.673 N/A ARG 60.A NH2 ASP 78.A OD1 no hydrogen 3.203 N/A ARG 60.A NH2 ASP 78.A OD2 no hydrogen 3.381 N/A LEU 61.A N TYR 77.A O no hydrogen 2.805 N/A THR 62.A N SER 53.A O no hydrogen 2.936 N/A ALA 63.A N VAL 75.A O no hydrogen 2.742 N/A VAL 64.A N HIS 51.A O no hydrogen 2.833 N/A VAL 65.A N THR 73.A O no hydrogen 2.796 N/A SER 66.A N THR 49.A O no hydrogen 2.793 N/A TYR 67.A N SER 70.A OG no hydrogen 2.801 N/A SER 70.A N TYR 67.A O no hydrogen 2.956 N/A SER 70.A OG TYR 67.A O no hydrogen 2.919 N/A SER 70.A OG SER 71.A O no hydrogen 3.103 N/A THR 73.A N VAL 65.A O no hydrogen 2.909 N/A THR 73.A OG1 ARG 39.A O no hydrogen 3.402 N/A VAL 75.A N ALA 63.A O no hydrogen 2.870 N/A TYR 77.A N LEU 61.A O no hydrogen 2.719 N/A VAL 79.A N LYS 59.A O no hydrogen 2.890 N/A LEU 81.A N TYR 54.A OH no hydrogen 2.859 N/A THR 82.A N ASP 80.A OD1 no hydrogen 2.975 N/A THR 82.A OG1 ASP 80.A OD1 no hydrogen 2.639 N/A ASN 83.A N ASP 80.A O no hydrogen 2.852 N/A VAL 84.A N LEU 81.A O no hydrogen 2.866 N/A LEU 85.A N LEU 81.A O no hydrogen 2.806 N/A VAL 89.A N VAL 174.A O no hydrogen 2.851 N/A ARG 90.A N ALA 210.A O no hydrogen 2.776 N/A ARG 90.A NE TYR 171.A O no hydrogen 2.788 N/A ARG 90.A NH1 THR 212.A O no hydrogen 2.768 N/A ARG 90.A NH2 TYR 171.A O no hydrogen 2.850 N/A GLY 92.A N PHE 208.A O no hydrogen 2.875 N/A LEU 93.A N ALA 168.A O no hydrogen 2.827 N/A SER 94.A N THR 206.A O no hydrogen 2.879 N/A SER 94.A OG THR 206.A OG1 no hydrogen 2.778 N/A SER 94.A OG LEU 225.A O no hydrogen 2.696 N/A ALA 95.A N GLY 166.A O no hydrogen 2.818 N/A THR 96.A N GLY 204.A O no hydrogen 2.955 N/A THR 96.A OG1 GLY 222.A O no hydrogen 2.491 N/A THR 97.A N SER 164.A O no hydrogen 2.795 N/A THR 97.A OG1 GLN 161.A O no hydrogen 2.684 N/A GLY 98.A N TYR 100.A O no hydrogen 2.746 N/A LYS 101.A N ASP 198.A OD1 no hydrogen 2.792 N/A LYS 101.A NZ ASP 198.A OD1 no hydrogen 2.236 N/A LYS 101.A NZ ASP 198.A OD2 no hydrogen 2.612 N/A THR 103.A N LYS 195.A O no hydrogen 2.794 N/A THR 103.A OG1 LEU 193.A O no hydrogen 2.943 N/A THR 103.A OG1 LYS 195.A O no hydrogen 3.517 N/A ASN 104.A ND2 THR 96.A O no hydrogen 3.403 N/A ASN 104.A ND2 THR 152.A OG1 no hydrogen 2.921 N/A THR 105.A N LEU 193.A O no hydrogen 3.178 N/A THR 105.A OG1 GLU 150.A OE1 no hydrogen 2.719 N/A THR 105.A OG1 GLU 150.A OE2 no hydrogen 3.417 N/A THR 105.A OG1 LEU 193.A O no hydrogen 3.447 N/A ILE 106.A N LEU 149.A O no hydrogen 2.652 N/A LEU 107.A N THR 191.A O no hydrogen 2.906 N/A SER 108.A OG THR 191.A OG1 no hydrogen 2.555 N/A TRP 109.A N PHE 125.A O no hydrogen 2.803 N/A SER 110.A N THR 189.A O no hydrogen 2.762 N/A PHE 111.A N PHE 123.A O no hydrogen 2.823 N/A THR 112.A N ASP 187.A O no hydrogen 2.770 N/A THR 112.A OG1 HIS 122.A ND1 no hydrogen 2.742 N/A SER 113.A N LEU 121.A O no hydrogen 2.668 N/A SER 113.A OG SER 185.A O no hydrogen 3.435 N/A LYS 114.A N SER 185.A O no hydrogen 2.756 N/A LEU 115.A N ASN 119.A O no hydrogen 2.796 N/A LYS 116.A N VAL 183.A O no hydrogen 2.650 N/A LEU 121.A N SER 113.A O no hydrogen 2.929 N/A HIS 122.A ND1 THR 112.A OG1 no hydrogen 2.742 N/A PHE 123.A N PHE 111.A O no hydrogen 2.874 N/A PHE 125.A N TRP 109.A O no hydrogen 2.666 N/A PHE 128.A N GLY 147.A O no hydrogen 2.547 N/A ASN 131.A N THR 129.A OG1 no hydrogen 2.774 N/A LEU 135.A N PRO 132.A O no hydrogen 2.962 N/A ILE 136.A N LEU 169.A O no hydrogen 2.808 N/A GLN 138.A N ARG 167.A O no hydrogen 2.770 N/A GLN 138.A NE2 THR 214.A O no hydrogen 3.036 N/A ASP 140.A N VAL 165.A O no hydrogen 2.711 N/A ALA 141.A N GLN 138.A O no hydrogen 3.337 N/A THR 142.A N GLU 150.A O no hydrogen 2.939 N/A THR 143.A OG1 THR 129.A O no hydrogen 2.745 N/A ASP 144.A N ASN 148.A O no hydrogen 2.860 N/A ASP 146.A N ASP 144.A OD1 no hydrogen 2.754 N/A GLY 147.A N ASP 144.A O no hydrogen 2.841 N/A ASN 148.A N ASP 144.A OD1 no hydrogen 2.908 N/A LEU 149.A N ILE 106.A O no hydrogen 2.826 N/A GLU 150.A N THR 142.A O no hydrogen 2.655 N/A LEU 151.A N ASN 104.A O no hydrogen 2.956 N/A LYS 153.A N SER 164.A OG no hydrogen 2.818 N/A SER 155.A N SER 159.A O no hydrogen 2.615 N/A SER 155.A OG SER 157.A OG no hydrogen 2.972 N/A SER 155.A OG SER 159.A O no hydrogen 3.559 N/A SER 157.A N SER 155.A OG no hydrogen 3.221 N/A SER 157.A OG SER 155.A OG no hydrogen 2.972 N/A GLY 158.A N SER 155.A O no hydrogen 2.844 N/A SER 159.A N SER 155.A OG no hydrogen 3.210 N/A GLN 161.A N LYS 153.A O no hydrogen 2.885 N/A GLN 161.A NE2 SER 159.A O no hydrogen 2.776 N/A SER 163.A N GLY 98.A O no hydrogen 2.913 N/A SER 164.A N THR 97.A OG1 no hydrogen 2.861 N/A SER 164.A OG ASP 140.A OD2 no hydrogen 2.411 N/A VAL 165.A N ASP 140.A OD2 no hydrogen 3.032 N/A GLY 166.A N ALA 95.A O no hydrogen 2.907 N/A ARG 167.A N GLN 138.A O no hydrogen 2.967 N/A ARG 167.A NE GLN 138.A OE1 no hydrogen 2.844 N/A ARG 167.A NH1 GLY 226.A O no hydrogen 2.789 N/A ARG 167.A NH2 GLN 138.A OE1 no hydrogen 2.888 N/A ARG 167.A NH2 THR 214.A OG1 no hydrogen 2.692 N/A ALA 168.A N LEU 93.A O no hydrogen 2.872 N/A LEU 169.A N ILE 136.A O no hydrogen 2.792 N/A PHE 170.A N VAL 91.A O no hydrogen 2.747 N/A TYR 171.A N ASP 134.A O no hydrogen 2.745 N/A VAL 174.A N VAL 89.A O no hydrogen 2.672 N/A HIS 175.A NE2 GLU 87.A OE1 no hydrogen 2.463 N/A ILE 176.A N GLU 87.A O no hydrogen 2.680 N/A TRP 177.A N GLU 87.A O no hydrogen 3.440 N/A SER 180.A OG GLU 178.A OE2 no hydrogen 3.333 N/A ALA 181.A N GLU 178.A O no hydrogen 3.231 N/A VAL 182.A N LYS 116.A O no hydrogen 2.867 N/A ALA 184.A N SER 56.A OG no hydrogen 2.739 N/A SER 185.A N LYS 114.A O no hydrogen 2.938 N/A PHE 186.A N TYR 54.A O no hydrogen 2.848 N/A ASP 187.A N THR 112.A O no hydrogen 2.798 N/A ALA 188.A N ILE 52.A O no hydrogen 2.747 N/A THR 189.A N SER 110.A O no hydrogen 2.889 N/A THR 189.A OG1 HIS 51.A ND1 no hydrogen 3.008 N/A PHE 190.A N ALA 50.A O no hydrogen 2.888 N/A THR 191.A N SER 108.A O no hydrogen 3.005 N/A THR 191.A OG1 SER 108.A OG no hydrogen 2.555 N/A PHE 192.A N GLY 48.A O no hydrogen 2.810 N/A LEU 193.A N THR 105.A O no hydrogen 2.881 N/A LYS 195.A N THR 103.A OG1 no hydrogen 2.688 N/A SER 196.A OG LYS 101.A O no hydrogen 2.612 N/A SER 196.A OG ASP 198.A O no hydrogen 3.505 N/A ASP 198.A N SER 196.A OG no hydrogen 2.793 N/A ASP 203.A N THR 96.A O no hydrogen 2.786 N/A GLY 204.A N THR 96.A O no hydrogen 3.254 N/A ILE 205.A N LEU 9.A O no hydrogen 2.878 N/A THR 206.A N SER 94.A O no hydrogen 2.732 N/A THR 206.A OG1 SER 94.A OG no hydrogen 2.778 N/A PHE 207.A N VAL 7.A O no hydrogen 3.027 N/A PHE 208.A N GLY 92.A O no hydrogen 2.814 N/A ILE 209.A N VAL 5.A O no hydrogen 2.714 N/A ALA 210.A N ARG 90.A O no hydrogen 2.852 N/A ASN 211.A N THR 3.A O no hydrogen 3.337 N/A ASN 211.A ND2 ASP 2.A OD1 no hydrogen 2.859 N/A ASN 211.A ND2 ASP 213.A OD1 no hydrogen 2.717 N/A ASP 213.A N ASP 213.A OD1 no hydrogen 2.574 N/A THR 214.A N ASN 211.A O no hydrogen 2.885 N/A THR 214.A OG1 ASP 2.A OD2 no hydrogen 2.595 N/A SER 215.A N ASP 2.A OD2 no hydrogen 2.952 N/A SER 220.A N PRO 217.A O no hydrogen 3.045 N/A SER 220.A OG PRO 217.A O no hydrogen 2.684 N/A ARG 223.A NH1 ASP 16.A OD2 no hydrogen 2.480 N/A LEU 224.A N SER 221.A O no hydrogen 3.017 N/A LEU 225.A N GLY 222.A O no hydrogen 2.915 N/A GLY 226.A N SER 220.A O no hydrogen 2.738 N/A LEU 227.A N LEU 224.A O no hydrogen 2.903 N/A PHE 228.A N LEU 224.A O no hydrogen 3.387 N/A ASN 232.A N ASP 230.A OD1 no hydrogen 2.931 N/A