Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ofk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 9.A N GLN 13.A OE1 no hydrogen 3.029 N/A GLN 13.A N ASN 10.A OD1 no hydrogen 2.873 N/A SER 14.A N ASN 10.A O no hydrogen 3.196 N/A LEU 15.A N THR 11.A O no hydrogen 2.978 N/A GLU 16.A N TYR 12.A O no hydrogen 2.902 N/A ARG 17.A N GLN 13.A O no hydrogen 2.906 N/A GLU 18.A N SER 14.A O no hydrogen 3.124 N/A LEU 19.A N LEU 15.A O no hydrogen 2.883 N/A ALA 20.A N ARG 17.A O no hydrogen 3.233 N/A ASN 21.A N GLU 18.A O no hydrogen 3.194 N/A ASN 21.A ND2 GLU 18.A OE1 no hydrogen 3.038 N/A TRP 25.A N GLU 18.A OE1 no hydrogen 2.636 N/A TRP 25.A NE1 TYR 124.A OH no hydrogen 3.044 N/A ARG 26.A N ASP 23.A O no hydrogen 3.017 N/A LEU 27.A N PRO 24.A O no hydrogen 3.260 N/A ASP 28.A N ASP 23.A OD1 no hydrogen 2.985 N/A ASP 29.A N ASP 23.A OD2 no hydrogen 3.031 N/A ASN 30.A N ARG 26.A O no hydrogen 2.972 N/A ASN 30.A ND2 GLU 193.A OE2 no hydrogen 2.926 N/A PHE 32.A N ASN 30.A OD1 no hydrogen 3.183 N/A ARG 34.A N ASN 30.A O no hydrogen 2.914 N/A ARG 34.A NH1 ASP 28.A O no hydrogen 3.063 N/A GLU 35.A N PRO 31.A O no hydrogen 2.912 N/A ARG 36.A N PHE 32.A O no hydrogen 2.834 N/A ARG 36.A NE GLU 33.A OE1 no hydrogen 2.760 N/A ARG 36.A NH2 GLU 33.A OE1 no hydrogen 2.811 N/A HIS 37.A N GLU 33.A O no hydrogen 2.943 N/A THR 38.A N ARG 34.A O no hydrogen 2.886 N/A THR 38.A OG1 ARG 34.A O no hydrogen 3.080 N/A GLN 39.A N GLU 35.A O no hydrogen 2.995 N/A LEU 40.A N ARG 36.A O no hydrogen 2.747 N/A LEU 41.A N HIS 37.A O no hydrogen 2.816 N/A ARG 42.A N THR 38.A O no hydrogen 2.814 N/A ARG 42.A NE GLN 39.A OE1 no hydrogen 2.863 N/A ARG 42.A NH1 GLU 182.A OE2 no hydrogen 2.692 N/A ARG 42.A NH2 GLN 39.A OE1 no hydrogen 2.740 N/A ARG 42.A NH2 GLU 182.A OE2 no hydrogen 3.348 N/A LEU 43.A N GLN 39.A O no hydrogen 2.945 N/A SER 44.A N LEU 40.A O no hydrogen 2.981 N/A SER 44.A OG LEU 40.A O no hydrogen 2.670 N/A LEU 45.A N LEU 41.A O no hydrogen 2.894 N/A SER 46.A N LEU 43.A O no hydrogen 3.349 N/A SER 46.A OG ARG 42.A O no hydrogen 2.969 N/A SER 46.A OG LEU 43.A O no hydrogen 3.098 N/A GLY 48.A N LEU 45.A O no hydrogen 2.807 N/A VAL 50.A N HIS 70.A O no hydrogen 2.819 N/A SER 51.A N ASP 114.A OD2 no hydrogen 2.712 N/A ASN 52.A N ASP 114.A OD1 no hydrogen 2.734 N/A ASN 52.A ND2 GLU 111.A OE1 no hydrogen 3.490 N/A ASN 52.A ND2 GLU 111.A OE2 no hydrogen 3.273 N/A ASN 52.A ND2 LEU 112.A O no hydrogen 2.863 N/A GLY 53.A N ARG 73.A O no hydrogen 2.781 N/A LEU 54.A N LEU 115.A O no hydrogen 2.762 N/A GLU 55.A N THR 75.A O no hydrogen 2.792 N/A ILE 56.A N VAL 117.A O no hydrogen 2.923 N/A GLY 57.A N ILE 77.A O no hydrogen 2.885 N/A CYS 58.A N ASP 78.A OD2 no hydrogen 2.885 N/A CYS 58.A SG ALA 59.A O no hydrogen 3.639 N/A CYS 58.A SG ASP 78.A OD2 no hydrogen 3.675 N/A GLY 61.A N CYS 58.A O no hydrogen 2.797 N/A THR 64.A OG1 GLU 55.A OE1 no hydrogen 2.634 N/A GLU 65.A N GLY 61.A O no hydrogen 2.926 N/A LYS 66.A N PHE 63.A O no hydrogen 2.952 N/A LYS 66.A NZ HIS 37.A ND1 no hydrogen 2.893 N/A LEU 67.A N PHE 63.A O no hydrogen 2.864 N/A ALA 68.A N THR 64.A O no hydrogen 2.784 N/A HIS 70.A N LEU 67.A O no hydrogen 3.020 N/A CYS 71.A N ALA 68.A O no hydrogen 3.239 N/A CYS 71.A SG LEU 67.A O no hydrogen 3.537 N/A LYS 72.A N VAL 50.A O no hydrogen 2.922 N/A ARG 73.A N SER 51.A O no hydrogen 3.166 N/A ARG 73.A NH1 GLU 111.A OE2 no hydrogen 3.115 N/A LEU 74.A N HIS 96.A O no hydrogen 3.126 N/A THR 75.A N GLY 53.A O no hydrogen 2.784 N/A VAL 76.A N SER 98.A O no hydrogen 2.819 N/A ILE 77.A N GLU 55.A O no hydrogen 2.943 N/A ASP 78.A N ALA 100.A O no hydrogen 3.116 N/A MET 80.A N ASP 78.A OD1 no hydrogen 2.842 N/A ALA 83.A N MET 80.A O no hydrogen 2.830 N/A ILE 84.A N MET 80.A O no hydrogen 3.392 N/A GLY 85.A N PRO 81.A O no hydrogen 2.988 N/A ARG 86.A N ARG 82.A O no hydrogen 3.094 N/A ARG 86.A NH1 LEU 19.A O no hydrogen 2.833 N/A ARG 86.A NH1 ASN 21.A O no hydrogen 2.539 N/A ARG 86.A NH2 ASP 22.A O no hydrogen 2.812 N/A ALA 87.A N ALA 83.A O no hydrogen 2.974 N/A CYS 88.A N ILE 84.A O no hydrogen 2.947 N/A CYS 88.A SG ILE 84.A O no hydrogen 3.542 N/A CYS 88.A SG GLY 85.A O no hydrogen 3.759 N/A GLN 89.A N GLY 85.A O no hydrogen 3.389 N/A ARG 90.A N ARG 86.A O no hydrogen 3.126 N/A ARG 90.A NE GLU 65.A OE1 no hydrogen 2.607 N/A ARG 90.A NH1 ASP 28.A OD2 no hydrogen 2.736 N/A ARG 90.A NH2 ASP 28.A OD1 no hydrogen 2.861 N/A ARG 90.A NH2 GLU 65.A OE1 no hydrogen 3.148 N/A THR 91.A N ALA 87.A O no hydrogen 2.940 N/A THR 91.A OG1 ALA 87.A O no hydrogen 3.091 N/A TRP 94.A N THR 91.A O no hydrogen 3.140 N/A HIS 96.A NE2 ALA 68.A O no hydrogen 2.731 N/A SER 98.A N LEU 74.A O no hydrogen 2.810 N/A ALA 100.A N VAL 76.A O no hydrogen 2.943 N/A LEU 105.A N ASP 103.A OD1 no hydrogen 2.945 N/A GLN 106.A N ASP 103.A O no hydrogen 2.912 N/A PHE 107.A N ILE 104.A O no hydrogen 3.428 N/A PHE 113.A N MET 141.A O no hydrogen 2.852 N/A ASP 114.A N ASN 52.A O no hydrogen 3.102 N/A ILE 116.A N HIS 147.A O no hydrogen 3.098 N/A VAL 117.A N LEU 54.A O no hydrogen 2.806 N/A VAL 118.A N VAL 149.A O no hydrogen 3.012 N/A GLU 120.A N GLY 151.A O no hydrogen 3.002 N/A TYR 123.A OH GLU 120.A OE1 no hydrogen 3.199 N/A TYR 124.A N VAL 121.A O no hydrogen 2.994 N/A LEU 125.A N LEU 122.A O no hydrogen 3.236 N/A GLU 126.A N GLN 130.A OE1 no hydrogen 3.056 N/A GLN 130.A N ASP 127.A OD1 no hydrogen 2.875 N/A GLN 130.A NE2 GLU 126.A OE1 no hydrogen 3.137 N/A MET 131.A N ASP 127.A O no hydrogen 3.195 N/A ARG 132.A N MET 128.A O no hydrogen 3.123 N/A THR 133.A N THR 129.A O no hydrogen 2.961 N/A THR 133.A OG1 THR 129.A O no hydrogen 3.246 N/A ALA 134.A N GLN 130.A O no hydrogen 2.905 N/A ILE 135.A N MET 131.A O no hydrogen 2.760 N/A ASP 136.A N ARG 132.A O no hydrogen 2.779 N/A ASN 137.A N THR 133.A O no hydrogen 3.036 N/A ASN 137.A ND2 ILE 104.A O no hydrogen 2.875 N/A ASN 137.A ND2 PHE 107.A O no hydrogen 2.784 N/A MET 138.A N ALA 134.A O no hydrogen 2.998 N/A VAL 139.A N ILE 135.A O no hydrogen 2.884 N/A LYS 140.A N ASP 136.A O no hydrogen 2.880 N/A LYS 140.A NZ ASN 137.A OD1 no hydrogen 3.514 N/A MET 141.A N ASN 137.A O no hydrogen 3.023 N/A LEU 142.A N VAL 139.A O no hydrogen 3.043 N/A ALA 143.A N PHE 113.A O no hydrogen 2.936 N/A GLY 146.A N ALA 143.A O no hydrogen 2.870 N/A HIS 147.A N ASP 114.A O no hydrogen 2.975 N/A LEU 148.A N PHE 200.A O no hydrogen 2.821 N/A VAL 149.A N ILE 116.A O no hydrogen 2.817 N/A PHE 150.A N ALA 198.A O no hydrogen 2.893 N/A GLY 151.A N VAL 118.A O no hydrogen 3.072 N/A SER 152.A N LEU 196.A O no hydrogen 2.986 N/A SER 152.A OG ALA 153.A O no hydrogen 2.752 N/A ALA 153.A N GLU 120.A OE1 no hydrogen 3.085 N/A ARG 154.A N ASP 194.A O no hydrogen 3.247 N/A ARG 154.A NE ASP 194.A OD1 no hydrogen 3.259 N/A ARG 154.A NH1 GLU 168.A OE2 no hydrogen 3.207 N/A ASP 155.A N GLU 168.A OE1 no hydrogen 2.863 N/A THR 157.A OG1 ALA 191.A O no hydrogen 3.108 N/A CYS 158.A N ARG 154.A O no hydrogen 2.820 N/A CYS 158.A SG ALA 153.A O no hydrogen 3.601 N/A CYS 158.A SG ARG 154.A O no hydrogen 3.451 N/A CYS 158.A SG ALA 165.A O no hydrogen 3.990 N/A ARG 159.A N ASP 155.A O no hydrogen 2.776 N/A ARG 160.A N ALA 156.A O no hydrogen 3.009 N/A ARG 160.A NH2 ASP 192.A OD2 no hydrogen 2.432 N/A TRP 161.A N THR 157.A O no hydrogen 2.975 N/A GLY 162.A N ARG 159.A O no hydrogen 3.071 N/A HIS 163.A N CYS 158.A O no hydrogen 2.897 N/A GLY 166.A N ASP 155.A OD1 no hydrogen 2.760 N/A ALA 167.A N ALA 153.A O no hydrogen 2.984 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.627 N/A THR 169.A N ASP 155.A OD1 no hydrogen 3.323 N/A THR 169.A OG1 ASP 155.A OD1 no hydrogen 3.251 N/A THR 169.A OG1 ASP 155.A OD2 no hydrogen 2.716 N/A VAL 170.A N GLY 166.A O no hydrogen 3.090 N/A ILE 171.A N ALA 167.A O no hydrogen 2.801 N/A THR 172.A N GLU 168.A O no hydrogen 3.063 N/A THR 172.A OG1 GLU 168.A O no hydrogen 3.009 N/A ILE 173.A N THR 169.A O no hydrogen 3.254 N/A LEU 174.A N VAL 170.A O no hydrogen 2.721 N/A THR 175.A N ILE 171.A O no hydrogen 2.911 N/A THR 175.A OG1 ILE 171.A O no hydrogen 2.590 N/A GLU 176.A N ILE 173.A O no hydrogen 3.178 N/A ALA 177.A N LEU 174.A O no hydrogen 3.156 N/A LEU 178.A N LEU 174.A O no hydrogen 2.902 N/A THR 179.A N ARG 201.A O no hydrogen 2.919 N/A VAL 181.A N ARG 199.A O no hydrogen 2.823 N/A ARG 183.A NE GLU 180.A OE2 no hydrogen 2.814 N/A ARG 183.A NH2 GLU 180.A OE1 no hydrogen 2.732 N/A ARG 183.A NH2 GLU 180.A OE2 no hydrogen 3.360 N/A VAL 184.A N LEU 197.A O no hydrogen 2.711 N/A GLN 185.A NE2 ASP 194.A OD1 no hydrogen 3.413 N/A CYS 186.A N CYS 195.A O no hydrogen 2.849 N/A GLY 188.A N GLU 193.A O no hydrogen 2.820 N/A GLN 189.A N GLU 193.A OE1 no hydrogen 2.779 N/A GLU 193.A N SER 190.A O no hydrogen 3.023 N/A CYS 195.A N CYS 186.A O no hydrogen 2.832 N/A CYS 195.A SG GLU 120.A OE2 no hydrogen 3.357 N/A CYS 195.A SG SER 152.A O no hydrogen 3.604 N/A CYS 195.A SG LEU 196.A O no hydrogen 3.711 N/A LEU 196.A N SER 152.A O no hydrogen 2.925 N/A LEU 197.A N VAL 184.A O no hydrogen 2.782 N/A ALA 198.A N PHE 150.A O no hydrogen 2.939 N/A ARG 199.A N GLU 182.A O no hydrogen 2.900 N/A ARG 199.A NE LEU 43.A O no hydrogen 3.081 N/A ARG 199.A NH2 SER 47.A OG no hydrogen 2.677 N/A PHE 200.A N LEU 148.A O no hydrogen 2.692 N/A ARG 201.A N THR 179.A O no hydrogen 2.754 N/A ASN 202.A N GLY 146.A O no hydrogen 3.129 N/A ASN 202.A ND2 ALA 143.A O no hydrogen 3.227 N/A