Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jqr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N LEU 215.A O no hydrogen 2.968 N/A VAL 6.A N ILE 213.A O no hydrogen 2.788 N/A GLU 9.A N SER 7.A OG no hydrogen 3.192 N/A SER 17.A N ASN 63.A OD1 no hydrogen 2.801 N/A SER 17.A OG GLU 14.A O no hydrogen 2.565 N/A PHE 19.A N TYR 62.A O no hydrogen 2.836 N/A ALA 21.A N TYR 55.A OH no hydrogen 2.912 N/A GLN 28.A N ASN 26.A OD1 no hydrogen 2.890 N/A ALA 29.A N ASN 26.A OD1 no hydrogen 3.079 N/A GLN 31.A N TYR 48.A O no hydrogen 2.965 N/A GLN 31.A NE2 THR 24.A O no hydrogen 2.678 N/A THR 33.A N HIS 46.A O no hydrogen 2.695 N/A ASP 34.A N THR 33.A OG1 no hydrogen 2.864 N/A PHE 35.A N PHE 44.A O no hydrogen 2.967 N/A LYS 36.A NZ ASN 40.A OD1 no hydrogen 2.899 N/A ASP 37.A N ILE 42.A O no hydrogen 3.422 N/A LYS 39.A N ASP 37.A OD2 no hydrogen 2.929 N/A ASN 40.A N ASP 37.A O no hydrogen 2.987 N/A LEU 41.A N ASP 37.A OD1 no hydrogen 2.715 N/A ILE 42.A N ASP 37.A OD1 no hydrogen 2.920 N/A ASN 43.A N THR 103.A O no hydrogen 2.832 N/A ASN 43.A ND2 ASP 34.A OD1 no hydrogen 3.010 N/A PHE 44.A N PHE 35.A O no hydrogen 2.796 N/A ASN 45.A ND2 GLU 32.A OE2 no hydrogen 2.965 N/A ASN 45.A ND2 PRO 99.A O no hydrogen 2.903 N/A HIS 46.A N THR 33.A O no hydrogen 2.760 N/A HIS 46.A ND1 PHE 60.A O no hydrogen 2.665 N/A HIS 46.A NE2 TYR 55.A OH no hydrogen 2.688 N/A TYR 47.A N ALA 58.A O no hydrogen 2.859 N/A TYR 48.A N GLN 31.A O no hydrogen 2.923 N/A ALA 49.A N SER 56.A O no hydrogen 2.929 N/A ASP 50.A N ASN 26.A O no hydrogen 3.008 N/A GLY 52.A N ASP 50.A OD1 no hydrogen 2.935 N/A GLY 54.A N ASP 50.A OD1 no hydrogen 3.018 N/A TYR 55.A OH HIS 46.A NE2 no hydrogen 2.688 N/A SER 56.A N ALA 49.A O no hydrogen 2.751 N/A ALA 58.A N TYR 47.A O no hydrogen 3.018 N/A GLY 59.A N ASP 90.A O no hydrogen 2.698 N/A PHE 60.A N ASN 45.A O no hydrogen 2.993 N/A SER 61.A N GLY 88.A O no hydrogen 2.918 N/A SER 61.A OG TYR 62.A O no hydrogen 3.530 N/A ASN 63.A N SER 17.A O no hydrogen 3.139 N/A ASN 63.A ND2 GLU 14.A O no hydrogen 2.909 N/A ASN 67.A ND2 ILE 76.A O no hydrogen 2.768 N/A GLN 68.A N ASP 66.A OD1 no hydrogen 3.010 N/A THR 69.A N ASP 66.A OD1 no hydrogen 2.852 N/A THR 69.A OG1 ASP 66.A OD1 no hydrogen 3.204 N/A THR 69.A OG1 ASP 66.A OD2 no hydrogen 2.710 N/A SER 72.A N THR 69.A O no hydrogen 3.098 N/A SER 72.A OG ASP 66.A O no hydrogen 2.575 N/A ALA 74.A N SER 72.A OG no hydrogen 3.294 N/A ILE 76.A N ASN 118.A O no hydrogen 3.028 N/A THR 77.A OG1 LYS 79.A O no hydrogen 2.688 N/A GLY 78.A N PRO 75.A O no hydrogen 2.830 N/A LYS 79.A N THR 77.A OG1 no hydrogen 3.216 N/A LYS 81.A N ASP 211.A OD2 no hydrogen 2.786 N/A ILE 82.A N ASP 211.A OD2 no hydrogen 2.968 N/A SER 84.A N GLU 9.A OE1 no hydrogen 3.482 N/A SER 84.A N GLU 9.A OE2 no hydrogen 2.866 N/A SER 84.A OG GLU 9.A OE1 no hydrogen 3.301 N/A VAL 85.A N GLU 9.A OE2 no hydrogen 2.744 N/A TYR 86.A OH ILE 64.A O no hydrogen 2.581 N/A ILE 87.A N LEU 210.A O no hydrogen 2.752 N/A GLY 88.A N SER 61.A O no hydrogen 2.713 N/A VAL 89.A N PHE 208.A O no hydrogen 2.840 N/A ASP 90.A N GLY 59.A O no hydrogen 3.019 N/A SER 91.A N SER 206.A O no hydrogen 3.136 N/A SER 91.A OG PHE 191.A O no hydrogen 2.602 N/A THR 92.A N THR 98.A O no hydrogen 3.169 N/A THR 92.A OG1 THR 98.A OG1 no hydrogen 3.375 N/A THR 98.A N THR 92.A OG1 no hydrogen 2.947 N/A THR 98.A OG1 THR 92.A OG1 no hydrogen 3.375 N/A THR 98.A OG1 THR 98.A O no hydrogen 2.690 N/A ALA 100.A N SER 91.A OG no hydrogen 2.915 N/A ILE 101.A N ASN 45.A OD1 no hydrogen 2.891 N/A LEU 102.A N VAL 189.A O no hydrogen 2.849 N/A THR 103.A N ASN 43.A O no hydrogen 2.861 N/A ILE 104.A N VAL 187.A O no hydrogen 2.666 N/A LEU 105.A N LEU 41.A O no hydrogen 2.755 N/A ASP 106.A N LEU 41.A O no hydrogen 3.306 N/A TYR 109.A N ASP 106.A O no hydrogen 3.095 N/A TYR 109.A OH ASN 2.A OD1 no hydrogen 2.650 N/A LYS 110.A N ILE 216.A O no hydrogen 2.895 N/A LYS 110.A NZ THR 181.A O no hydrogen 2.984 N/A LYS 110.A NZ GLN 184.A O no hydrogen 3.140 N/A LYS 112.A N THR 214.A O no hydrogen 2.753 N/A LYS 112.A NZ GLU 3.A OE1 no hydrogen 3.138 N/A LYS 112.A NZ GLU 3.A OE2 no hydrogen 3.059 N/A GLY 113.A N THR 214.A O no hydrogen 3.399 N/A THR 114.A N PHE 178.A O no hydrogen 3.040 N/A THR 114.A OG1 TRP 115.A O no hydrogen 3.008 N/A THR 114.A OG1 ASP 211.A O no hydrogen 3.255 N/A TRP 115.A N ASP 211.A O no hydrogen 2.837 N/A ILE 116.A N ILE 176.A O no hydrogen 2.797 N/A ALA 117.A N CYS 209.A O no hydrogen 2.966 N/A ASN 118.A ND2 LEU 161.A O no hydrogen 2.899 N/A ASN 118.A ND2 VAL 172.A O no hydrogen 2.953 N/A SER 119.A OG TYR 207.A O no hydrogen 2.703 N/A THR 120.A N ALA 74.A O no hydrogen 2.774 N/A THR 120.A OG1 ALA 74.A O no hydrogen 2.945 N/A TRP 121.A N SER 72.A O no hydrogen 3.000 N/A TRP 121.A NE1 ASP 128.A OD2 no hydrogen 3.085 N/A ALA 122.A N SER 119.A OG no hydrogen 3.065 N/A TYR 123.A N SER 119.A O no hydrogen 2.990 N/A GLY 127.A N GLY 124.A O no hydrogen 2.839 N/A ASP 128.A N ALA 131.A O no hydrogen 2.961 N/A ALA 131.A N ASP 128.A OD1 no hydrogen 2.798 N/A ARG 132.A N ASP 197.A OD2 no hydrogen 2.877 N/A ARG 132.A NH1 ALA 133.A O no hydrogen 3.166 N/A ARG 132.A NH1 ASP 138.A OD2 no hydrogen 2.821 N/A ARG 132.A NH2 ASP 138.A OD1 no hydrogen 3.003 N/A LYS 135.A N ASP 138.A OD2 no hydrogen 2.807 N/A ALA 136.A N ASP 167.A OD1 no hydrogen 2.920 N/A GLY 137.A N TYR 164.A O no hydrogen 2.740 N/A ASP 138.A N LYS 135.A O no hydrogen 3.012 N/A TRP 139.A N SER 196.A OG no hydrogen 2.914 N/A TYR 140.A N ALA 162.A O no hydrogen 3.110 N/A TYR 140.A OH ALA 205.A O no hydrogen 2.726 N/A LYS 141.A N ASP 194.A O no hydrogen 2.792 N/A VAL 142.A N ILE 159.A O no hydrogen 2.965 N/A THR 143.A N ILE 192.A O no hydrogen 2.872 N/A ALA 144.A N ALA 157.A O no hydrogen 2.809 N/A THR 145.A N LYS 190.A O no hydrogen 2.906 N/A GLY 146.A N GLY 155.A O no hydrogen 2.949 N/A TYR 147.A N LYS 188.A O no hydrogen 2.835 N/A ASP 148.A N ASN 152.A O no hydrogen 2.794 N/A GLY 151.A N ASP 148.A O no hydrogen 3.127 N/A ASN 152.A N ASP 148.A OD1 no hydrogen 2.826 N/A THR 154.A N GLY 146.A O no hydrogen 2.789 N/A THR 154.A OG1 LEU 183.A O no hydrogen 2.593 N/A ALA 157.A N ALA 144.A O no hydrogen 2.899 N/A ILE 159.A N VAL 142.A O no hydrogen 3.026 N/A LEU 161.A N TYR 140.A O no hydrogen 2.726 N/A TYR 164.A N ASP 138.A O no hydrogen 2.895 N/A LYS 165.A N ASP 169.A OD2 no hydrogen 2.590 N/A THR 166.A N ASP 169.A OD2 no hydrogen 3.322 N/A ASN 168.A N THR 166.A OG1 no hydrogen 3.245 N/A ASP 169.A N THR 166.A O no hydrogen 3.229 N/A VAL 172.A N LEU 161.A O no hydrogen 2.825 N/A TRP 175.A NE1 LYS 79.A O no hydrogen 2.921 N/A ILE 176.A N ILE 116.A O no hydrogen 2.839 N/A PHE 178.A N THR 114.A O no hydrogen 2.791 N/A LEU 180.A N LYS 112.A O no hydrogen 2.954 N/A THR 181.A N ASP 179.A OD1 no hydrogen 3.065 N/A THR 181.A OG1 ASP 179.A OD1 no hydrogen 2.630 N/A THR 181.A OG1 ASP 179.A OD2 no hydrogen 3.406 N/A LEU 183.A N LEU 180.A O no hydrogen 3.060 N/A GLN 184.A N THR 181.A O no hydrogen 3.000 N/A GLN 184.A NE2 PRO 182.A O no hydrogen 3.019 N/A VAL 187.A N TYR 147.A O no hydrogen 2.796 N/A LYS 188.A N TYR 147.A O no hydrogen 3.061 N/A LYS 188.A NZ THR 103.A OG1 no hydrogen 3.235 N/A VAL 189.A N LEU 102.A O no hydrogen 2.914 N/A LYS 190.A N THR 145.A O no hydrogen 2.886 N/A LYS 190.A NZ ASP 93.A OD2 no hydrogen 2.905 N/A LYS 190.A NZ TYR 147.A OH no hydrogen 3.033 N/A PHE 191.A N ALA 100.A O no hydrogen 2.961 N/A ILE 192.A N THR 143.A O no hydrogen 2.861 N/A ASP 194.A N LYS 141.A O no hydrogen 2.829 N/A SER 195.A N ASP 194.A OD1 no hydrogen 2.935 N/A SER 195.A OG THR 204.A OG1 no hydrogen 2.708 N/A SER 196.A N TRP 139.A O no hydrogen 3.089 N/A SER 196.A OG ASP 138.A OD1 no hydrogen 2.709 N/A SER 196.A OG TRP 139.A O no hydrogen 3.305 N/A ASP 197.A N SER 195.A OG no hydrogen 3.100 N/A LYS 198.A NZ ASP 194.A OD1 no hydrogen 3.255 N/A LYS 198.A NZ ASP 194.A OD2 no hydrogen 2.698 N/A ASN 199.A N GLY 202.A O no hydrogen 2.914 N/A TYR 201.A N ASN 199.A OD1 no hydrogen 2.947 N/A GLY 202.A N ASN 199.A O no hydrogen 3.280 N/A ASN 203.A ND2 ASP 197.A OD1 no hydrogen 2.963 N/A THR 204.A OG1 SER 195.A OG no hydrogen 2.708 N/A SER 206.A OG ASP 90.A OD1 no hydrogen 2.674 N/A PHE 208.A N VAL 89.A O no hydrogen 2.926 N/A CYS 209.A N ALA 117.A O no hydrogen 2.883 N/A CYS 209.A SG PRO 73.A O no hydrogen 3.286 N/A LEU 210.A N ILE 87.A O no hydrogen 2.843 N/A ASP 211.A N TRP 115.A O no hydrogen 3.138 N/A GLY 212.A N ASP 211.A OD1 no hydrogen 2.935 N/A THR 214.A N GLY 113.A O no hydrogen 2.870 N/A THR 214.A OG1 GLY 212.A O no hydrogen 2.748 N/A LEU 215.A N VAL 4.A O no hydrogen 2.873 N/A ILE 216.A N LYS 110.A O no hydrogen 2.833 N/A GLU 217.A N ASN 2.A O no hydrogen 3.007 N/A LYS 218.A N ASN 108.A O no hydrogen 2.913 N/A LYS 218.A NZ THR 107.A O no hydrogen 2.945 N/A