Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4oqe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N GLU 196.A O no hydrogen 3.422 N/A GLN 1.A NE2 SER 5.A O no hydrogen 3.055 N/A TYR 4.A OH HIS 112.A NE2 no hydrogen 2.707 N/A SER 5.A N GLN 1.A OE1 no hydrogen 3.195 N/A SER 5.A OG ASP 3.A OD2 no hydrogen 2.513 N/A GLY 6.A N ASP 72.A OD2 no hydrogen 2.920 N/A ALA 9.A N SER 5.A O no hydrogen 3.490 N/A GLU 10.A N GLY 6.A O no hydrogen 3.201 N/A LEU 11.A N GLU 7.A O no hydrogen 2.768 N/A TYR 12.A N ILE 8.A O no hydrogen 2.913 N/A TYR 12.A N ALA 9.A O no hydrogen 3.088 N/A LEU 14.A N LEU 11.A O no hydrogen 3.065 N/A VAL 15.A N LEU 11.A O no hydrogen 3.096 N/A HIS 16.A N TYR 12.A O no hydrogen 3.201 N/A HIS 16.A ND1 TYR 12.A O no hydrogen 2.886 N/A GLN 17.A N ASP 13.A O no hydrogen 3.150 N/A GLY 18.A N LEU 14.A O no hydrogen 2.861 N/A LYS 19.A N VAL 15.A O no hydrogen 3.026 N/A GLY 20.A N GLN 17.A O no hydrogen 2.673 N/A LYS 21.A N HIS 16.A O no hydrogen 2.981 N/A LYS 21.A NZ GLU 26.A OE1 no hydrogen 3.156 N/A LYS 21.A NZ GLU 26.A OE2 no hydrogen 2.847 N/A ARG 25.A N ASP 22.A OD1 no hydrogen 3.528 N/A GLU 26.A N ASP 22.A O no hydrogen 2.917 N/A ALA 27.A N TYR 23.A O no hydrogen 2.666 N/A ALA 28.A N HIS 24.A O no hydrogen 2.741 N/A ASP 29.A N ARG 25.A O no hydrogen 2.702 N/A LEU 30.A N GLU 26.A O no hydrogen 2.826 N/A ALA 31.A N ALA 27.A O no hydrogen 2.702 N/A ALA 32.A N ALA 28.A O no hydrogen 3.127 N/A LEU 33.A N ASP 29.A O no hydrogen 2.829 N/A VAL 34.A N LEU 30.A O no hydrogen 2.921 N/A VAL 34.A N ALA 31.A O no hydrogen 3.109 N/A ARG 35.A N ALA 31.A O no hydrogen 3.034 N/A ARG 36.A N ALA 32.A O no hydrogen 3.079 N/A HIS 37.A N VAL 34.A O no hydrogen 2.910 N/A SER 38.A N VAL 34.A O no hydrogen 2.535 N/A SER 42.A N SER 101.A OG no hydrogen 3.188 N/A LEU 43.A N THR 63.A O no hydrogen 2.753 N/A LEU 44.A N ALA 102.A O no hydrogen 2.909 N/A ASP 45.A N GLU 65.A O no hydrogen 2.874 N/A VAL 46.A N THR 104.A O no hydrogen 2.862 N/A ALA 47.A N LEU 67.A O no hydrogen 2.330 N/A CYS 48.A N LEU 67.A O no hydrogen 3.378 N/A CYS 48.A SG GLY 49.A O no hydrogen 3.880 N/A GLY 49.A N GLU 68.A OE1 no hydrogen 2.916 N/A THR 50.A OG1 ASP 13.A OD1 no hydrogen 2.528 N/A GLY 51.A N CYS 48.A O no hydrogen 2.885 N/A HIS 53.A NE2 GLU 26.A OE1 no hydrogen 2.868 N/A ARG 55.A N GLY 51.A O no hydrogen 3.038 N/A ARG 55.A NE ARG 55.A O no hydrogen 3.259 N/A HIS 56.A N HIS 53.A O no hydrogen 2.934 N/A HIS 56.A ND1 MET 52.A O no hydrogen 3.275 N/A LEU 57.A N HIS 53.A O no hydrogen 2.908 N/A SER 60.A N LEU 57.A O no hydrogen 2.875 N/A THR 63.A N ALA 41.A O no hydrogen 2.701 N/A GLU 65.A N LEU 43.A O no hydrogen 2.843 N/A GLY 66.A N VAL 85.A O no hydrogen 3.255 N/A LEU 67.A N ASP 45.A O no hydrogen 3.083 N/A GLU 68.A N HIS 87.A O no hydrogen 3.025 N/A SER 70.A N GLU 68.A OE2 no hydrogen 2.714 N/A SER 70.A OG TYR 4.A O no hydrogen 2.658 N/A MET 73.A N SER 70.A OG no hydrogen 3.061 N/A LEU 74.A N SER 70.A O no hydrogen 3.253 N/A ALA 75.A N ALA 71.A O no hydrogen 2.946 N/A ALA 77.A N MET 73.A O no hydrogen 3.166 N/A ARG 78.A N LEU 74.A O no hydrogen 2.865 N/A ARG 78.A NH1 LEU 86.A O no hydrogen 2.813 N/A ARG 79.A N ALA 75.A O no hydrogen 2.997 N/A ARG 80.A N ILE 76.A O no hydrogen 2.914 N/A ARG 80.A NH1 ASP 13.A OD2 no hydrogen 3.066 N/A ARG 80.A NH2 ASP 13.A OD2 no hydrogen 2.854 N/A ARG 80.A NH2 THR 50.A O no hydrogen 2.772 N/A ASN 81.A N ALA 77.A O no hydrogen 2.759 N/A ASN 81.A ND2 GLY 51.A O no hydrogen 3.167 N/A ASN 81.A ND2 ALA 77.A O no hydrogen 3.174 N/A ALA 84.A N ASN 81.A O no hydrogen 3.220 N/A HIS 87.A N GLY 66.A O no hydrogen 2.828 N/A HIS 87.A NE2 GLU 65.A OE1 no hydrogen 2.719 N/A GLY 89.A N GLU 68.A O no hydrogen 2.999 N/A ARG 92.A N ASP 90.A OD1 no hydrogen 3.167 N/A ARG 92.A NE ASP 90.A OD1 no hydrogen 2.897 N/A ARG 92.A NH1 GLU 118.A OE1 no hydrogen 3.413 N/A ARG 92.A NH1 GLU 118.A OE2 no hydrogen 2.683 N/A ARG 92.A NH2 ASP 90.A OD1 no hydrogen 3.320 N/A ARG 92.A NH2 ASP 90.A OD2 no hydrogen 2.569 N/A ASP 93.A N ASP 90.A O no hydrogen 2.948 N/A LEU 96.A N HIS 129.A NE2 no hydrogen 3.200 N/A ARG 98.A NE ARG 99.A O no hydrogen 2.890 N/A ARG 98.A NH2 ARG 99.A O no hydrogen 3.107 N/A PHE 100.A N HIS 129.A O no hydrogen 2.805 N/A SER 101.A N SER 42.A OG no hydrogen 3.032 N/A ALA 102.A N SER 42.A O no hydrogen 3.103 N/A VAL 103.A N VAL 135.A O no hydrogen 2.992 N/A THR 104.A N LEU 44.A O no hydrogen 2.829 N/A THR 104.A OG1 ASP 45.A OD1 no hydrogen 2.701 N/A CYS 105.A N VAL 137.A O no hydrogen 2.795 N/A CYS 105.A SG VAL 46.A O no hydrogen 3.465 N/A PHE 107.A N GLU 139.A OE1 no hydrogen 2.754 N/A SER 108.A OG PRO 140.A O no hydrogen 2.794 N/A SER 109.A N MET 106.A O no hydrogen 3.319 N/A SER 109.A OG MET 106.A O no hydrogen 2.833 N/A GLY 111.A N SER 108.A O no hydrogen 3.100 N/A HIS 112.A N SER 109.A O no hydrogen 3.076 N/A LEU 113.A N ILE 110.A O no hydrogen 2.851 N/A ALA 114.A N GLU 118.A OE1 no hydrogen 2.848 N/A GLN 116.A NE2 ASP 120.A OD1 no hydrogen 2.663 N/A GLN 116.A NE2 ASP 120.A OD2 no hydrogen 3.570 N/A GLN 116.A NE2 GLN 208.A O no hydrogen 3.082 N/A LEU 119.A N GLY 115.A O no hydrogen 2.994 N/A ASP 120.A N GLN 116.A O no hydrogen 2.947 N/A ALA 121.A N ALA 117.A O no hydrogen 3.155 N/A ALA 122.A N GLU 118.A O no hydrogen 3.194 N/A LEU 123.A N LEU 119.A O no hydrogen 2.924 N/A GLU 124.A N ASP 120.A O no hydrogen 2.785 N/A ARG 125.A N ALA 121.A O no hydrogen 2.801 N/A ARG 125.A NE PHE 94.A O no hydrogen 3.135 N/A ARG 125.A NH1 PHE 94.A O no hydrogen 3.025 N/A ARG 125.A NH2 GLU 124.A OE1 no hydrogen 2.743 N/A PHE 126.A N ALA 122.A O no hydrogen 2.786 N/A ALA 127.A N LEU 123.A O no hydrogen 2.916 N/A ALA 128.A N GLU 124.A O no hydrogen 3.062 N/A HIS 129.A N PHE 126.A O no hydrogen 2.766 N/A HIS 129.A ND1 ARG 125.A O no hydrogen 2.898 N/A VAL 130.A N ALA 127.A O no hydrogen 3.461 N/A LEU 131.A N PHE 100.A O no hydrogen 2.879 N/A GLY 134.A N LEU 131.A O no hydrogen 2.932 N/A VAL 135.A N SER 101.A O no hydrogen 2.857 N/A VAL 136.A N GLY 235.A O no hydrogen 2.787 N/A VAL 137.A N VAL 103.A O no hydrogen 2.930 N/A VAL 138.A N PHE 233.A O no hydrogen 2.936 N/A GLU 139.A N CYS 105.A O no hydrogen 2.972 N/A TRP 141.A N TYR 209.A OH no hydrogen 3.317 N/A TRP 141.A NE1 THR 177.A OG1 no hydrogen 3.068 N/A ASN 146.A N PHE 143.A O no hydrogen 3.082 N/A PHE 147.A N PRO 144.A O no hydrogen 3.064 N/A THR 148.A OG1 THR 148.A O no hydrogen 2.445 N/A ALA 153.A N SER 168.A O no hydrogen 3.018 N/A GLY 155.A N ARG 166.A O no hydrogen 2.992 N/A THR 156.A OG1 THR 165.A OG1 no hydrogen 2.655 N/A VAL 157.A N VAL 164.A O no hydrogen 2.834 N/A ALA 159.A N THR 162.A O no hydrogen 2.922 N/A THR 162.A N ALA 159.A O no hydrogen 3.216 N/A THR 163.A N ALA 186.A O no hydrogen 2.816 N/A VAL 164.A N VAL 157.A O no hydrogen 2.627 N/A THR 165.A N LEU 184.A O no hydrogen 2.998 N/A THR 165.A OG1 THR 156.A OG1 no hydrogen 2.655 N/A ARG 166.A N GLY 155.A O no hydrogen 2.901 N/A VAL 167.A N HIS 182.A O no hydrogen 2.833 N/A SER 168.A N ALA 153.A O no hydrogen 2.982 N/A HIS 169.A N GLU 180.A O no hydrogen 2.860 N/A SER 170.A N TYR 151.A O no hydrogen 2.856 N/A SER 171.A N ARG 178.A O no hydrogen 3.098 N/A SER 171.A OG ARG 178.A O no hydrogen 3.468 N/A ARG 172.A NH2 GLU 175.A OE2 no hydrogen 3.463 N/A GLU 173.A N ALA 176.A O no hydrogen 2.955 N/A THR 177.A N ILE 201.A O no hydrogen 3.077 N/A ARG 178.A N SER 171.A O no hydrogen 2.904 N/A ARG 178.A NE GLU 173.A OE1 no hydrogen 3.335 N/A ARG 178.A NE GLU 173.A OE2 no hydrogen 3.496 N/A ARG 178.A NH1 SER 198.A OG no hydrogen 3.154 N/A ARG 178.A NH2 GLU 173.A OE2 no hydrogen 2.959 N/A ILE 179.A N HIS 199.A O no hydrogen 3.239 N/A GLU 180.A N HIS 169.A O no hydrogen 2.870 N/A VAL 181.A N GLU 197.A O no hydrogen 2.791 N/A HIS 182.A N VAL 167.A O no hydrogen 2.888 N/A TYR 183.A N HIS 195.A O no hydrogen 2.856 N/A TYR 183.A OH GLU 197.A OE1 no hydrogen 2.405 N/A LEU 184.A N THR 165.A O no hydrogen 2.900 N/A VAL 185.A N THR 193.A O no hydrogen 2.987 N/A ALA 186.A N THR 163.A O no hydrogen 2.892 N/A GLY 187.A N GLY 191.A O no hydrogen 3.150 N/A ARG 190.A NH2 GLU 7.A OE2 no hydrogen 3.410 N/A GLY 191.A N GLY 187.A O no hydrogen 3.108 N/A THR 193.A N VAL 185.A O no hydrogen 2.943 N/A THR 193.A OG1 HIS 195.A NE2 no hydrogen 3.326 N/A HIS 194.A ND1 TYR 183.A O no hydrogen 3.275 N/A HIS 195.A N TYR 183.A O no hydrogen 2.858 N/A GLU 197.A N VAL 181.A O no hydrogen 2.897 N/A SER 198.A N GLN 1.A O no hydrogen 2.839 N/A HIS 199.A N ILE 179.A O no hydrogen 3.114 N/A HIS 199.A NE2 GLU 197.A OE2 no hydrogen 2.755 N/A ILE 201.A N THR 177.A O no hydrogen 2.865 N/A THR 202.A N GLY 111.A O no hydrogen 2.820 N/A THR 202.A OG1 GLY 111.A O no hydrogen 3.565 N/A THR 202.A OG1 LEU 113.A O no hydrogen 2.649 N/A LEU 203.A N GLU 175.A O no hydrogen 2.576 N/A THR 205.A N GLN 208.A OE1 no hydrogen 2.619 N/A THR 205.A OG1 GLN 208.A OE1 no hydrogen 3.412 N/A ARG 206.A NE GLU 210.A OE2 no hydrogen 3.118 N/A GLN 208.A N THR 205.A OG1 no hydrogen 2.936 N/A GLN 208.A NE2 GLN 116.A OE1 no hydrogen 3.647 N/A TYR 209.A N THR 205.A O no hydrogen 3.115 N/A GLU 210.A N ARG 206.A O no hydrogen 3.084 N/A ARG 211.A N GLU 207.A O no hydrogen 2.979 N/A ALA 212.A N GLN 208.A O no hydrogen 3.302 N/A PHE 213.A N TYR 209.A O no hydrogen 3.094 N/A THR 214.A N GLU 210.A O no hydrogen 3.016 N/A THR 214.A OG1 GLU 210.A O no hydrogen 2.486 N/A THR 214.A OG1 ARG 211.A O no hydrogen 3.517 N/A ALA 215.A N ARG 211.A O no hydrogen 2.753 N/A ALA 216.A N ALA 212.A O no hydrogen 3.024 N/A GLY 217.A N THR 214.A O no hydrogen 2.702 N/A LEU 218.A N PHE 213.A O no hydrogen 3.065 N/A SER 219.A N LEU 236.A O no hydrogen 2.941 N/A SER 219.A OG LEU 236.A O no hydrogen 3.396 N/A GLU 221.A N THR 234.A O no hydrogen 3.409 N/A MET 223.A N LEU 232.A O no hydrogen 2.894 N/A SER 228.A OG GLU 139.A OE2 no hydrogen 2.443 N/A ARG 230.A NH1 SER 108.A OG no hydrogen 2.716 N/A GLY 231.A N GLY 225.A O no hydrogen 2.760 N/A PHE 233.A N VAL 138.A O no hydrogen 2.948 N/A THR 234.A N GLU 221.A O no hydrogen 3.236 N/A GLY 235.A N VAL 136.A O no hydrogen 2.581 N/A LEU 236.A N SER 219.A O no hydrogen 3.230 N/A ALA 239.A N GLY 217.A O no hydrogen 3.124 N/A