Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qua_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLY 2.A O no hydrogen 3.432 N/A SER 8.A OG GLU 234.A O no hydrogen 3.367 N/A TYR 9.A N GLU 234.A O no hydrogen 2.847 N/A TYR 9.A OH ASP 154.A OD1 no hydrogen 2.688 N/A LYS 10.A NZ ASP 12.A OD1 no hydrogen 2.685 N/A TYR 13.A N SER 84.A OG no hydrogen 3.288 N/A GLU 15.A N LYS 82.A O no hydrogen 2.963 N/A CYS 19.A N GLU 56.A O no hydrogen 2.946 N/A ILE 20.A N VAL 87.A O no hydrogen 2.877 N/A ILE 21.A N ARG 58.A O no hydrogen 2.816 N/A ILE 22.A N VAL 89.A O no hydrogen 2.809 N/A ASN 23.A N LYS 60.A O no hydrogen 2.799 N/A ASN 23.A ND2 ASP 40.A OD1 no hydrogen 2.805 N/A ASN 23.A ND2 ASN 61.A OD1 no hydrogen 3.226 N/A ASN 24.A N LEU 91.A O no hydrogen 2.968 N/A ASN 24.A ND2 LEU 63.A O no hydrogen 3.344 N/A ASN 24.A ND2 PHE 100.A O no hydrogen 2.891 N/A LYS 25.A N ASP 62.A OD1 no hydrogen 2.794 N/A ASN 26.A N ASP 62.A OD1 no hydrogen 2.945 N/A HIS 28.A N THR 102.A O no hydrogen 3.022 N/A THR 31.A N HIS 28.A O no hydrogen 3.028 N/A THR 31.A OG1 HIS 28.A O no hydrogen 2.596 N/A GLY 32.A N LYS 29.A O no hydrogen 2.866 N/A MET 33.A N THR 31.A OG1 no hydrogen 3.181 N/A ARG 36.A N LYS 25.A O no hydrogen 2.967 N/A ARG 36.A NH1 ASN 24.A O no hydrogen 2.865 N/A ARG 36.A NH1 THR 39.A OG1 no hydrogen 2.998 N/A THR 39.A N ARG 36.A O no hydrogen 3.113 N/A THR 39.A OG1 ASN 23.A OD1 no hydrogen 2.545 N/A ASP 42.A N GLY 38.A O no hydrogen 3.393 N/A ALA 43.A N THR 39.A O no hydrogen 2.818 N/A ALA 44.A N ASP 40.A O no hydrogen 2.920 N/A ASN 45.A N VAL 41.A O no hydrogen 2.946 N/A LEU 46.A N ASP 42.A O no hydrogen 2.917 N/A ARG 47.A N ALA 43.A O no hydrogen 3.053 N/A ARG 47.A NH1 ASN 59.A OD1 no hydrogen 2.804 N/A GLU 48.A N ALA 44.A O no hydrogen 3.184 N/A THR 49.A N ASN 45.A O no hydrogen 2.918 N/A THR 49.A OG1 ASN 45.A O no hydrogen 2.710 N/A THR 49.A OG1 ASN 45.A OD1 no hydrogen 3.476 N/A PHE 50.A N LEU 46.A O no hydrogen 2.997 N/A ARG 51.A N ARG 47.A O no hydrogen 2.800 N/A ARG 51.A NE GLU 48.A OE2 no hydrogen 2.969 N/A ARG 51.A NH2 GLU 48.A OE1 no hydrogen 2.647 N/A ARG 51.A NH2 GLU 48.A OE2 no hydrogen 3.422 N/A ASN 52.A N GLU 48.A O no hydrogen 3.121 N/A ASN 52.A ND2 GLU 48.A O no hydrogen 3.093 N/A ASN 52.A ND2 GLU 48.A OE1 no hydrogen 3.019 N/A LEU 53.A N PHE 50.A O no hydrogen 3.178 N/A LYS 54.A N ARG 51.A O no hydrogen 3.047 N/A TYR 55.A N PHE 50.A O no hydrogen 2.974 N/A TYR 55.A OH SER 85.A OG no hydrogen 2.809 N/A GLU 56.A N GLY 17.A O no hydrogen 2.960 N/A ARG 58.A N CYS 19.A O no hydrogen 2.816 N/A ARG 58.A NE GLU 56.A OE2 no hydrogen 3.429 N/A ARG 58.A NH1 GLU 78.A OE2 no hydrogen 2.832 N/A ARG 58.A NH2 GLU 56.A OE2 no hydrogen 3.218 N/A ARG 58.A NH2 GLU 78.A OE1 no hydrogen 3.204 N/A ARG 58.A NH2 GLU 78.A OE2 no hydrogen 3.242 N/A ASN 59.A ND2 ALA 43.A O no hydrogen 3.656 N/A LYS 60.A N ILE 21.A O no hydrogen 2.800 N/A LYS 60.A NZ.B ASN 59.A O no hydrogen 2.675 N/A ASP 62.A N ASN 23.A O no hydrogen 2.860 N/A LEU 63.A N ASN 24.A OD1 no hydrogen 2.872 N/A THR 64.A N GLU 67.A OE1 no hydrogen 2.777 N/A THR 64.A OG1 GLU 66.A OE1 no hydrogen 3.175 N/A THR 64.A OG1 GLU 67.A OE1 no hydrogen 3.252 N/A ARG 65.A N ASN 103.A OD1 no hydrogen 2.857 N/A ARG 65.A NE.A PRO 105.A O no hydrogen 2.993 N/A ARG 65.A NE.B GLU 66.A OE2 no hydrogen 2.818 N/A ARG 65.A NH2.A PRO 105.A O no hydrogen 3.005 N/A ARG 65.A NH2.B GLU 66.A OE2 no hydrogen 3.479 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 2.799 N/A GLU 67.A N THR 64.A OG1 no hydrogen 3.050 N/A ILE 68.A N THR 64.A O no hydrogen 2.856 N/A VAL 69.A N ARG 65.A O no hydrogen 3.252 N/A GLU 70.A N GLU 66.A O no hydrogen 3.151 N/A LEU 71.A N GLU 67.A O no hydrogen 3.017 N/A MET 72.A N ILE 68.A O no hydrogen 3.039 N/A ARG 73.A N VAL 69.A O no hydrogen 2.910 N/A ARG 73.A NE GLU 70.A OE1.A no hydrogen 3.492 N/A ARG 73.A NE GLU 70.A OE2.A no hydrogen 2.758 N/A ARG 73.A NH2 GLU 70.A OE1.A no hydrogen 3.216 N/A ASP 74.A N GLU 70.A O no hydrogen 2.892 N/A VAL 75.A N LEU 71.A O no hydrogen 2.864 N/A SER 76.A N MET 72.A O no hydrogen 2.915 N/A SER 76.A OG ARG 73.A O no hydrogen 2.694 N/A LYS 77.A N ASP 74.A O no hydrogen 3.095 N/A GLU 78.A N VAL 75.A O no hydrogen 3.216 N/A HIS 80.A N SER 122.A OG no hydrogen 2.903 N/A HIS 80.A NE2 VAL 75.A O no hydrogen 2.692 N/A SER 81.A N ASP 79.A OD1 no hydrogen 3.088 N/A SER 81.A OG ASP 79.A OD1 no hydrogen 2.475 N/A ARG 83.A N HIS 80.A O no hydrogen 2.768 N/A ARG 83.A NE GLU 15.A OE2 no hydrogen 3.271 N/A ARG 83.A NH1 GLU 78.A OE1 no hydrogen 2.909 N/A ARG 83.A NH2 GLU 78.A OE1 no hydrogen 3.480 N/A SER 84.A N GLU 15.A O no hydrogen 2.804 N/A SER 84.A OG GLU 15.A O no hydrogen 3.215 N/A SER 85.A N MET 16.A O no hydrogen 2.859 N/A SER 85.A OG MET 16.A O no hydrogen 2.757 N/A SER 85.A OG TYR 55.A OH no hydrogen 2.809 N/A PHE 86.A N PRO 127.A O no hydrogen 3.008 N/A VAL 87.A N LEU 18.A O no hydrogen 2.903 N/A CYS 88.A N LEU 129.A O no hydrogen 2.787 N/A CYS 88.A SG ILE 20.A O no hydrogen 4.034 N/A VAL 89.A N ILE 20.A O no hydrogen 2.658 N/A LEU 90.A N ILE 131.A O no hydrogen 2.778 N/A LEU 91.A N ILE 22.A O no hydrogen 2.982 N/A SER 92.A N GLN 133.A O no hydrogen 3.075 N/A SER 92.A OG PHE 100.A O no hydrogen 2.614 N/A HIS 93.A NE2 THR 34.A O no hydrogen 2.849 N/A GLU 95.A N ILE 98.A O no hydrogen 3.225 N/A ILE 98.A N GLU 95.A O no hydrogen 2.886 N/A ILE 99.A N VAL 106.A O no hydrogen 3.014 N/A PHE 100.A N HIS 93.A O no hydrogen 3.078 N/A GLY 101.A N GLY 104.A O no hydrogen 2.650 N/A THR 102.A N LEU 63.A O no hydrogen 2.828 N/A ASN 103.A ND2 GLU 66.A OE1 no hydrogen 2.999 N/A ASN 103.A ND2 GLU 66.A OE2 no hydrogen 3.479 N/A GLY 104.A N GLY 101.A O no hydrogen 3.318 N/A VAL 106.A N ILE 99.A O no hydrogen 2.618 N/A LEU 108.A N GLY 97.A O no hydrogen 2.822 N/A ILE 111.A N ASP 107.A O no hydrogen 3.352 N/A THR 112.A N LEU 108.A O no hydrogen 3.008 N/A THR 112.A OG1 LEU 108.A O no hydrogen 3.422 N/A THR 112.A OG1 LYS 109.A O no hydrogen 3.441 N/A ASN 113.A N LYS 109.A O no hydrogen 2.998 N/A PHE 115.A N THR 112.A O no hydrogen 2.997 N/A ARG 116.A N ASN 113.A O no hydrogen 3.098 N/A ARG 116.A NE ASP 118.A OD1 no hydrogen 3.053 N/A ARG 116.A NH2 ASP 118.A OD1 no hydrogen 3.470 N/A ARG 116.A NH2 ASP 118.A OD2 no hydrogen 2.713 N/A GLY 117.A N VAL 151.A O no hydrogen 3.108 N/A ARG 119.A N ARG 116.A O no hydrogen 2.720 N/A CYS 120.A N ARG 116.A O no hydrogen 2.966 N/A CYS 120.A SG SER 76.A O no hydrogen 3.416 N/A ARG 121.A NH1 THR 124.A OG1 no hydrogen 3.085 N/A LEU 123.A N CYS 120.A O no hydrogen 3.061 N/A THR 124.A N ARG 121.A O no hydrogen 3.313 N/A THR 124.A OG1 GLY 117.A O no hydrogen 2.708 N/A THR 124.A OG1 CYS 120.A O no hydrogen 3.514 N/A THR 124.A OG1 ARG 121.A O no hydrogen 3.103 N/A LYS 126.A N LEU 123.A O no hydrogen 2.901 N/A LYS 126.A NZ HIS 80.A O no hydrogen 3.099 N/A LYS 126.A NZ SER 81.A O no hydrogen 3.434 N/A LYS 126.A NZ ARG 83.A O no hydrogen 2.896 N/A LYS 126.A NZ SER 122.A O no hydrogen 2.827 N/A LYS 128.A N ASP 154.A O no hydrogen 2.806 N/A LYS 128.A NZ LEU 123.A O no hydrogen 2.751 N/A LYS 128.A NZ LYS 126.A O no hydrogen 2.565 N/A LEU 129.A N PHE 86.A O no hydrogen 2.746 N/A PHE 130.A N LEU 156.A O no hydrogen 2.749 N/A ILE 131.A N CYS 88.A O no hydrogen 2.885 N/A ILE 132.A N ALA 158.A O no hydrogen 3.057 N/A GLN 133.A N LEU 90.A O no hydrogen 2.821 N/A GLN 133.A NE2 SER 167.A OG no hydrogen 2.947 N/A CYS 135.A SG SER 167.A O no hydrogen 3.841 N/A ARG 136.A N TYR 165.A O no hydrogen 2.957 N/A ARG 136.A NH1 THR 161.A O no hydrogen 3.110 N/A ARG 136.A NH2 GLU 96.A OE2 no hydrogen 2.956 N/A GLU 139.A N GLY 164.A O no hydrogen 3.046 N/A CYS 142.A SG GLY 143.A O no hydrogen 3.355 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 2.981 N/A ALA 153.A N PRO 150.A O no hydrogen 3.118 N/A ASP 154.A N MET 230.A O no hydrogen 2.895 N/A LEU 156.A N LYS 128.A O no hydrogen 2.910 N/A PHE 157.A N VAL 228.A O no hydrogen 2.792 N/A ALA 158.A N PHE 130.A O no hydrogen 2.840 N/A TYR 159.A N CYS 226.A O no hydrogen 2.879 N/A SER 160.A N ILE 132.A O no hydrogen 3.082 N/A SER 160.A OG ILE 132.A O no hydrogen 3.319 N/A SER 160.A OG SER 167.A OG no hydrogen 2.863 N/A THR 161.A OG1 TYR 166.A O no hydrogen 2.838 N/A GLY 164.A N GLU 96.A OE1 no hydrogen 3.191 N/A TYR 165.A N ALA 162.A O no hydrogen 3.148 N/A TYR 166.A N GLU 139.A O no hydrogen 2.886 N/A SER 167.A OG SER 160.A OG no hydrogen 2.863 N/A TRP 168.A N GLN 223.A OE1 no hydrogen 2.717 N/A ARG 169.A NH2 SER 37.A O no hydrogen 2.850 N/A ASN 170.A N GLY 174.A O no hydrogen 3.085 N/A LYS 172.A N ASN 170.A OD1 no hydrogen 2.891 N/A LYS 172.A NZ ASP 173.A OD1 no hydrogen 3.271 N/A ASP 173.A N ASN 170.A OD1 no hydrogen 2.690 N/A GLY 174.A N ASN 170.A O no hydrogen 2.773 N/A SER 175.A N ASP 42.A OD1 no hydrogen 2.998 N/A SER 175.A N ASP 42.A OD2 no hydrogen 3.290 N/A SER 175.A OG ASP 42.A OD2 no hydrogen 2.595 N/A TRP 176.A N TRP 168.A O no hydrogen 3.406 N/A ILE 178.A N SER 175.A OG no hydrogen 3.170 N/A GLN 179.A N SER 175.A O no hydrogen 3.036 N/A GLN 179.A NE2 GLY 174.A O no hydrogen 2.852 N/A GLN 179.A NE2 SER 175.A O no hydrogen 3.312 N/A SER 180.A N TRP 176.A O no hydrogen 3.123 N/A SER 180.A OG TRP 176.A O no hydrogen 2.632 N/A LEU 181.A N PHE 177.A O no hydrogen 2.750 N/A CYS 182.A N ILE 178.A O no hydrogen 3.044 N/A CYS 182.A SG THR 49.A OG1 no hydrogen 3.342 N/A CYS 182.A SG ILE 178.A O no hydrogen 3.368 N/A ALA 183.A N GLN 179.A O no hydrogen 3.174 N/A MET 184.A N SER 180.A O no hydrogen 3.006 N/A LEU 185.A N LEU 181.A O no hydrogen 2.935 N/A LYS 186.A N CYS 182.A O no hydrogen 2.811 N/A LYS 186.A NZ ASN 45.A OD1 no hydrogen 3.210 N/A GLN 187.A N ALA 183.A O no hydrogen 3.049 N/A TYR 188.A N MET 184.A O no hydrogen 2.875 N/A ALA 189.A N LEU 185.A O no hydrogen 2.928 N/A LYS 191.A N TYR 188.A O no hydrogen 2.849 N/A LEU 192.A N TYR 188.A O no hydrogen 2.818 N/A PHE 194.A N LEU 235.A O no hydrogen 2.914 N/A MET 195.A N GLU 193.A OE1 no hydrogen 2.641 N/A ILE 197.A N GLU 193.A O no hydrogen 3.052 N/A LEU 198.A N PHE 194.A O no hydrogen 2.839 N/A THR 199.A N MET 195.A O no hydrogen 2.904 N/A THR 199.A OG1 MET 195.A O no hydrogen 2.802 N/A ARG 200.A N HIS 196.A O no hydrogen 3.252 N/A VAL 201.A N ILE 197.A O no hydrogen 3.026 N/A ASN 202.A N LEU 198.A O no hydrogen 2.926 N/A ARG 203.A N THR 199.A O no hydrogen 3.127 N/A LYS 204.A N ARG 200.A O no hydrogen 3.012 N/A VAL 205.A N VAL 201.A O no hydrogen 3.032 N/A ALA 206.A N ASN 202.A O no hydrogen 2.893 N/A THR 207.A N ARG 203.A O no hydrogen 2.877 N/A THR 207.A OG1 ARG 203.A O no hydrogen 2.615 N/A GLU 208.A N LYS 204.A O no hydrogen 2.935 N/A SER 211.A N LYS 221.A O no hydrogen 2.948 N/A SER 211.A OG PHE 218.A O no hydrogen 2.716 N/A SER 213.A N HIS 219.A ND1 no hydrogen 3.214 N/A SER 213.A OG ASP 215.A O no hydrogen 3.344 N/A ASP 215.A N SER 213.A OG no hydrogen 2.944 N/A THR 217.A N ASP 215.A OD1 no hydrogen 3.065 N/A THR 217.A OG1 ASP 215.A OD1 no hydrogen 3.470 N/A PHE 218.A N ASP 215.A O no hydrogen 2.861 N/A HIS 219.A N ALA 216.A O no hydrogen 3.424 N/A ALA 220.A N SER 211.A O no hydrogen 2.939 N/A LYS 221.A N SER 211.A OG no hydrogen 3.042 N/A LYS 222.A N ASP 141.A O no hydrogen 2.826 N/A LYS 222.A NZ ALA 206.A O no hydrogen 2.739 N/A LYS 222.A NZ PHE 209.A O no hydrogen 2.841 N/A GLN 223.A NE2 SER 160.A O no hydrogen 2.727 N/A CYS 226.A N TYR 159.A O no hydrogen 3.027 N/A VAL 228.A N PHE 157.A O no hydrogen 2.754 N/A MET 230.A N PHE 155.A O no hydrogen 2.903 N/A LEU 231.A N SER 229.A OG no hydrogen 3.041 N/A THR 232.A N TYR 9.A OH no hydrogen 2.936 N/A THR 232.A OG1 ASP 154.A OD1 no hydrogen 2.761 N/A LYS 233.A NZ ASP 6.A OD1 no hydrogen 3.139 N/A GLU 234.A N ASN 7.A O no hydrogen 2.879 N/A LEU 235.A N GLU 193.A OE2 no hydrogen 2.915 N/A TYR 236.A OH GLU 234.A OE1 no hydrogen 2.573 N/A