Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qy3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N LYS 1.A O no hydrogen 3.410 N/A LEU 5.A N GLY 2.A O no hydrogen 3.236 N/A PHE 6.A N GLU 3.A O no hydrogen 3.105 N/A VAL 10.A N GLY 33.A O no hydrogen 2.999 N/A ILE 12.A N GLY 31.A O no hydrogen 2.743 N/A LEU 13.A N LEU 117.A O no hydrogen 2.967 N/A VAL 14.A N GLY 29.A O no hydrogen 2.942 N/A GLU 15.A N ASN 119.A O no hydrogen 2.952 N/A LEU 16.A N VAL 27.A O no hydrogen 2.843 N/A ASP 17.A N ILE 121.A O no hydrogen 2.988 N/A GLY 18.A N PHE 25.A O no hydrogen 2.737 N/A ASP 19.A N LEU 123.A O no hydrogen 3.035 N/A VAL 20.A N HIS 23.A O no hydrogen 3.119 N/A ASN 21.A N GLY 125.A O no hydrogen 2.994 N/A ASN 21.A ND2 PHE 128.A O no hydrogen 2.796 N/A GLY 22.A N ASP 19.A OD1 no hydrogen 3.071 N/A HIS 23.A N VAL 20.A O no hydrogen 2.963 N/A HIS 23.A ND1 VAL 20.A O no hydrogen 2.946 N/A LYS 24.A NZ ASP 19.A OD2 no hydrogen 2.857 N/A PHE 25.A N GLY 18.A O no hydrogen 3.093 N/A SER 26.A N THR 48.A OG1 no hydrogen 3.124 N/A SER 26.A OG ASP 17.A OD1 no hydrogen 2.816 N/A VAL 27.A N LEU 16.A O no hydrogen 2.872 N/A SER 28.A N ILE 45.A O no hydrogen 2.829 N/A SER 28.A OG GLU 15.A OE1 no hydrogen 2.919 N/A SER 28.A OG GLU 15.A OE2 no hydrogen 3.192 N/A GLY 29.A N VAL 14.A O no hydrogen 2.688 N/A GLU 30.A N LYS 43.A O no hydrogen 3.149 N/A GLY 31.A N ILE 12.A O no hydrogen 3.257 N/A GLU 32.A N THR 41.A O no hydrogen 2.984 N/A GLY 33.A N VAL 10.A O no hydrogen 3.005 N/A ASP 34.A N LYS 39.A O no hydrogen 2.815 N/A THR 36.A OG1 THR 7.A O no hydrogen 3.195 N/A TYR 37.A N ASP 34.A O no hydrogen 3.110 N/A GLY 38.A N ALA 35.A O no hydrogen 3.138 N/A LYS 39.A N ASP 34.A O no hydrogen 3.087 N/A LEU 40.A N GLU 220.A O no hydrogen 2.845 N/A THR 41.A N GLU 32.A O no hydrogen 3.057 N/A THR 41.A OG1 GLU 32.A O no hydrogen 3.513 N/A LEU 42.A N LEU 218.A O no hydrogen 2.897 N/A LYS 43.A N GLU 30.A O no hydrogen 2.937 N/A LYS 43.A NZ GLU 211.A OE2 no hydrogen 2.892 N/A PHE 44.A N MET 216.A O no hydrogen 2.808 N/A ILE 45.A N SER 28.A O no hydrogen 2.797 N/A CYS 46.A N ASP 214.A O no hydrogen 2.947 N/A CYS 46.A SG SER 26.A O no hydrogen 3.645 N/A CYS 46.A SG THR 48.A OG1 no hydrogen 3.493 N/A CYS 46.A SG GLY 49.A O no hydrogen 3.116 N/A THR 47.A N SER 26.A O no hydrogen 3.082 N/A LEU 51.A N ASP 214.A OD2 no hydrogen 2.956 N/A TRP 55.A NE1 ASP 214.A OD1 no hydrogen 2.930 N/A THR 57.A N PRO 54.A O no hydrogen 3.194 N/A THR 57.A OG1 PRO 54.A O no hydrogen 2.689 N/A THR 57.A OG1 TYR 104.A OH no hydrogen 2.930 N/A LEU 58.A N TRP 55.A O no hydrogen 3.054 N/A VAL 59.A N PRO 56.A O no hydrogen 3.373 N/A THR 60.A OG1 HIS 179.A NE2 no hydrogen 2.754 N/A LEU 62.A N LEU 58.A O no hydrogen 2.895 N/A THR 63.A N VAL 59.A O no hydrogen 2.862 N/A THR 63.A OG1 VAL 59.A O no hydrogen 2.650 N/A TYR 64.A OH GLU 93.A O no hydrogen 3.379 N/A TYR 64.A OH ASN 183.A OD1 no hydrogen 2.853 N/A VAL 66.A N THR 63.A O no hydrogen 3.227 N/A GLN 67.A N TYR 64.A O no hydrogen 3.335 N/A GLN 67.A NE2 GLN 181.A OE1 no hydrogen 3.402 N/A PHE 69.A N VAL 66.A O no hydrogen 3.070 N/A SER 70.A N GLN 67.A O no hydrogen 3.307 N/A SER 70.A OG GLN 67.A O no hydrogen 2.711 N/A ARG 71.A N VAL 222.A O no hydrogen 2.959 N/A TYR 72.A OH HIS 197.A NE2 no hydrogen 2.684 N/A HIS 75.A NE2 ILE 227.A O no hydrogen 2.682 N/A MET 76.A N PRO 73.A O no hydrogen 2.826 N/A LYS 77.A N ASP 74.A O no hydrogen 3.264 N/A LYS 77.A NZ ASP 74.A O no hydrogen 3.112 N/A LYS 77.A NZ ASP 74.A OD2 no hydrogen 3.265 N/A GLN 78.A NE2 HIS 75.A O no hydrogen 2.884 N/A HIS 79.A N MET 76.A O no hydrogen 2.979 N/A LYS 83.A N ASP 80.A OD1 no hydrogen 3.240 N/A LYS 83.A NZ CYS 68.A O no hydrogen 2.922 N/A LYS 83.A NZ SER 70.A O no hydrogen 2.775 N/A LYS 83.A NZ ASP 80.A OD2 no hydrogen 2.822 N/A SER 84.A OG ASP 80.A O no hydrogen 3.521 N/A SER 84.A OG PHE 81.A O no hydrogen 2.719 N/A ALA 85.A N PHE 81.A O no hydrogen 3.136 N/A MET 86.A N LYS 83.A O no hydrogen 3.232 N/A GLU 88.A N GLU 88.A OE2 no hydrogen 2.883 N/A GLY 89.A N ALA 85.A O no hydrogen 2.746 N/A TYR 90.A N VAL 110.A O no hydrogen 3.013 N/A VAL 91.A N THR 184.A O no hydrogen 2.749 N/A GLN 92.A N ALA 108.A O no hydrogen 2.707 N/A GLN 92.A NE2 ASN 119.A OD1 no hydrogen 2.844 N/A GLU 93.A N GLN 182.A O no hydrogen 2.958 N/A ALA 94.A N THR 106.A O no hydrogen 3.118 N/A THR 95.A N TYR 180.A O no hydrogen 3.071 N/A ILE 96.A N TYR 104.A O no hydrogen 2.771 N/A SER 97.A N ASP 178.A O no hydrogen 2.876 N/A PHE 98.A N GLY 102.A O no hydrogen 3.021 N/A LYS 99.A N LEU 176.A O no hydrogen 2.987 N/A ASP 101.A N PHE 98.A O no hydrogen 3.098 N/A GLY 102.A N ASP 101.A OD1 no hydrogen 2.902 N/A ASN 103.A N ILE 126.A O no hydrogen 3.112 N/A TYR 104.A N ILE 96.A O no hydrogen 2.853 N/A TYR 104.A OH THR 57.A OG1 no hydrogen 2.930 N/A LYS 105.A N LYS 124.A O no hydrogen 2.789 N/A LYS 105.A NZ THR 95.A OG1 no hydrogen 2.987 N/A THR 106.A N ALA 94.A O no hydrogen 2.815 N/A THR 106.A OG1 ALA 94.A O no hydrogen 3.493 N/A ARG 107.A N GLU 122.A O no hydrogen 3.019 N/A ARG 107.A NH1 GLU 109.A OE2 no hydrogen 3.031 N/A ALA 108.A N GLN 92.A O no hydrogen 2.857 N/A GLU 109.A N ARG 120.A O no hydrogen 3.040 N/A VAL 110.A N TYR 90.A O no hydrogen 3.128 N/A LYS 111.A N VAL 118.A O no hydrogen 3.041 N/A LYS 111.A NZ GLU 109.A OE1 no hydrogen 2.651 N/A PHE 112.A N PRO 87.A O no hydrogen 3.094 N/A GLU 113.A N THR 116.A O no hydrogen 2.815 N/A THR 116.A N GLU 113.A O no hydrogen 3.338 N/A LEU 117.A N PRO 11.A O no hydrogen 3.049 N/A VAL 118.A N LYS 111.A O no hydrogen 2.870 N/A ASN 119.A N LEU 13.A O no hydrogen 2.918 N/A ARG 120.A N GLU 109.A O no hydrogen 2.983 N/A ILE 121.A N GLU 15.A O no hydrogen 2.763 N/A GLU 122.A N ARG 107.A O no hydrogen 2.910 N/A LEU 123.A N ASP 17.A O no hydrogen 2.845 N/A LYS 124.A N LYS 105.A O no hydrogen 2.908 N/A GLY 125.A N ASP 19.A O no hydrogen 2.664 N/A ILE 126.A N ASN 103.A O no hydrogen 3.034 N/A PHE 128.A N ASN 21.A OD1 no hydrogen 3.117 N/A LYS 129.A N ASP 101.A OD1 no hydrogen 2.880 N/A LYS 129.A NZ ASP 100.A O no hydrogen 2.846 N/A GLY 132.A N LYS 129.A O no hydrogen 3.148 N/A ASN 133.A ND2 GLN 175.A OE1 no hydrogen 2.912 N/A GLY 136.A N GLY 132.A O no hydrogen 3.008 N/A HIS 137.A N ILE 134.A O no hydrogen 3.157 N/A LYS 138.A N ASN 133.A O no hydrogen 3.123 N/A LYS 138.A NZ ASP 131.A O no hydrogen 2.922 N/A GLU 140.A N ASN 168.A O no hydrogen 2.840 N/A TYR 141.A OH SER 206.A O no hydrogen 2.722 N/A ASN 142.A ND2 GLU 140.A OE1 no hydrogen 2.888 N/A ASN 144.A ND2 ARG 166.A O no hydrogen 2.770 N/A ASN 144.A ND2 ASN 168.A OD1 no hydrogen 3.138 N/A HIS 146.A N THR 201.A O no hydrogen 3.125 N/A VAL 148.A N LEU 199.A O no hydrogen 2.907 N/A TYR 149.A N ASN 162.A O no hydrogen 3.164 N/A ILE 150.A N HIS 197.A O no hydrogen 2.837 N/A THR 151.A N LYS 160.A O no hydrogen 2.999 N/A ASP 153.A N GLY 158.A O no hydrogen 2.885 N/A LYS 156.A N ASP 153.A O no hydrogen 3.306 N/A ASN 157.A N LYS 154.A O no hydrogen 3.274 N/A GLY 158.A N ASP 153.A O no hydrogen 3.009 N/A ILE 159.A N ASN 183.A O no hydrogen 3.090 N/A LYS 160.A N THR 151.A O no hydrogen 2.792 N/A ALA 161.A N GLN 181.A O no hydrogen 2.826 N/A ASN 162.A N TYR 149.A O no hydrogen 2.910 N/A PHE 163.A N HIS 179.A O no hydrogen 3.339 N/A LYS 164.A NZ ASP 178.A OD1 no hydrogen 2.737 N/A ILE 165.A N ALA 177.A O no hydrogen 2.894 N/A HIS 167.A N GLN 175.A O no hydrogen 2.938 N/A ASN 168.A ND2 ASN 142.A OD1 no hydrogen 2.886 N/A ASN 168.A ND2 ASN 144.A OD1 no hydrogen 3.221 N/A ILE 169.A N SER 173.A O no hydrogen 2.969 N/A GLU 170.A N LYS 138.A O no hydrogen 2.854 N/A GLY 172.A N ILE 169.A O no hydrogen 3.047 N/A SER 173.A N ASP 171.A OD1 no hydrogen 3.101 N/A VAL 174.A N SER 173.A OG no hydrogen 2.753 N/A GLN 175.A N HIS 167.A O no hydrogen 2.832 N/A GLN 175.A NE2 LYS 99.A O no hydrogen 2.858 N/A GLN 175.A NE2 LEU 176.A O no hydrogen 2.971 N/A ALA 177.A N ILE 165.A O no hydrogen 2.746 N/A ASP 178.A N SER 97.A O no hydrogen 2.942 N/A HIS 179.A N PHE 163.A O no hydrogen 2.841 N/A HIS 179.A ND1 ALA 177.A O no hydrogen 2.978 N/A HIS 179.A NE2 THR 60.A OG1 no hydrogen 2.754 N/A TYR 180.A N THR 95.A O no hydrogen 3.137 N/A GLN 181.A N ALA 161.A O no hydrogen 2.815 N/A GLN 182.A N GLU 93.A O no hydrogen 2.760 N/A ASN 183.A N ILE 159.A O no hydrogen 2.941 N/A THR 184.A N VAL 91.A O no hydrogen 3.039 N/A ILE 186.A N GLY 89.A O no hydrogen 2.983 N/A LEU 192.A N SER 84.A OG no hydrogen 2.976 N/A ASP 195.A N HIS 79.A ND1 no hydrogen 3.291 N/A HIS 197.A N ILE 150.A O no hydrogen 3.340 N/A HIS 197.A ND1 ASP 195.A O no hydrogen 2.987 N/A HIS 197.A NE2 TYR 72.A OH no hydrogen 2.684 N/A TYR 198.A N ALA 225.A O no hydrogen 2.984 N/A LEU 199.A N VAL 148.A O no hydrogen 2.975 N/A SER 200.A N THR 223.A O no hydrogen 2.663 N/A SER 200.A OG GLN 202.A OE1 no hydrogen 2.946 N/A THR 201.A N HIS 146.A O no hydrogen 2.866 N/A GLN 202.A N PHE 221.A O no hydrogen 2.944 N/A SER 203.A OG GLU 220.A OE1 no hydrogen 2.729 N/A ALA 204.A N LEU 219.A O no hydrogen 2.821 N/A SER 206.A N VAL 217.A O no hydrogen 2.912 N/A LYS 207.A NZ HIS 215.A O no hydrogen 2.784 N/A ASP 208.A N HIS 215.A NE2 no hydrogen 2.773 N/A GLU 211.A N ASP 208.A O no hydrogen 3.023 N/A ARG 213.A N GLU 211.A OE1 no hydrogen 3.078 N/A ARG 213.A NE GLU 211.A OE1 no hydrogen 2.712 N/A ARG 213.A NH2 GLU 211.A OE1 no hydrogen 3.412 N/A ARG 213.A NH2 GLU 211.A OE2 no hydrogen 2.745 N/A HIS 215.A ND1 ARG 213.A O no hydrogen 2.894 N/A MET 216.A N PHE 44.A O no hydrogen 2.882 N/A VAL 217.A N SER 206.A O no hydrogen 3.008 N/A LEU 218.A N LEU 42.A O no hydrogen 2.738 N/A LEU 219.A N ALA 204.A O no hydrogen 3.047 N/A GLU 220.A N LEU 40.A O no hydrogen 2.863 N/A PHE 221.A N GLN 202.A O no hydrogen 2.914 N/A VAL 222.A N GLY 38.A O no hydrogen 2.997 N/A THR 223.A N SER 200.A O no hydrogen 2.942 N/A ALA 224.A N ARG 71.A O no hydrogen 2.896 N/A ALA 225.A N TYR 198.A O no hydrogen 2.835 N/A