Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w0y_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 9.A N SER 6.A OG no hydrogen 3.039 N/A GLN 10.A N SER 6.A O no hydrogen 2.966 N/A ARG 11.A N GLU 7.A O no hydrogen 2.996 N/A ILE 12.A N GLU 8.A O no hydrogen 2.921 N/A ILE 13.A N GLN 9.A O no hydrogen 3.084 N/A ALA 14.A N GLN 10.A O no hydrogen 3.056 N/A ILE 15.A N ARG 11.A O no hydrogen 2.975 N/A LEU 16.A N ILE 12.A O no hydrogen 3.057 N/A LEU 17.A N ILE 13.A O no hydrogen 2.937 N/A ASP 18.A N ALA 14.A O no hydrogen 3.005 N/A ALA 19.A N ILE 15.A O no hydrogen 2.813 N/A HIS 20.A N LEU 16.A O no hydrogen 2.885 N/A HIS 21.A N LEU 17.A O no hydrogen 2.884 N/A LYS 22.A N ASP 18.A O no hydrogen 3.136 N/A LYS 22.A NZ ASP 18.A OD1 no hydrogen 2.784 N/A LYS 22.A NZ ASP 18.A OD2 no hydrogen 3.523 N/A THR 23.A N HIS 20.A O no hydrogen 3.097 N/A THR 23.A OG1 ALA 19.A O no hydrogen 2.686 N/A THR 27.A N ASP 25.A OD1 no hydrogen 2.943 N/A THR 27.A OG1 ASP 25.A OD1 no hydrogen 2.671 N/A THR 27.A OG1 ASP 25.A OD2 no hydrogen 3.454 N/A TYR 28.A N ASP 25.A O no hydrogen 3.239 N/A SER 29.A N ASP 25.A OD2 no hydrogen 3.078 N/A SER 29.A OG ASP 25.A OD2 no hydrogen 2.640 N/A PHE 31.A N TYR 28.A O no hydrogen 3.201 N/A CYS 32.A SG SER 29.A O no hydrogen 3.767 N/A GLN 33.A N ASP 30.A O no hydrogen 2.915 N/A PHE 34.A N PHE 31.A O no hydrogen 3.274 N/A ARG 35.A N ASP 62.A OD1 no hydrogen 2.785 N/A ARG 35.A NE ASP 62.A OD1 no hydrogen 2.988 N/A ARG 35.A NE ASP 62.A OD2 no hydrogen 3.363 N/A ARG 35.A NH1 MET 239.A O no hydrogen 2.962 N/A ARG 35.A NH2 ASP 62.A OD2 no hydrogen 2.987 N/A ARG 35.A NH2 LYS 240.A O no hydrogen 3.187 N/A ARG 35.A NH2 LEU 241.A O no hydrogen 2.990 N/A ARG 39.A NE ASP 129.A OD1 no hydrogen 2.768 N/A ARG 39.A NH1 ASP 122.A O no hydrogen 2.963 N/A ARG 39.A NH2 ASP 122.A O no hydrogen 2.925 N/A GLY 45.A N ASP 42.A O no hydrogen 3.432 N/A SER 46.A N ASP 42.A OD1 no hydrogen 3.084 N/A LEU 49.A N SER 46.A OG no hydrogen 3.231 N/A GLU 50.A N SER 46.A O no hydrogen 3.027 N/A LEU 51.A N VAL 47.A O no hydrogen 2.862 N/A SER 52.A N THR 48.A O no hydrogen 3.032 N/A SER 52.A OG THR 48.A O no hydrogen 3.388 N/A SER 52.A OG LEU 49.A O no hydrogen 2.702 N/A GLN 53.A N LEU 49.A O no hydrogen 3.146 N/A GLN 53.A N GLU 50.A O no hydrogen 3.257 N/A LEU 54.A N GLU 50.A O no hydrogen 2.761 N/A SER 55.A OG VAL 38.A O no hydrogen 2.918 N/A MET 56.A N LYS 132.A O no hydrogen 3.360 N/A LEU 57.A N LEU 54.A O no hydrogen 3.067 N/A HIS 59.A ND1 ARG 35.A O no hydrogen 2.851 N/A HIS 59.A NE2 TYR 125.A OH no hydrogen 2.651 N/A LEU 60.A N MET 56.A O no hydrogen 2.971 N/A ALA 61.A N LEU 57.A O no hydrogen 2.826 N/A ASP 62.A N PRO 58.A O no hydrogen 3.029 N/A LEU 63.A N HIS 59.A O no hydrogen 2.921 N/A VAL 64.A N LEU 60.A O no hydrogen 2.985 N/A SER 65.A N ALA 61.A O no hydrogen 2.797 N/A SER 65.A OG THR 242.A OG1 no hydrogen 2.718 N/A TYR 66.A N ASP 62.A O no hydrogen 2.911 N/A TYR 66.A OH ASP 30.A OD2 no hydrogen 2.652 N/A SER 67.A N LEU 63.A O no hydrogen 3.137 N/A SER 67.A OG LEU 63.A O no hydrogen 2.731 N/A ILE 68.A N VAL 64.A O no hydrogen 2.867 N/A GLN 69.A N SER 65.A O no hydrogen 3.246 N/A LYS 70.A N TYR 66.A O no hydrogen 3.189 N/A VAL 71.A N SER 67.A O no hydrogen 2.862 N/A ILE 72.A N ILE 68.A O no hydrogen 2.827 N/A GLY 73.A N GLN 69.A O no hydrogen 3.228 N/A PHE 74.A N LYS 70.A O no hydrogen 2.809 N/A ALA 75.A N VAL 71.A O no hydrogen 2.819 N/A LYS 76.A N ILE 72.A O no hydrogen 3.180 N/A MET 77.A N PHE 74.A O no hydrogen 2.981 N/A ILE 78.A N ALA 75.A O no hydrogen 2.891 N/A PHE 81.A N ILE 78.A O no hydrogen 3.038 N/A ASP 83.A N GLY 80.A O no hydrogen 2.869 N/A LEU 84.A N PHE 81.A O no hydrogen 3.312 N/A ASP 88.A N THR 85.A OG1 no hydrogen 3.204 N/A GLN 89.A N THR 85.A O no hydrogen 3.017 N/A ILE 90.A N SER 86.A O no hydrogen 3.005 N/A VAL 91.A N GLU 87.A O no hydrogen 3.132 N/A LEU 92.A N ASP 88.A O no hydrogen 2.994 N/A LEU 93.A N GLN 89.A O no hydrogen 3.015 N/A LYS 94.A N ILE 90.A O no hydrogen 2.956 N/A LYS 94.A NZ GLU 247.A OE1 no hydrogen 2.914 N/A SER 95.A N VAL 91.A O no hydrogen 3.083 N/A SER 95.A OG VAL 91.A O no hydrogen 2.746 N/A SER 95.A OG LEU 92.A O no hydrogen 3.340 N/A SER 96.A N LEU 92.A O no hydrogen 3.141 N/A SER 96.A OG LEU 92.A O no hydrogen 2.930 N/A VAL 100.A N SER 96.A O no hydrogen 2.960 N/A ILE 101.A N ALA 97.A O no hydrogen 3.031 N/A MET 102.A N ILE 98.A O no hydrogen 2.964 N/A LEU 103.A N GLU 99.A O no hydrogen 3.073 N/A ARG 104.A N VAL 100.A O no hydrogen 2.808 N/A ARG 104.A NH1 THR 23.A O no hydrogen 3.303 N/A ARG 104.A NH2 THR 23.A O no hydrogen 2.798 N/A SER 105.A N ILE 101.A O no hydrogen 2.795 N/A SER 105.A OG ILE 101.A O no hydrogen 3.485 N/A SER 105.A OG MET 102.A O no hydrogen 2.815 N/A ASN 106.A N LEU 103.A O no hydrogen 3.255 N/A ASN 106.A ND2 GLN 147.A O no hydrogen 2.887 N/A ASN 106.A ND2 GLN 147.A OE1 no hydrogen 2.874 N/A SER 108.A N SER 105.A O no hydrogen 3.264 N/A SER 108.A OG SER 105.A O no hydrogen 2.919 N/A PHE 109.A N SER 105.A O no hydrogen 3.261 N/A PHE 109.A N ASN 106.A O no hydrogen 3.100 N/A THR 110.A N SER 115.A O no hydrogen 2.809 N/A ASP 112.A N THR 110.A OG1 no hydrogen 3.123 N/A SER 115.A N THR 110.A O no hydrogen 3.323 N/A SER 115.A OG ASP 113.A OD1 no hydrogen 2.767 N/A SER 115.A OG THR 117.A OG1 no hydrogen 2.723 N/A TRP 116.A N TYR 125.A O no hydrogen 2.920 N/A THR 117.A N SER 108.A O no hydrogen 2.911 N/A THR 117.A OG1 SER 115.A OG no hydrogen 2.723 N/A CYS 118.A N TYR 123.A O no hydrogen 2.865 N/A ASP 122.A N ASN 120.A OD1 no hydrogen 2.801 N/A TYR 123.A N ASN 120.A O no hydrogen 3.074 N/A LYS 124.A NZ ASP 113.A OD2 no hydrogen 2.734 N/A LYS 124.A NZ SER 115.A OG no hydrogen 3.053 N/A LYS 124.A NZ THR 117.A OG1 no hydrogen 2.810 N/A TYR 125.A N TRP 116.A O no hydrogen 2.877 N/A TYR 125.A OH HIS 59.A NE2 no hydrogen 2.651 N/A ARG 126.A N ASP 129.A OD2 no hydrogen 2.881 N/A ASP 129.A N ARG 126.A O no hydrogen 3.019 N/A VAL 130.A N VAL 127.A O no hydrogen 3.097 N/A THR 131.A N VAL 127.A O no hydrogen 3.119 N/A THR 131.A OG1 SER 128.A O no hydrogen 2.713 N/A LYS 132.A N SER 128.A O no hydrogen 3.020 N/A LYS 132.A NZ SER 128.A O no hydrogen 3.486 N/A ALA 133.A N VAL 130.A O no hydrogen 3.046 N/A GLY 134.A N THR 131.A O no hydrogen 2.923 N/A HIS 135.A N VAL 130.A O no hydrogen 3.477 N/A HIS 135.A ND1 GLN 227.A OE1 no hydrogen 3.131 N/A SER 136.A N GLN 227.A OE1 no hydrogen 2.783 N/A LEU 139.A N SER 136.A O no hydrogen 3.085 N/A ILE 140.A N SER 136.A O no hydrogen 3.359 N/A GLU 141.A N LEU 137.A O no hydrogen 3.059 N/A LEU 143.A N LEU 139.A O no hydrogen 2.991 N/A ILE 144.A N ILE 140.A O no hydrogen 2.915 N/A LYS 145.A N GLU 141.A O no hydrogen 3.160 N/A PHE 146.A N PRO 142.A O no hydrogen 2.872 N/A GLN 147.A N LEU 143.A O no hydrogen 2.910 N/A GLN 147.A NE2 MET 102.A O no hydrogen 3.002 N/A VAL 148.A N ILE 144.A O no hydrogen 3.016 N/A GLY 149.A N LYS 145.A O no hydrogen 3.039 N/A LEU 150.A N PHE 146.A O no hydrogen 2.906 N/A LYS 151.A N GLN 147.A O no hydrogen 2.911 N/A LYS 151.A NZ ASN 106.A O no hydrogen 2.781 N/A LYS 151.A NZ PHE 109.A O no hydrogen 2.838 N/A LYS 152.A N VAL 148.A O no hydrogen 2.982 N/A LEU 153.A N LEU 150.A O no hydrogen 3.065 N/A ASN 154.A N LYS 151.A O no hydrogen 3.119 N/A HIS 156.A N GLU 159.A OE2 no hydrogen 2.893 N/A HIS 156.A ND1 TYR 196.A OH no hydrogen 2.770 N/A GLU 158.A N GLU 158.A OE2 no hydrogen 2.782 N/A HIS 160.A N HIS 156.A O no hydrogen 3.030 N/A VAL 161.A N GLU 157.A O no hydrogen 2.953 N/A LEU 162.A N GLU 158.A O no hydrogen 3.201 N/A LEU 163.A N GLU 159.A O no hydrogen 2.902 N/A MET 164.A N HIS 160.A O no hydrogen 3.073 N/A ALA 165.A N VAL 161.A O no hydrogen 3.078 N/A ILE 166.A N LEU 162.A O no hydrogen 2.839 N/A CYS 167.A N LEU 163.A O no hydrogen 2.943 N/A CYS 167.A SG GLU 99.A OE1 no hydrogen 3.309 N/A ILE 168.A N MET 164.A O no hydrogen 2.983 N/A VAL 169.A N ALA 165.A O no hydrogen 2.982 N/A SER 170.A N ILE 168.A O no hydrogen 3.014 N/A SER 170.A OG ILE 166.A O no hydrogen 3.252 N/A SER 170.A OG CYS 167.A O no hydrogen 3.046 N/A ARG 173.A NH1 GLU 99.A OE2 no hydrogen 2.839 N/A ARG 173.A NH2 GLU 99.A OE1 no hydrogen 2.777 N/A ARG 173.A NH2 CYS 167.A O no hydrogen 3.128 N/A GLN 177.A N ASP 88.A OD2 no hydrogen 2.932 N/A ASP 178.A N ASP 88.A OD1 no hydrogen 2.922 N/A LEU 181.A N ASP 178.A OD2 no hydrogen 3.084 N/A ILE 182.A N ASP 178.A O no hydrogen 3.166 N/A GLU 183.A N ALA 179.A O no hydrogen 2.869 N/A ALA 184.A N ALA 180.A O no hydrogen 3.016 N/A ILE 185.A N LEU 181.A O no hydrogen 2.963 N/A GLN 186.A N ILE 182.A O no hydrogen 2.874 N/A GLN 186.A NE2 ILE 166.A O no hydrogen 3.062 N/A ASP 187.A N GLU 183.A O no hydrogen 2.804 N/A ARG 188.A N ALA 184.A O no hydrogen 3.178 N/A LEU 189.A N ILE 185.A O no hydrogen 3.299 N/A SER 190.A N GLN 186.A O no hydrogen 2.759 N/A SER 190.A OG GLN 186.A O no hydrogen 3.090 N/A ASN 191.A N ASP 187.A O no hydrogen 2.884 N/A THR 192.A N ARG 188.A O no hydrogen 3.147 N/A THR 192.A OG1 ARG 188.A O no hydrogen 2.735 N/A LEU 193.A N LEU 189.A O no hydrogen 2.867 N/A GLN 194.A N SER 190.A O no hydrogen 2.844 N/A THR 195.A N ASN 191.A O no hydrogen 2.891 N/A THR 195.A OG1 ASN 191.A O no hydrogen 2.778 N/A TYR 196.A N THR 192.A O no hydrogen 2.802 N/A TYR 196.A OH HIS 156.A ND1 no hydrogen 2.770 N/A ILE 197.A N LEU 193.A O no hydrogen 2.933 N/A ARG 198.A N GLN 194.A O no hydrogen 3.233 N/A ARG 198.A NH2 THR 195.A OG1 no hydrogen 3.378 N/A CYS 199.A N THR 195.A O no hydrogen 3.214 N/A CYS 199.A N TYR 196.A O no hydrogen 3.316 N/A CYS 199.A SG PRO 3.A O no hydrogen 3.684 N/A CYS 199.A SG THR 195.A O no hydrogen 3.327 N/A ARG 200.A N TYR 196.A O no hydrogen 2.859 N/A HIS 201.A N ILE 197.A O no hydrogen 3.194 N/A HIS 201.A ND1 GLU 159.A OE1 no hydrogen 2.740 N/A LYS 209.A N LEU 205.A O no hydrogen 3.082 N/A MET 210.A N LEU 206.A O no hydrogen 2.859 N/A ILE 211.A N TYR 207.A O no hydrogen 2.956 N/A GLN 212.A N ALA 208.A O no hydrogen 3.020 N/A LYS 213.A N LYS 209.A O no hydrogen 3.173 N/A LYS 213.A NZ ASP 216.A OD1 no hydrogen 3.414 N/A LEU 214.A N MET 210.A O no hydrogen 3.271 N/A ALA 215.A N ILE 211.A O no hydrogen 3.212 N/A ASP 216.A N GLN 212.A O no hydrogen 2.897 N/A LEU 217.A N LYS 213.A O no hydrogen 2.881 N/A ARG 218.A N LEU 214.A O no hydrogen 3.262 N/A ARG 218.A NH2 ASP 172.A OD2 no hydrogen 2.783 N/A SER 219.A N ALA 215.A O no hydrogen 3.391 N/A LEU 220.A N ASP 216.A O no hydrogen 3.107 N/A ASN 221.A N LEU 217.A O no hydrogen 2.846 N/A ASN 221.A ND2 SER 95.A O no hydrogen 2.811 N/A ASN 221.A ND2 GLU 99.A OE2 no hydrogen 2.787 N/A GLU 222.A N ARG 218.A O no hydrogen 3.107 N/A GLU 223.A N SER 219.A O no hydrogen 3.122 N/A HIS 224.A N LEU 220.A O no hydrogen 2.883 N/A SER 225.A N ASN 221.A O no hydrogen 2.912 N/A LYS 226.A N GLU 222.A O no hydrogen 3.161 N/A GLN 227.A N GLU 223.A O no hydrogen 2.973 N/A GLN 227.A NE2 SER 136.A O no hydrogen 3.650 N/A GLN 227.A NE2 GLU 223.A OE1 no hydrogen 2.805 N/A TYR 228.A N HIS 224.A O no hydrogen 2.754 N/A ARG 229.A N SER 225.A O no hydrogen 3.111 N/A CYS 230.A N LYS 226.A O no hydrogen 3.245 N/A LEU 231.A N GLN 227.A O no hydrogen 3.072 N/A SER 232.A N TYR 228.A O no hydrogen 2.855 N/A SER 232.A OG ARG 229.A O no hydrogen 2.725 N/A PHE 233.A N CYS 230.A O no hydrogen 3.041 N/A GLN 234.A N LEU 231.A O no hydrogen 3.004 N/A CYS 237.A N GLN 234.A O no hydrogen 3.105 N/A CYS 237.A SG LEU 231.A O no hydrogen 3.358 N/A LYS 240.A N CYS 237.A O no hydrogen 2.931 N/A LEU 241.A N SER 238.A O no hydrogen 3.059 N/A THR 242.A OG1 SER 65.A OG no hydrogen 2.718 N/A VAL 245.A N THR 242.A OG1 no hydrogen 3.146 N/A LEU 246.A N THR 242.A O no hydrogen 2.906 N/A GLU 247.A N PRO 243.A O no hydrogen 3.094 N/A VAL 248.A N LEU 244.A O no hydrogen 2.944 N/A PHE 249.A N VAL 245.A O no hydrogen 2.990 N/A GLY 250.A N LEU 246.A O no hydrogen 2.922 N/A