Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3m6y_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N THR 2.A OG1 no hydrogen 3.249 N/A LYS 6.A N ASN 3.A O no hydrogen 3.106 N/A LYS 6.A NZ ASN 3.A OD1 no hydrogen 3.135 N/A ARG 7.A N ILE 4.A O no hydrogen 2.868 N/A ARG 7.A NE GLY 34.A O no hydrogen 2.617 N/A ARG 7.A NH1 GLY 34.A O no hydrogen 3.531 N/A ARG 7.A NH2 ASP 62.A OD2 no hydrogen 3.084 N/A PHE 8.A N GLN 5.A O no hydrogen 3.468 N/A TYR 9.A N VAL 13.A O no hydrogen 2.847 N/A TYR 9.A OH ASP 245.A OD1 no hydrogen 2.647 N/A LYS 10.A NZ ASP 245.A OD1 no hydrogen 2.858 N/A GLY 11.A N PHE 8.A O no hydrogen 3.189 N/A ARG 12.A N TYR 9.A O no hydrogen 2.915 N/A ARG 12.A NE GLU 210.A O no hydrogen 2.774 N/A ARG 12.A NH1 TYR 247.A O no hydrogen 3.024 N/A ARG 12.A NH2 VAL 209.A O no hydrogen 2.877 N/A ALA 14.A N VAL 212.A O no hydrogen 3.108 N/A LEU 15.A N TYR 35.A O no hydrogen 3.099 N/A ASN 16.A N PRO 214.A O no hydrogen 3.007 N/A ASN 16.A ND2 SER 66.A OG no hydrogen 3.060 N/A VAL 17.A N VAL 37.A O no hydrogen 3.258 N/A ASN 20.A ND2 ASN 227.A OD1 no hydrogen 3.196 N/A ASN 24.A N ASN 21.A OD1.A no hydrogen 2.891 N/A ASN 24.A N ASN 21.A OD1.B no hydrogen 2.952 N/A ALA 25.A N ASN 21.A O no hydrogen 2.962 N/A LYS 26.A N ILE 22.A O no hydrogen 2.838 N/A ASP 27.A N GLU 23.A O no hydrogen 2.945 N/A ILE 28.A N ASN 24.A O no hydrogen 2.823 N/A PHE 29.A N ALA 25.A O no hydrogen 2.880 N/A GLU 30.A N LYS 26.A O no hydrogen 2.997 N/A ALA 31.A N ASP 27.A O no hydrogen 2.916 N/A ALA 32.A N ILE 28.A O no hydrogen 2.901 N/A GLU 33.A N GLU 30.A O no hydrogen 2.990 N/A GLY 34.A N PHE 29.A O no hydrogen 2.899 N/A TYR 35.A N ALA 32.A O no hydrogen 2.953 N/A VAL 37.A N LEU 15.A O no hydrogen 2.918 N/A VAL 38.A N ALA 64.A O no hydrogen 2.862 N/A GLY 39.A N VAL 17.A O no hydrogen 2.773 N/A VAL 40.A N SER 66.A O no hydrogen 2.996 N/A SER 42.A N GLY 68.A O no hydrogen 2.872 N/A SER 42.A OG GLY 68.A O no hydrogen 3.023 N/A SER 42.A OG LEU 69.A O no hydrogen 2.922 N/A LYS 43.A N LEU 69.A O no hydrogen 3.148 N/A LYS 43.A NZ ASP 73.A OD2 no hydrogen 2.760 N/A ASP 44.A N LEU 41.A O no hydrogen 3.084 N/A TYR 45.A N SER 42.A O no hydrogen 3.117 N/A GLU 50.A N THR 47.A OG1 no hydrogen 2.965 N/A ALA 51.A N THR 47.A O no hydrogen 3.092 N/A VAL 52.A N VAL 48.A O no hydrogen 2.859 N/A THR 53.A N GLU 49.A O no hydrogen 2.999 N/A THR 53.A OG1 GLU 49.A O no hydrogen 3.053 N/A ALA 54.A N GLU 50.A O no hydrogen 3.038 N/A ALA 56.A N THR 53.A O no hydrogen 3.095 N/A TYR 57.A N ALA 54.A O no hydrogen 2.972 N/A LYS 59.A N LYS 55.A O no hydrogen 2.941 N/A GLU 60.A N TYR 57.A O no hydrogen 3.012 N/A ILE 61.A N GLY 58.A O no hydrogen 3.318 N/A ASP 63.A N GLY 58.A O no hydrogen 2.855 N/A ALA 64.A N ILE 61.A O no hydrogen 2.903 N/A SER 66.A N VAL 38.A O no hydrogen 2.848 N/A SER 66.A OG HIS 91.A ND1 no hydrogen 2.699 N/A ILE 67.A N HIS 91.A O no hydrogen 2.836 N/A GLY 68.A N VAL 40.A O no hydrogen 2.867 N/A ASP 73.A N GLY 70.A O no hydrogen 2.954 N/A ARG 75.A N ASP 73.A OD1 no hydrogen 3.033 N/A ARG 75.A NE ASP 73.A OD1 no hydrogen 2.931 N/A ARG 75.A NE ASP 73.A OD2 no hydrogen 3.435 N/A ARG 75.A NH2 ASP 73.A OD2 no hydrogen 2.972 N/A GLN 76.A N ASP 73.A O no hydrogen 2.948 N/A GLN 76.A NE2 SER 42.A OG no hydrogen 2.936 N/A ALA 77.A N ASN 74.A O no hydrogen 3.083 N/A VAL 80.A N GLN 76.A O no hydrogen 2.904 N/A ALA 81.A N ALA 77.A O no hydrogen 2.955 N/A GLU 82.A N.A ALA 78.A O no hydrogen 3.064 N/A GLU 82.A N.B ALA 78.A O no hydrogen 3.050 N/A GLU 82.A N.B VAL 79.A O no hydrogen 3.126 N/A ILE 83.A N VAL 79.A O no hydrogen 2.872 N/A ALA 84.A N VAL 80.A O no hydrogen 3.089 N/A LYS 85.A N GLU 82.A O.A no hydrogen 3.144 N/A LYS 85.A N GLU 82.A O.B no hydrogen 2.965 N/A LYS 85.A NZ GLU 82.A OE2.B no hydrogen 3.142 N/A HIS 86.A N ILE 83.A O no hydrogen 2.819 N/A TYR 87.A N ILE 83.A O no hydrogen 2.956 N/A TYR 87.A OH ASP 63.A OD1 no hydrogen 2.760 N/A SER 90.A N VAL 65.A O no hydrogen 2.936 N/A SER 90.A OG ASP 63.A O no hydrogen 2.704 N/A HIS 91.A N VAL 65.A O no hydrogen 3.236 N/A HIS 91.A ND1 SER 66.A OG no hydrogen 2.699 N/A HIS 91.A NE2 GLU 187.A OE1 no hydrogen 2.883 N/A HIS 91.A NE2 GLU 187.A OE2 no hydrogen 3.172 N/A ILE 92.A N TRP 112.A O no hydrogen 2.770 N/A ASN 93.A N ILE 67.A O no hydrogen 2.888 N/A ASN 93.A ND2 ILE 67.A O no hydrogen 3.000 N/A GLN 94.A N ASN 114.A OD1 no hydrogen 3.005 N/A GLN 94.A NE2 ALA 77.A O no hydrogen 2.969 N/A GLN 94.A NE2 THR 102.A OG1 no hydrogen 2.936 N/A VAL 95.A N GLN 94.A OE1 no hydrogen 2.823 N/A PHE 96.A N THR 130.A OG1 no hydrogen 3.181 N/A SER 98.A N VAL 95.A O no hydrogen 3.020 N/A VAL 99.A N PHE 96.A O no hydrogen 3.389 N/A THR 102.A N SER 98.A O no hydrogen 3.128 N/A THR 102.A OG1 SER 98.A O no hydrogen 2.757 N/A ARG 103.A N VAL 99.A O no hydrogen 2.892 N/A ARG 103.A NE GLY 155.A O no hydrogen 2.800 N/A ARG 103.A NH1 SER 111.A O no hydrogen 2.975 N/A ARG 103.A NH2 SER 111.A O no hydrogen 3.067 N/A ARG 103.A NH2 GLY 155.A O no hydrogen 2.871 N/A ALA 104.A N GLY 100.A O no hydrogen 2.949 N/A ASN 105.A N ALA 101.A O no hydrogen 2.877 N/A ASN 105.A ND2 ALA 81.A O no hydrogen 2.855 N/A LEU 106.A N THR 102.A O no hydrogen 3.023 N/A GLY 107.A N ALA 104.A O no hydrogen 2.960 N/A GLU 108.A N GLU 108.A OE1 no hydrogen 2.865 N/A LYS 109.A N LEU 106.A O no hydrogen 2.938 N/A LYS 109.A NZ ALA 84.A O no hydrogen 2.943 N/A LYS 109.A NZ LYS 85.A O no hydrogen 3.170 N/A LYS 109.A NZ LEU 106.A O no hydrogen 2.850 N/A SER 111.A OG PRO 88.A O no hydrogen 2.718 N/A TRP 112.A NE1 GLU 187.A OE2 no hydrogen 2.877 N/A ILE 113.A N ASN 157.A OD1 no hydrogen 2.846 N/A ASN 114.A N ILE 92.A O no hydrogen 2.938 N/A ASN 114.A ND2 ASN 93.A OD1 no hydrogen 2.889 N/A ASN 114.A ND2 GLU 187.A OE1 no hydrogen 3.003 N/A SER 115.A N SER 158.A O no hydrogen 3.024 N/A LEU 116.A N GLN 94.A O no hydrogen 2.929 N/A VAL 117.A N LYS 160.A O no hydrogen 2.973 N/A SER 118.A N ASN 127.A O no hydrogen 3.012 N/A SER 118.A OG PHE 162.A O no hydrogen 2.666 N/A THR 120.A N GLU 171.A OE1 no hydrogen 2.896 N/A THR 120.A OG1 TYR 125.A O no hydrogen 2.951 N/A THR 120.A OG1 GLU 171.A OE1 no hydrogen 3.498 N/A GLY 121.A N GLU 171.A OE1 no hydrogen 3.082 N/A LYS 122.A N THR 120.A OG1 no hydrogen 2.987 N/A TYR 125.A N LYS 122.A O no hydrogen 3.091 N/A VAL 126.A N VAL 143.A O no hydrogen 2.908 N/A ASN 127.A N SER 118.A O no hydrogen 2.953 N/A ILE 128.A N ALA 141.A O no hydrogen 3.065 N/A SER 129.A N ASN 127.A OD1 no hydrogen 2.856 N/A THR 130.A N ILE 128.A O no hydrogen 2.913 N/A THR 130.A OG1 LEU 116.A O no hydrogen 2.837 N/A GLY 131.A N SER 134.A OG no hydrogen 2.930 N/A SER 134.A OG GLY 131.A O no hydrogen 3.435 N/A ALA 135.A N GLY 131.A O no hydrogen 2.779 N/A ALA 136.A N ILE 133.A O no hydrogen 3.154 N/A GLY 137.A N SER 134.A O no hydrogen 3.180 N/A LYS 140.A NZ ALA 135.A O no hydrogen 3.302 N/A ALA 141.A N SER 129.A OG no hydrogen 2.853 N/A VAL 143.A N VAL 126.A O no hydrogen 2.939 N/A ILE 145.A N GLY 124.A O no hydrogen 3.049 N/A LYS 146.A NZ GLU 181.A OE1 no hydrogen 2.931 N/A THR 147.A N PRO 144.A O no hydrogen 2.972 N/A THR 147.A OG1 PRO 144.A O no hydrogen 2.760 N/A ALA 148.A N PRO 144.A O no hydrogen 3.290 N/A ILE 149.A N ILE 145.A O no hydrogen 3.023 N/A ALA 150.A N LYS 146.A O no hydrogen 2.965 N/A LEU 151.A N THR 147.A O no hydrogen 3.134 N/A VAL 152.A N ALA 148.A O no hydrogen 2.890 N/A ARG 153.A N ILE 149.A O no hydrogen 2.892 N/A ARG 153.A NH1 GLU 182.A O no hydrogen 2.921 N/A ARG 153.A NH2 GLU 182.A O no hydrogen 2.898 N/A ASP 154.A N ALA 150.A O no hydrogen 2.989 N/A GLY 156.A N VAL 152.A O no hydrogen 2.901 N/A ASN 157.A N ILE 113.A O no hydrogen 2.774 N/A SER 158.A OG GLU 187.A OE2 no hydrogen 2.688 N/A LEU 159.A N ALA 185.A O no hydrogen 3.149 N/A LYS 160.A N SER 115.A O no hydrogen 2.900 N/A LYS 160.A NZ ASN 93.A OD1 no hydrogen 3.005 N/A LYS 160.A NZ TYR 217.A OH no hydrogen 3.528 N/A TYR 161.A N GLU 187.A O no hydrogen 3.058 N/A PHE 162.A N VAL 117.A O no hydrogen 3.140 N/A LYS 164.A N GLY 190.A O no hydrogen 3.265 N/A GLY 165.A N GLY 190.A O no hydrogen 2.910 N/A ALA 167.A N LYS 164.A O no hydrogen 3.069 N/A HIS 168.A ND1 GLU 171.A OE2 no hydrogen 2.929 N/A GLU 169.A N LEU 166.A O no hydrogen 3.202 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.903 N/A TYR 172.A N HIS 168.A O no hydrogen 2.802 N/A TYR 172.A OH ILE 200.A O no hydrogen 2.745 N/A ARG 173.A N GLU 169.A O no hydrogen 2.919 N/A ALA 174.A N GLU 170.A O no hydrogen 3.190 N/A VAL 175.A N GLU 171.A O no hydrogen 3.010 N/A ALA 176.A N TYR 172.A O no hydrogen 2.871 N/A LYS 177.A N ARG 173.A O no hydrogen 2.878 N/A ALA 178.A N ALA 174.A O no hydrogen 3.026 N/A CYS 179.A N VAL 175.A O no hydrogen 2.898 N/A CYS 179.A SG VAL 175.A O no hydrogen 3.443 N/A CYS 179.A SG ALA 185.A O no hydrogen 3.961 N/A ALA 180.A N ALA 176.A O no hydrogen 2.858 N/A GLU 181.A N LYS 177.A O no hydrogen 2.967 N/A GLU 182.A N ALA 178.A O no hydrogen 3.029 N/A GLY 183.A N ALA 180.A O no hydrogen 3.116 N/A PHE 184.A N CYS 179.A O no hydrogen 2.867 N/A LEU 186.A N GLN 211.A O no hydrogen 3.231 N/A GLU 187.A N LEU 159.A O no hydrogen 2.752 N/A THR 189.A N TYR 161.A O no hydrogen 3.045 N/A THR 189.A OG1 GLU 187.A O no hydrogen 3.289 N/A ASP 193.A N ASN 196.A OD1 no hydrogen 2.832 N/A ASN 196.A N ASP 193.A OD1 no hydrogen 2.912 N/A ASN 196.A ND2 GLY 191.A O no hydrogen 2.994 N/A PHE 197.A N ASP 193.A O no hydrogen 3.022 N/A ILE 200.A N ASN 196.A O no hydrogen 3.038 N/A VAL 201.A N PHE 197.A O no hydrogen 2.934 N/A ARG 202.A N GLU 198.A O no hydrogen 2.779 N/A ARG 202.A NE GLU 198.A OE2 no hydrogen 3.013 N/A ARG 202.A NH1 TYR 247.A OH no hydrogen 3.102 N/A ILE 203.A N THR 199.A O no hydrogen 2.851 N/A LEU 205.A N VAL 201.A O no hydrogen 2.914 N/A GLU 206.A N ARG 202.A O no hydrogen 2.759 N/A ALA 207.A N ILE 203.A O no hydrogen 3.231 N/A ASN 208.A N LEU 205.A O no hydrogen 2.909 N/A VAL 209.A N ALA 204.A O no hydrogen 3.048 N/A GLN 211.A NE2 GLN 5.A OE1 no hydrogen 3.022 N/A GLN 211.A NE2 GLY 11.A O no hydrogen 2.886 N/A VAL 212.A N ARG 12.A O no hydrogen 2.849 N/A ILE 213.A N LEU 186.A O no hydrogen 2.958 N/A HIS 215.A N PRO 188.A O no hydrogen 3.058 N/A HIS 215.A ND1 TYR 217.A OH no hydrogen 2.621 N/A HIS 215.A NE2 GLU 187.A OE1 no hydrogen 2.742 N/A VAL 216.A N ASN 16.A O no hydrogen 2.933 N/A SER 219.A OG ILE 192.A O no hydrogen 2.797 N/A ILE 220.A N TYR 217.A O no hydrogen 3.133 N/A ILE 221.A N SER 218.A O no hydrogen 3.196 N/A ASP 222.A N ASN 227.A O no hydrogen 2.852 N/A THR 225.A N ASP 222.A OD2 no hydrogen 2.791 N/A THR 225.A OG1 ASP 222.A OD2 no hydrogen 2.768 N/A GLY 226.A N ASP 222.A O no hydrogen 2.767 N/A ASN 227.A N THR 225.A OG1 no hydrogen 3.153 N/A THR 228.A OG1 LEU 18.A O no hydrogen 2.606 N/A LYS 229.A N ILE 220.A O no hydrogen 2.785 N/A LYS 229.A NZ ASP 222.A OD1 no hydrogen 2.853 N/A VAL 233.A N LYS 229.A O no hydrogen 3.088 N/A ARG 234.A N VAL 230.A O no hydrogen 2.925 N/A GLU 235.A N GLU 231.A O no hydrogen 3.017 N/A LEU 236.A N ALA 232.A O no hydrogen 2.948 N/A LEU 237.A N VAL 233.A O no hydrogen 2.901 N/A ALA 238.A N ARG 234.A O no hydrogen 3.032 N/A VAL 239.A N GLU 235.A O no hydrogen 3.114 N/A VAL 240.A N LEU 236.A O no hydrogen 2.934 N/A LYS 241.A N LEU 237.A O no hydrogen 2.896 N/A LYS 241.A NZ GLU 33.A OE1 no hydrogen 2.774 N/A LYS 242.A N ALA 238.A O no hydrogen 3.037 N/A LEU 243.A N VAL 239.A O no hydrogen 3.009 N/A VAL 244.A N VAL 240.A O no hydrogen 2.848 N/A ASP 245.A N LYS 241.A O no hydrogen 2.895 N/A GLN 246.A N LEU 243.A O no hydrogen 3.040 N/A GLN 246.A NE2 LEU 243.A O no hydrogen 2.970 N/A TYR 247.A N VAL 244.A O no hydrogen 3.178 N/A TYR 247.A OH GLU 206.A OE1 no hydrogen 2.674 N/A