Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5xmx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N VAL 1.A O no hydrogen 3.104 N/A ALA 6.A N ALA 2.A O no hydrogen 3.401 N/A PHE 7.A N ASP 3.A O no hydrogen 2.805 N/A SER 8.A N LEU 4.A O no hydrogen 2.793 N/A SER 8.A OG LEU 4.A O no hydrogen 2.999 N/A LYS 9.A N LYS 5.A O no hydrogen 2.995 N/A HIS 10.A N ALA 6.A O no hydrogen 2.968 N/A HIS 10.A ND1 ALA 6.A O no hydrogen 2.904 N/A ILE 11.A N PHE 7.A O no hydrogen 2.999 N/A TYR 12.A N SER 8.A O no hydrogen 2.832 N/A ASN 13.A N LYS 9.A O no hydrogen 2.906 N/A ALA 14.A N HIS 10.A O no hydrogen 3.000 N/A TYR 15.A N ILE 11.A O no hydrogen 3.176 N/A TYR 15.A OH ASP 164.A OD1 no hydrogen 2.681 N/A LEU 16.A N TYR 12.A O no hydrogen 2.920 N/A LYS 17.A N ASN 13.A O no hydrogen 3.112 N/A ASN 18.A N TYR 15.A O no hydrogen 3.202 N/A ASN 18.A ND2 ALA 14.A O no hydrogen 2.631 N/A ASN 18.A ND2 SER 85.A OG no hydrogen 3.425 N/A PHE 19.A N TYR 15.A O no hydrogen 3.109 N/A ASN 20.A N GLU 78.A OE2 no hydrogen 2.896 N/A LYS 23.A N ASP 164.A OD1 no hydrogen 2.839 N/A LYS 23.A NZ LEU 162.A O no hydrogen 2.875 N/A LYS 24.A N ASP 164.A OD2 no hydrogen 2.762 N/A LYS 25.A N THR 22.A OG1 no hydrogen 3.003 N/A ALA 26.A N THR 22.A O no hydrogen 2.998 N/A ARG 27.A N LYS 23.A O no hydrogen 2.850 N/A ARG 27.A NH1 SER 115.A O no hydrogen 2.826 N/A ARG 27.A NH1 VAL 117.A O no hydrogen 2.882 N/A ARG 27.A NH2 VAL 117.A O no hydrogen 3.182 N/A SER 28.A N LYS 24.A O no hydrogen 3.302 N/A SER 28.A OG LYS 24.A O no hydrogen 3.511 N/A SER 28.A OG LYS 25.A O no hydrogen 2.731 N/A ILE 29.A N LYS 25.A O no hydrogen 2.920 N/A LEU 30.A N ALA 26.A O no hydrogen 2.806 N/A THR 31.A N ARG 27.A O no hydrogen 3.058 N/A THR 31.A OG1 ARG 27.A O no hydrogen 2.782 N/A GLY 32.A N ILE 29.A O no hydrogen 3.083 N/A PHE 35.A N SER 128.A O no hydrogen 2.975 N/A ILE 37.A N PHE 130.A O no hydrogen 2.864 N/A HIS 38.A N THR 42.A OG1 no hydrogen 2.858 N/A ASP 39.A N THR 42.A OG1 no hydrogen 3.015 N/A THR 42.A N ASP 39.A OD1 no hydrogen 2.956 N/A THR 42.A OG1 ASP 39.A O no hydrogen 3.161 N/A THR 42.A OG1 ASP 39.A OD1 no hydrogen 2.806 N/A LEU 43.A N ASP 39.A O no hydrogen 3.049 N/A TRP 44.A N ILE 40.A O no hydrogen 2.966 N/A GLN 45.A N GLU 41.A O no hydrogen 2.895 N/A GLN 45.A NE2 GLU 41.A OE2 no hydrogen 2.353 N/A ALA 46.A N THR 42.A O no hydrogen 2.852 N/A GLU 47.A N LEU 43.A O no hydrogen 2.993 N/A LYS 48.A N TRP 44.A O no hydrogen 3.074 N/A LYS 48.A N GLN 45.A O no hydrogen 3.051 N/A GLY 49.A N GLN 45.A O no hydrogen 3.347 N/A VAL 51.A N ALA 46.A O no hydrogen 3.148 N/A TRP 52.A N ALA 46.A O no hydrogen 2.963 N/A LYS 58.A NZ GLU 245.A OE1 no hydrogen 3.019 N/A HIS 63.A N GLU 59.A O no hydrogen 2.999 N/A HIS 63.A NE2 GLU 47.A OE2 no hydrogen 2.406 N/A VAL 64.A N ILE 60.A O no hydrogen 3.013 N/A PHE 65.A N SER 61.A O no hydrogen 3.138 N/A TYR 66.A N VAL 62.A O no hydrogen 2.881 N/A ARG 67.A N HIS 63.A O no hydrogen 2.976 N/A ARG 67.A NE GLU 47.A OE2 no hydrogen 2.768 N/A ARG 67.A NH2 GLU 47.A OE1 no hydrogen 2.806 N/A CYS 68.A N VAL 64.A O no hydrogen 2.921 N/A CYS 68.A SG VAL 64.A O no hydrogen 3.453 N/A GLN 69.A N PHE 65.A O no hydrogen 2.948 N/A GLN 69.A NE2 SER 247.A O no hydrogen 2.965 N/A CYS 70.A N TYR 66.A O no hydrogen 2.997 N/A CYS 70.A SG TYR 66.A O no hydrogen 3.514 N/A THR 71.A N ARG 67.A O no hydrogen 3.047 N/A THR 71.A OG1 ARG 67.A O no hydrogen 3.173 N/A THR 72.A N CYS 68.A O no hydrogen 2.934 N/A THR 72.A OG1 CYS 68.A O no hydrogen 3.410 N/A VAL 73.A N GLN 69.A O no hydrogen 2.975 N/A GLU 74.A N CYS 70.A O no hydrogen 3.154 N/A THR 75.A N THR 71.A O no hydrogen 2.992 N/A THR 75.A OG1 THR 71.A O no hydrogen 3.058 N/A VAL 76.A N THR 72.A O no hydrogen 2.946 N/A ARG 77.A N VAL 73.A O no hydrogen 3.178 N/A GLU 78.A N GLU 74.A O no hydrogen 3.066 N/A LEU 79.A N THR 75.A O no hydrogen 2.839 N/A THR 80.A N VAL 76.A O no hydrogen 2.784 N/A THR 80.A OG1 VAL 76.A O no hydrogen 2.811 N/A GLU 81.A N ARG 77.A O no hydrogen 3.169 N/A PHE 82.A N GLU 78.A O no hydrogen 2.772 N/A ALA 83.A N LEU 79.A O no hydrogen 2.798 N/A LYS 84.A N THR 80.A O no hydrogen 3.152 N/A LYS 84.A NZ GLU 81.A OE2 no hydrogen 2.994 N/A SER 85.A N PHE 82.A O no hydrogen 2.874 N/A SER 85.A OG GLU 81.A O no hydrogen 3.368 N/A ILE 86.A N ALA 83.A O no hydrogen 2.886 N/A PHE 89.A N ILE 86.A O no hydrogen 2.853 N/A SER 91.A N SER 88.A O no hydrogen 3.243 N/A SER 91.A OG SER 88.A O no hydrogen 3.247 N/A LEU 92.A N PHE 89.A O no hydrogen 3.184 N/A GLN 97.A N PHE 93.A O no hydrogen 2.998 N/A GLN 97.A NE2 LEU 92.A O no hydrogen 2.992 N/A VAL 98.A N LEU 94.A O no hydrogen 3.069 N/A THR 99.A N ASN 95.A O no hydrogen 2.877 N/A THR 99.A OG1 ASN 95.A O no hydrogen 2.871 N/A THR 99.A OG1 ASN 95.A OD1 no hydrogen 3.465 N/A LEU 100.A N ASP 96.A O no hydrogen 2.786 N/A LEU 101.A N GLN 97.A O no hydrogen 3.008 N/A LYS 102.A N VAL 98.A O no hydrogen 2.801 N/A LYS 102.A NZ ILE 255.A O no hydrogen 2.566 N/A TYR 103.A N THR 99.A O no hydrogen 3.056 N/A GLY 104.A N LEU 100.A O no hydrogen 2.983 N/A VAL 105.A N LEU 101.A O no hydrogen 3.078 N/A ALA 108.A N GLY 104.A O no hydrogen 2.989 N/A ILE 109.A N VAL 105.A O no hydrogen 2.688 N/A PHE 110.A N HIS 106.A O no hydrogen 2.889 N/A ALA 111.A N GLU 107.A O no hydrogen 3.023 N/A MET 112.A N ALA 108.A O no hydrogen 3.007 N/A LEU 113.A N ILE 109.A O no hydrogen 2.867 N/A SER 115.A N MET 112.A O no hydrogen 2.889 N/A ILE 116.A N LEU 113.A O no hydrogen 2.974 N/A VAL 117.A N ALA 114.A O no hydrogen 3.202 N/A ASN 118.A N GLY 121.A O no hydrogen 2.974 N/A ASP 120.A N ASN 118.A OD1 no hydrogen 2.780 N/A GLY 121.A N ASN 118.A O no hydrogen 3.287 N/A LEU 122.A N VAL 131.A O no hydrogen 2.980 N/A LEU 123.A N ILE 116.A O no hydrogen 2.936 N/A VAL 124.A N GLY 129.A O no hydrogen 2.982 N/A GLY 127.A N VAL 124.A O no hydrogen 3.084 N/A SER 128.A N ALA 125.A O no hydrogen 3.051 N/A SER 128.A OG ALA 125.A O no hydrogen 3.065 N/A GLY 129.A N VAL 124.A O no hydrogen 3.153 N/A PHE 130.A N PHE 35.A O no hydrogen 2.933 N/A VAL 131.A N LEU 122.A O no hydrogen 2.784 N/A THR 132.A N ILE 37.A O no hydrogen 3.074 N/A ARG 133.A N ASP 120.A O no hydrogen 2.839 N/A ARG 133.A NE GLU 148.A OE1 no hydrogen 3.055 N/A ARG 133.A NE GLU 148.A OE2 no hydrogen 3.356 N/A ARG 133.A NH1 LYS 119.A O no hydrogen 3.341 N/A ARG 133.A NH2 GLU 148.A OE2 no hydrogen 2.714 N/A PHE 135.A N THR 132.A OG1 no hydrogen 2.967 N/A LEU 136.A N THR 132.A O no hydrogen 3.187 N/A ARG 137.A N ARG 133.A O no hydrogen 2.887 N/A ARG 137.A NH1 GLU 134.A OE2 no hydrogen 2.418 N/A ARG 137.A NH2 GLU 148.A OE2 no hydrogen 2.820 N/A SER 138.A N GLU 134.A O no hydrogen 3.162 N/A SER 138.A N PHE 135.A O no hydrogen 3.087 N/A SER 138.A OG PHE 135.A O no hydrogen 2.661 N/A LEU 139.A N LEU 136.A O no hydrogen 3.281 N/A ARG 140.A N SER 61.A OG no hydrogen 2.913 N/A ARG 140.A NE GLU 59.A OE1 no hydrogen 3.216 N/A ARG 140.A NE GLU 59.A OE2 no hydrogen 3.447 N/A ARG 140.A NH1 LYS 141.A O no hydrogen 2.928 N/A ARG 140.A NH1 GLU 243.A OE2 no hydrogen 2.894 N/A ARG 140.A NH2 GLU 59.A OE2 no hydrogen 2.944 N/A ARG 140.A NH2 GLU 243.A OE1 no hydrogen 2.814 N/A ARG 140.A NH2 GLU 243.A OE2 no hydrogen 3.424 N/A PHE 143.A N ARG 140.A O no hydrogen 2.852 N/A SER 144.A N ARG 140.A O no hydrogen 3.192 N/A SER 144.A OG LEU 139.A O no hydrogen 3.018 N/A ILE 146.A N PRO 142.A O no hydrogen 3.221 N/A ILE 146.A N PHE 143.A O no hydrogen 3.275 N/A ILE 147.A N SER 144.A O no hydrogen 3.282 N/A GLU 148.A N SER 144.A O no hydrogen 3.210 N/A LYS 150.A N ILE 147.A O no hydrogen 3.088 N/A LYS 150.A NZ ILE 146.A O no hydrogen 2.750 N/A LYS 150.A NZ HIS 232.A ND1 no hydrogen 3.006 N/A GLU 152.A N GLU 148.A O no hydrogen 3.081 N/A PHE 153.A N PRO 149.A O no hydrogen 2.846 N/A ALA 154.A N LYS 150.A O no hydrogen 2.863 N/A VAL 155.A N PHE 151.A O no hydrogen 2.983 N/A PHE 157.A N PHE 153.A O no hydrogen 2.854 N/A ASN 158.A N ALA 154.A O no hydrogen 2.761 N/A ASN 158.A ND2 ALA 114.A O no hydrogen 2.958 N/A ALA 159.A N VAL 155.A O no hydrogen 3.310 N/A ALA 159.A N LYS 156.A O no hydrogen 3.261 N/A LEU 160.A N PHE 157.A O no hydrogen 2.968 N/A GLU 161.A N ASN 158.A O no hydrogen 2.885 N/A ASP 163.A N ASP 166.A OD2 no hydrogen 2.864 N/A SER 165.A OG ASP 163.A OD1 no hydrogen 2.648 N/A SER 165.A OG HIS 203.A NE2 no hydrogen 2.682 N/A ASP 166.A N ASP 163.A OD1 no hydrogen 3.126 N/A LEU 167.A N ASP 163.A O no hydrogen 2.976 N/A ALA 168.A N ASP 164.A O no hydrogen 2.854 N/A PHE 170.A N ASP 166.A O no hydrogen 3.014 N/A ILE 171.A N LEU 167.A O no hydrogen 2.757 N/A ALA 172.A N ALA 168.A O no hydrogen 3.085 N/A ALA 173.A N LEU 169.A O no hydrogen 2.909 N/A ILE 174.A N PHE 170.A O no hydrogen 3.076 N/A ILE 175.A N ILE 171.A O no hydrogen 3.080 N/A LEU 176.A N ALA 172.A O no hydrogen 2.865 N/A ARG 180.A NH1 GLU 107.A OE2 no hydrogen 3.061 N/A ARG 180.A NH2 GLU 107.A OE1 no hydrogen 2.939 N/A ARG 180.A NH2 ILE 174.A O no hydrogen 2.882 N/A MET 184.A N ASP 96.A OD1 no hydrogen 2.687 N/A ASN 185.A N ASP 96.A OD2 no hydrogen 3.108 N/A ARG 188.A N ASN 185.A OD1 no hydrogen 3.202 N/A VAL 189.A N ASN 185.A O no hydrogen 3.312 N/A GLU 190.A N VAL 186.A O no hydrogen 2.874 N/A ALA 191.A N PRO 187.A O no hydrogen 2.857 N/A ILE 192.A N ARG 188.A O no hydrogen 3.001 N/A GLN 193.A N VAL 189.A O no hydrogen 2.842 N/A GLN 193.A NE2 ALA 173.A O no hydrogen 3.134 N/A ASP 194.A N GLU 190.A O no hydrogen 2.930 N/A THR 195.A N ALA 191.A O no hydrogen 3.071 N/A THR 195.A OG1 ALA 191.A O no hydrogen 2.986 N/A ILE 196.A N ILE 192.A O no hydrogen 3.093 N/A LEU 197.A N GLN 193.A O no hydrogen 3.007 N/A ARG 198.A N ASP 194.A O no hydrogen 2.809 N/A ALA 199.A N THR 195.A O no hydrogen 2.870 N/A LEU 200.A N ILE 196.A O no hydrogen 2.664 N/A GLU 201.A N LEU 197.A O no hydrogen 2.927 N/A PHE 202.A N ARG 198.A O no hydrogen 3.080 N/A HIS 203.A N ALA 199.A O no hydrogen 2.832 N/A HIS 203.A NE2 SER 165.A OG no hydrogen 2.682 N/A LEU 204.A N LEU 200.A O no hydrogen 2.966 N/A GLN 205.A N GLU 201.A O no hydrogen 3.209 N/A ALA 206.A N PHE 202.A O no hydrogen 3.266 N/A ASN 207.A N HIS 203.A O no hydrogen 2.800 N/A ASN 207.A ND2 ASP 163.A OD1 no hydrogen 3.324 N/A ASN 207.A ND2 ASP 163.A OD2 no hydrogen 2.871 N/A ASN 207.A ND2 ASP 166.A OD1 no hydrogen 2.899 N/A ASN 207.A ND2 ASP 166.A OD2 no hydrogen 3.495 N/A HIS 208.A N LEU 204.A O no hydrogen 2.685 N/A HIS 208.A NE2 ASP 166.A OD2 no hydrogen 2.545 N/A ALA 211.A N HIS 208.A O no hydrogen 3.165 N/A TYR 213.A N GLN 212.A OE1 no hydrogen 2.853 N/A LYS 217.A N TYR 213.A O no hydrogen 3.031 N/A LEU 218.A N LEU 214.A O no hydrogen 3.033 N/A LEU 219.A N PHE 215.A O no hydrogen 3.046 N/A GLN 220.A N PRO 216.A O no hydrogen 3.050 N/A LYS 221.A N LYS 217.A O no hydrogen 3.114 N/A MET 222.A N LEU 218.A O no hydrogen 3.046 N/A ALA 223.A N LEU 219.A O no hydrogen 3.133 N/A ASP 224.A N GLN 220.A O no hydrogen 2.792 N/A LEU 225.A N LYS 221.A O no hydrogen 2.772 N/A ARG 226.A N MET 222.A O no hydrogen 3.093 N/A ARG 226.A NH2 ASP 179.A OD1 no hydrogen 2.925 N/A GLN 227.A N ALA 223.A O no hydrogen 3.184 N/A LEU 228.A N ASP 224.A O no hydrogen 2.827 N/A VAL 229.A N LEU 225.A O no hydrogen 2.965 N/A VAL 229.A N ARG 226.A O no hydrogen 3.188 N/A THR 230.A N ARG 226.A O no hydrogen 3.034 N/A THR 230.A OG1 ARG 226.A O no hydrogen 3.128 N/A GLU 231.A N GLN 227.A O no hydrogen 2.867 N/A HIS 232.A N LEU 228.A O no hydrogen 2.892 N/A ALA 233.A N VAL 229.A O no hydrogen 2.699 N/A GLN 234.A N THR 230.A O no hydrogen 3.071 N/A MET 235.A N GLU 231.A O no hydrogen 3.056 N/A MET 236.A N HIS 232.A O no hydrogen 2.897 N/A GLN 237.A N ALA 233.A O no hydrogen 2.930 N/A ARG 238.A N GLN 234.A O no hydrogen 2.984 N/A ILE 239.A N MET 235.A O no hydrogen 2.986 N/A LYS 240.A N MET 236.A O no hydrogen 2.943 N/A LYS 241.A N GLN 237.A O no hydrogen 2.871 N/A THR 242.A N ARG 238.A O no hydrogen 2.845 N/A THR 242.A OG1 ARG 238.A O no hydrogen 2.745 N/A GLU 243.A N ILE 239.A O no hydrogen 2.964 N/A THR 246.A N GLU 243.A O no hydrogen 3.231 N/A SER 247.A N TYR 66.A OH no hydrogen 2.991 N/A HIS 249.A N GLN 69.A OE1 no hydrogen 2.873 N/A LEU 251.A N HIS 249.A ND1 no hydrogen 2.980 N/A GLN 253.A N HIS 249.A O no hydrogen 2.858 N/A GLU 254.A N PRO 250.A O no hydrogen 3.027 N/A ILE 255.A N LEU 251.A O no hydrogen 3.166 N/A TYR 256.A N LEU 252.A O no hydrogen 2.991 N/A TYR 256.A OH HIS 106.A NE2 no hydrogen 3.024 N/A LYS 257.A N GLU 254.A O no hydrogen 3.068 N/A