Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5b0l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 4.A OD2 no hydrogen 3.527 N/A ASP 4.A N ASP 1.A OD2 no hydrogen 3.058 N/A MET 6.A N ASP 2.A O no hydrogen 2.965 N/A LEU 7.A N ASP 3.A O no hydrogen 2.939 N/A ALA 8.A N ASP 4.A O no hydrogen 3.091 N/A ALA 9.A N LYS 5.A O no hydrogen 3.089 N/A GLU 10.A N MET 6.A O no hydrogen 2.894 N/A ALA 11.A N LEU 7.A O no hydrogen 3.101 N/A ALA 12.A N ALA 8.A O no hydrogen 2.732 N/A ASN 13.A N ALA 9.A O no hydrogen 2.717 N/A ASN 13.A ND2 LEU 41.A O no hydrogen 3.039 N/A ASN 13.A ND2 SER 61.A OG no hydrogen 3.103 N/A ARG 14.A N GLU 10.A O no hydrogen 2.921 N/A ARG 14.A NE ALA 35.A O no hydrogen 3.315 N/A ARG 14.A NH1 GLU 10.A OE2 no hydrogen 3.175 N/A ASP 15.A N ALA 11.A O no hydrogen 2.861 N/A HIS 16.A N ALA 12.A O no hydrogen 2.870 N/A HIS 16.A NE2 GLU 103.A OE1 no hydrogen 3.027 N/A HIS 16.A NE2 GLU 103.A OE2 no hydrogen 2.909 N/A VAL 17.A N ASN 13.A O no hydrogen 2.990 N/A THR 18.A N ARG 14.A O no hydrogen 2.973 N/A THR 18.A OG1 ARG 14.A O no hydrogen 3.374 N/A THR 18.A OG1 ASP 15.A O no hydrogen 3.438 N/A ARG 19.A N ASP 15.A O no hydrogen 2.974 N/A CYS 20.A N HIS 16.A O no hydrogen 3.087 N/A CYS 20.A SG GLN 23.A OE1 no hydrogen 3.887 N/A VAL 21.A N VAL 17.A O no hydrogen 2.748 N/A ALA 22.A N THR 18.A O no hydrogen 2.905 N/A GLN 23.A N ARG 19.A O no hydrogen 2.980 N/A THR 24.A N VAL 21.A O no hydrogen 3.381 N/A GLY 25.A N ALA 22.A O no hydrogen 3.252 N/A GLY 26.A N VAL 21.A O no hydrogen 3.193 N/A SER 27.A N GLU 88.A OE1 no hydrogen 3.107 N/A SER 27.A N GLU 88.A OE2 no hydrogen 3.259 N/A SER 27.A OG GLU 88.A OE1 no hydrogen 3.020 N/A LEU 30.A N SER 27.A O no hydrogen 2.848 N/A LEU 30.A N SER 27.A OG no hydrogen 3.395 N/A VAL 31.A N SER 27.A O no hydrogen 3.077 N/A ALA 32.A N PRO 28.A O no hydrogen 3.050 N/A HIS 33.A N ASP 29.A O no hydrogen 3.210 N/A HIS 33.A NE2 ASP 76.A OD2 no hydrogen 2.844 N/A THR 34.A N LEU 30.A O no hydrogen 2.965 N/A THR 34.A OG1 LEU 30.A O no hydrogen 3.510 N/A THR 34.A OG1 VAL 31.A O no hydrogen 2.825 N/A ALA 35.A N VAL 31.A O no hydrogen 3.057 N/A ALA 36.A N ALA 32.A O no hydrogen 3.027 N/A ALA 36.A N HIS 33.A O no hydrogen 3.164 N/A LEU 37.A N THR 34.A O no hydrogen 3.127 N/A ARG 38.A N ALA 36.A O no hydrogen 2.904 N/A LEU 41.A N LEU 37.A O no hydrogen 3.161 N/A LEU 41.A N ARG 38.A O no hydrogen 3.162 N/A ARG 42.A N ARG 38.A O no hydrogen 2.999 N/A ARG 42.A N LEU 39.A O no hydrogen 2.935 N/A ARG 42.A NE TYR 250.A OH no hydrogen 3.227 N/A VAL 43.A N LEU 39.A O no hydrogen 2.805 N/A HIS 45.A N ARG 42.A O no hydrogen 2.766 N/A LEU 47.A N VAL 43.A O no hydrogen 2.911 N/A THR 48.A N HIS 45.A O no hydrogen 3.209 N/A THR 48.A OG1 PRO 44.A O no hydrogen 3.099 N/A THR 48.A OG1 HIS 45.A O no hydrogen 3.352 N/A GLU 49.A N PHE 46.A O no hydrogen 3.175 N/A THR 51.A N THR 48.A O no hydrogen 2.881 N/A THR 51.A OG1 THR 48.A O no hydrogen 3.337 N/A THR 51.A OG1 GLN 170.A OE1 no hydrogen 3.431 N/A ASP 55.A N ASP 53.A OD1 no hydrogen 2.644 N/A ARG 56.A N ASP 53.A OD1 no hydrogen 3.146 N/A ARG 56.A NH1 LEU 107.A O no hydrogen 3.471 N/A ARG 56.A NH2 LEU 107.A O no hydrogen 2.724 N/A ARG 56.A NH2 CYS 165.A O no hydrogen 2.512 N/A ARG 57.A N ASP 53.A O no hydrogen 2.734 N/A ARG 57.A NE THR 48.A OG1 no hydrogen 3.115 N/A ARG 57.A NH2 HIS 45.A O no hydrogen 2.733 N/A ARG 57.A NH2 GLU 49.A OE2 no hydrogen 2.813 N/A ALA 58.A N PRO 54.A O no hydrogen 3.081 N/A ALA 59.A N ASP 55.A O no hydrogen 3.230 N/A VAL 60.A N ARG 56.A O no hydrogen 2.902 N/A SER 61.A N ARG 57.A O no hydrogen 3.098 N/A ARG 62.A N ALA 58.A O no hydrogen 3.275 N/A ALA 63.A N ALA 59.A O no hydrogen 3.182 N/A LEU 64.A N VAL 60.A O no hydrogen 3.045 N/A ALA 65.A N SER 61.A O no hydrogen 2.961 N/A LEU 66.A N ARG 62.A O no hydrogen 2.869 N/A ASP 67.A N ALA 63.A O no hydrogen 3.322 N/A ILE 68.A N LEU 64.A O no hydrogen 2.956 N/A VAL 69.A N ALA 65.A O no hydrogen 3.042 N/A SER 70.A N LEU 66.A O no hydrogen 3.084 N/A SER 70.A OG CYS 93.A O no hydrogen 2.727 N/A MET 71.A N ASP 67.A O no hydrogen 2.947 N/A LYS 72.A N ILE 68.A O no hydrogen 2.918 N/A LYS 72.A NZ ASP 76.A OD1 no hydrogen 2.679 N/A LEU 73.A N VAL 69.A O no hydrogen 2.722 N/A LEU 73.A N SER 70.A O no hydrogen 3.091 N/A LEU 74.A N SER 70.A O no hydrogen 2.976 N/A ASP 75.A N MET 71.A O no hydrogen 3.027 N/A ASP 76.A N LYS 72.A O no hydrogen 3.084 N/A LEU 77.A N LEU 73.A O no hydrogen 2.814 N/A MET 78.A N LEU 74.A O no hydrogen 3.033 N/A MET 78.A N ASP 75.A O no hydrogen 3.082 N/A ASP 79.A N ASP 75.A O no hydrogen 3.086 N/A ASP 80.A N ASP 76.A O no hydrogen 3.080 N/A LEU 84.A N THR 82.A OG1 no hydrogen 3.042 N/A GLU 88.A N ASP 85.A OD2 no hydrogen 3.068 N/A LEU 89.A N ASP 85.A O no hydrogen 3.214 N/A ALA 90.A N ARG 86.A O no hydrogen 3.271 N/A CYS 91.A N VAL 87.A O no hydrogen 2.973 N/A CYS 91.A SG VAL 87.A O no hydrogen 3.238 N/A VAL 92.A N GLU 88.A O no hydrogen 2.830 N/A CYS 93.A N LEU 89.A O no hydrogen 2.825 N/A CYS 93.A SG SER 70.A O no hydrogen 3.389 N/A LEU 94.A N ALA 90.A O no hydrogen 2.921 N/A ARG 95.A N CYS 91.A O no hydrogen 2.933 N/A ARG 95.A NE GLN 23.A OE1 no hydrogen 3.154 N/A ARG 95.A NH1 ARG 95.A O no hydrogen 2.672 N/A LEU 96.A N VAL 92.A O no hydrogen 2.786 N/A HIS 97.A N CYS 93.A O no hydrogen 3.013 N/A HIS 97.A ND1 ASP 67.A OD1 no hydrogen 2.509 N/A LEU 98.A N LEU 94.A O no hydrogen 2.894 N/A ARG 99.A N ARG 95.A O no hydrogen 3.082 N/A ARG 99.A NE GLU 103.A OE2 no hydrogen 2.783 N/A ALA 100.A N LEU 96.A O no hydrogen 2.969 N/A LEU 101.A N HIS 97.A O no hydrogen 2.975 N/A HIS 102.A N LEU 98.A O no hydrogen 3.036 N/A GLU 103.A N ARG 99.A O no hydrogen 2.871 N/A LEU 104.A N ALA 100.A O no hydrogen 2.805 N/A GLU 105.A N LEU 101.A O no hydrogen 2.965 N/A SER 106.A N HIS 102.A O no hydrogen 3.214 N/A SER 106.A N GLU 103.A O no hydrogen 2.979 N/A SER 106.A OG HIS 102.A O no hydrogen 3.429 N/A SER 106.A OG GLU 103.A O no hydrogen 2.566 N/A LEU 107.A N LEU 104.A O no hydrogen 3.154 N/A ALA 108.A N LEU 104.A O no hydrogen 3.044 N/A ARG 109.A N ALA 164.A O no hydrogen 3.513 N/A ARG 109.A NH1 ALA 163.A O no hydrogen 3.392 N/A LYS 112.A N ASP 110.A OD1 no hydrogen 3.169 N/A LYS 112.A NZ THR 115.A OG1 no hydrogen 3.244 N/A LYS 112.A NZ ASP 116.A OD1 no hydrogen 2.768 N/A ALA 113.A N ASP 110.A O no hydrogen 2.829 N/A VAL 114.A N PRO 111.A O no hydrogen 3.177 N/A THR 115.A OG1 LYS 112.A O no hydrogen 3.412 N/A ASP 116.A N LYS 112.A O no hydrogen 2.875 N/A ILE 117.A N ALA 113.A O no hydrogen 2.728 N/A LEU 118.A N VAL 114.A O no hydrogen 2.965 N/A GLU 119.A N THR 115.A O no hydrogen 2.949 N/A GLN 120.A N ASP 116.A O no hydrogen 2.944 N/A ALA 122.A N GLU 119.A O no hydrogen 3.144 N/A LEU 125.A N ASP 121.A O no hydrogen 2.904 N/A CYS 126.A N ALA 122.A O no hydrogen 2.660 N/A CYS 126.A SG ALA 122.A O no hydrogen 3.360 N/A GLY 127.A N VAL 123.A O no hydrogen 2.792 N/A GLY 128.A N HIS 124.A O no hydrogen 3.103 N/A GLN 129.A N LEU 125.A O no hydrogen 3.056 N/A ILE 130.A N CYS 126.A O no hydrogen 2.925 N/A ARG 131.A N GLY 127.A O no hydrogen 2.837 N/A THR 132.A N GLY 128.A O no hydrogen 2.801 N/A THR 132.A OG1 GLY 128.A O no hydrogen 2.662 N/A LYS 133.A N GLN 129.A O no hydrogen 3.192 N/A LYS 133.A NZ ASP 75.A OD1 no hydrogen 3.272 N/A LYS 133.A NZ ASP 79.A OD1 no hydrogen 3.099 N/A LYS 133.A NZ ASP 79.A OD2 no hydrogen 2.984 N/A ARG 134.A N ILE 130.A O no hydrogen 2.955 N/A SER 135.A N ARG 131.A O no hydrogen 3.054 N/A SER 135.A OG ARG 131.A O no hydrogen 3.233 N/A ALA 137.A N ASN 204.A OD1 no hydrogen 3.018 N/A THR 138.A N GLU 142.A OE1 no hydrogen 2.733 N/A THR 138.A OG1 GLU 142.A OE1 no hydrogen 2.839 N/A GLU 142.A N ASN 139.A OD1 no hydrogen 2.887 N/A TRP 143.A N ASN 139.A O no hydrogen 2.975 N/A TRP 143.A NE1 ASP 191.A OD1 no hydrogen 2.880 N/A ARG 144.A N LEU 140.A O no hydrogen 2.997 N/A ARG 144.A NH1 GLU 225.A OE1 no hydrogen 2.693 N/A ALA 145.A N ARG 141.A O no hydrogen 3.026 N/A HIS 146.A N GLU 142.A O no hydrogen 2.855 N/A ALA 147.A N TRP 143.A O no hydrogen 2.702 N/A SER 148.A N ARG 144.A O no hydrogen 2.994 N/A SER 148.A N ALA 145.A O no hydrogen 3.254 N/A SER 148.A OG ARG 144.A O no hydrogen 3.228 N/A SER 148.A OG ALA 145.A O no hydrogen 2.723 N/A THR 149.A N HIS 146.A O no hydrogen 3.109 N/A THR 149.A OG1 HIS 146.A O no hydrogen 2.869 N/A TYR 150.A N HIS 146.A O no hydrogen 3.465 N/A GLY 151.A N ALA 147.A O no hydrogen 2.898 N/A SER 152.A N ALA 147.A O no hydrogen 3.006 N/A SER 152.A OG GLU 180.A O no hydrogen 2.987 N/A THR 153.A N SER 148.A O no hydrogen 2.851 N/A THR 153.A OG1 HIS 124.A ND1 no hydrogen 3.184 N/A THR 153.A OG1 SER 148.A O no hydrogen 2.706 N/A PHE 154.A N THR 149.A O no hydrogen 3.203 N/A LEU 155.A N GLY 151.A O no hydrogen 3.077 N/A GLY 156.A N SER 152.A O no hydrogen 2.698 N/A ARG 157.A N THR 153.A O no hydrogen 3.029 N/A ARG 157.A N PHE 154.A O no hydrogen 3.246 N/A ARG 157.A NE ASP 121.A OD1 no hydrogen 3.471 N/A ARG 157.A NH1 LEU 118.A O no hydrogen 2.687 N/A TYR 158.A N LEU 155.A O no hydrogen 2.848 N/A TYR 158.A OH ASP 67.A OD2 no hydrogen 2.578 N/A GLY 159.A N LEU 155.A O no hydrogen 3.111 N/A ALA 160.A N GLY 156.A O no hydrogen 2.982 N/A LEU 161.A N ARG 157.A O no hydrogen 2.853 N/A ALA 162.A N TYR 158.A O no hydrogen 2.817 N/A ALA 163.A N GLY 159.A O no hydrogen 3.002 N/A ALA 164.A N ALA 160.A O no hydrogen 3.076 N/A CYS 165.A N LEU 161.A O no hydrogen 3.029 N/A CYS 165.A SG LEU 104.A O no hydrogen 3.610 N/A CYS 165.A SG LEU 161.A O no hydrogen 3.260 N/A GLY 166.A N ALA 163.A O no hydrogen 3.270 N/A VAL 175.A N PRO 171.A O no hydrogen 3.009 N/A ARG 176.A N ALA 172.A O no hydrogen 3.372 N/A ARG 176.A NE GLU 180.A OE1 no hydrogen 3.124 N/A ARG 176.A NH2 ASP 121.A OD2 no hydrogen 2.803 N/A ARG 176.A NH2 GLU 180.A OE1 no hydrogen 3.555 N/A GLU 177.A N ASP 173.A O no hydrogen 2.835 N/A PHE 178.A N SER 174.A O no hydrogen 3.047 N/A ALA 179.A N VAL 175.A O no hydrogen 2.903 N/A GLU 180.A N ARG 176.A O no hydrogen 2.913 N/A ALA 181.A N GLU 177.A O no hydrogen 3.073 N/A PHE 182.A N PHE 178.A O no hydrogen 2.789 N/A ALA 183.A N ALA 179.A O no hydrogen 2.893 N/A MET 184.A N GLU 180.A O no hydrogen 3.291 N/A THR 185.A N ALA 181.A O no hydrogen 3.173 N/A ILE 186.A N PHE 182.A O no hydrogen 3.007 N/A THR 187.A N ALA 183.A O no hydrogen 2.796 N/A THR 187.A OG1 ALA 183.A O no hydrogen 2.839 N/A MET 188.A N MET 184.A O no hydrogen 3.062 N/A MET 188.A N THR 185.A O no hydrogen 3.233 N/A ALA 189.A N THR 185.A O no hydrogen 3.072 N/A ASP 190.A N ILE 186.A O no hydrogen 3.034 N/A ASP 191.A N THR 187.A O no hydrogen 3.122 N/A LEU 192.A N MET 188.A O no hydrogen 2.777 N/A THR 193.A N ASP 190.A O no hydrogen 3.049 N/A THR 193.A OG1 ALA 189.A O no hydrogen 2.843 N/A TYR 195.A N GLU 200.A OE1 no hydrogen 3.311 N/A TYR 195.A N GLU 200.A OE2 no hydrogen 3.305 N/A ASP 196.A N ASP 194.A OD1 no hydrogen 3.193 N/A ARG 201.A NH1 HIS 207.A ND1 no hydrogen 3.455 N/A ASN 204.A ND2 ALA 137.A O no hydrogen 3.605 N/A ALA 206.A N ASP 191.A OD2 no hydrogen 3.340 N/A HIS 207.A N GLY 203.A O no hydrogen 2.837 N/A LEU 208.A N ASN 204.A O no hydrogen 2.770 N/A MET 209.A N LEU 205.A O no hydrogen 2.801 N/A ARG 210.A N ALA 206.A O no hydrogen 2.984 N/A ARG 210.A NE HIS 262.A ND1 no hydrogen 2.982 N/A THR 211.A N HIS 207.A O no hydrogen 2.813 N/A THR 211.A OG1 HIS 207.A O no hydrogen 3.176 N/A GLY 212.A N LEU 208.A O no hydrogen 3.106 N/A VAL 214.A N LEU 208.A O no hydrogen 2.979 N/A GLN 217.A NE2 ASP 221.A OD1 no hydrogen 2.833 N/A VAL 219.A N ALA 215.A O no hydrogen 3.259 N/A VAL 219.A N GLY 216.A O no hydrogen 2.909 N/A VAL 220.A N GLY 216.A O no hydrogen 3.203 N/A ASP 221.A N GLN 217.A O no hydrogen 2.802 N/A LEU 222.A N ASP 218.A O no hydrogen 3.302 N/A LEU 223.A N VAL 219.A O no hydrogen 2.919 N/A GLU 224.A N VAL 220.A O no hydrogen 3.049 N/A GLU 225.A N ASP 221.A O no hydrogen 2.820 N/A LEU 226.A N LEU 222.A O no hydrogen 2.835 N/A ARG 227.A N LEU 223.A O no hydrogen 2.990 N/A ARG 227.A N GLU 224.A O no hydrogen 3.141 N/A ARG 227.A NE GLU 224.A OE1 no hydrogen 3.126 N/A ARG 227.A NH1 HIS 248.A ND1 no hydrogen 2.838 N/A ARG 227.A NH1 ASP 252.A OD1 no hydrogen 3.021 N/A ARG 227.A NH2 GLU 224.A OE2 no hydrogen 3.032 N/A ARG 227.A NH2 ASP 252.A OD1 no hydrogen 2.999 N/A GLY 228.A N GLU 224.A O no hydrogen 2.978 N/A ARG 229.A N GLU 225.A O no hydrogen 2.881 N/A ALA 230.A N LEU 226.A O no hydrogen 3.172 N/A LEU 231.A N ARG 227.A O no hydrogen 2.888 N/A ALA 232.A N GLY 228.A O no hydrogen 2.897 N/A ALA 233.A N ARG 229.A O no hydrogen 2.990 N/A VAL 234.A N ALA 230.A O no hydrogen 2.968 N/A ALA 235.A N ALA 232.A O no hydrogen 3.220 N/A ALA 236.A N ALA 232.A O no hydrogen 3.334 N/A ALA 240.A N VAL 234.A O no hydrogen 3.086 N/A LEU 243.A N ALA 240.A O no hydrogen 2.848 N/A VAL 244.A N PRO 241.A O no hydrogen 2.915 N/A VAL 247.A N LEU 243.A O no hydrogen 2.956 N/A HIS 248.A N VAL 244.A O no hydrogen 3.265 N/A LEU 249.A N PRO 245.A O no hydrogen 2.723 N/A TYR 250.A N VAL 246.A O no hydrogen 3.113 N/A THR 251.A N VAL 247.A O no hydrogen 2.896 N/A THR 251.A OG1 VAL 247.A O no hydrogen 3.431 N/A ASP 252.A N HIS 248.A O no hydrogen 2.722 N/A ASP 253.A N LEU 249.A O no hydrogen 3.006 N/A VAL 254.A N TYR 250.A O no hydrogen 3.361 N/A LEU 255.A N THR 251.A O no hydrogen 3.191 N/A VAL 256.A N ASP 252.A O no hydrogen 2.944 N/A ARG 257.A N ASP 253.A O no hydrogen 2.825 N/A ARG 257.A NE ASP 253.A OD1 no hydrogen 2.951 N/A ARG 257.A NH2 ASP 253.A OD2 no hydrogen 2.901 N/A LEU 258.A N ASP 253.A O no hydrogen 3.323 N/A LEU 259.A N VAL 254.A O no hydrogen 2.874 N/A ARG 261.A N LEU 258.A O no hydrogen 2.970 N/A HIS 262.A N LEU 259.A O no hydrogen 2.728 N/A HIS 262.A NE2 LEU 192.A O no hydrogen 2.781 N/A