Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6mrf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N GLY 188.A O no hydrogen 2.918 N/A LYS 3.A NZ ILE 169.A O no hydrogen 3.150 N/A LYS 3.A NZ THR 190.A OG1 no hydrogen 3.190 N/A THR 4.A N GLU 7.A OE1 no hydrogen 3.021 N/A THR 4.A OG1 GLU 7.A OE1 no hydrogen 3.514 N/A GLU 7.A N THR 4.A OG1 no hydrogen 3.164 N/A ILE 8.A N THR 4.A O no hydrogen 2.817 N/A GLU 9.A N PRO 5.A O no hydrogen 2.906 N/A LYS 10.A N ASP 6.A O no hydrogen 3.093 N/A MET 11.A N GLU 7.A O no hydrogen 3.040 N/A ARG 12.A N ILE 8.A O no hydrogen 2.875 N/A ARG 12.A NE GLU 236.A OE1 no hydrogen 3.324 N/A ARG 12.A NE GLU 236.A OE2 no hydrogen 2.752 N/A ARG 12.A NH2 GLU 236.A OE1 no hydrogen 2.998 N/A ILE 13.A N GLU 9.A O no hydrogen 3.231 N/A ALA 14.A N LYS 10.A O no hydrogen 3.093 N/A GLY 15.A N MET 11.A O no hydrogen 2.806 N/A ARG 16.A N ARG 12.A O no hydrogen 2.979 N/A LEU 17.A N ILE 13.A O no hydrogen 2.993 N/A ALA 18.A N ALA 14.A O no hydrogen 2.968 N/A ALA 19.A N GLY 15.A O no hydrogen 2.987 N/A GLU 20.A N ARG 16.A O no hydrogen 2.899 N/A VAL 21.A N LEU 17.A O no hydrogen 3.118 N/A LEU 22.A N ALA 18.A O no hydrogen 3.388 N/A ASP 23.A N ALA 19.A O no hydrogen 3.112 N/A MET 24.A N GLU 20.A O no hydrogen 2.867 N/A ILE 25.A N VAL 21.A O no hydrogen 3.136 N/A LYS 26.A N ASP 23.A O no hydrogen 3.263 N/A LYS 26.A NZ ASP 23.A OD1 no hydrogen 2.835 N/A HIS 28.A N ILE 25.A O no hydrogen 2.938 N/A ILE 29.A N LYS 26.A O no hydrogen 3.079 N/A GLY 32.A N LEU 83.A O no hydrogen 2.867 N/A VAL 33.A N LYS 30.A O no hydrogen 3.282 N/A SER 34.A N GLU 37.A OE1 no hydrogen 2.949 N/A SER 34.A OG GLU 37.A OE1 no hydrogen 3.372 N/A THR 35.A N LYS 81.A O no hydrogen 3.047 N/A THR 35.A OG1 SER 78.A O no hydrogen 3.334 N/A LEU 36.A N SER 78.A O no hydrogen 3.204 N/A GLU 37.A N SER 34.A OG no hydrogen 3.028 N/A LEU 38.A N SER 34.A O no hydrogen 3.355 N/A ASP 39.A N THR 35.A O no hydrogen 3.047 N/A THR 40.A N LEU 36.A O no hydrogen 2.911 N/A THR 40.A OG1 LEU 36.A O no hydrogen 3.298 N/A ILE 41.A N GLU 37.A O no hydrogen 3.069 N/A CYS 42.A N LEU 38.A O no hydrogen 2.992 N/A CYS 42.A SG LEU 38.A O no hydrogen 3.387 N/A ARG 43.A N ASP 39.A O no hydrogen 2.827 N/A ASN 44.A N THR 40.A O no hydrogen 2.936 N/A HIS 45.A N ILE 41.A O no hydrogen 2.990 N/A HIS 45.A NE2 GLU 20.A OE1 no hydrogen 2.829 N/A ILE 46.A N CYS 42.A O no hydrogen 2.889 N/A GLU 47.A N ARG 43.A O no hydrogen 2.903 N/A ASN 48.A N ASN 44.A O no hydrogen 2.848 N/A ASN 48.A ND2 ASN 44.A OD1 no hydrogen 2.914 N/A VAL 49.A N HIS 45.A O no hydrogen 3.067 N/A GLN 50.A N HIS 45.A O no hydrogen 2.862 N/A GLN 50.A NE2 LEU 17.A O no hydrogen 2.986 N/A GLN 50.A NE2 GLU 20.A OE1 no hydrogen 2.899 N/A ALA 52.A N ILE 46.A O no hydrogen 2.843 N/A ILE 53.A N ILE 96.A O no hydrogen 2.881 N/A VAL 57.A N PRO 54.A O no hydrogen 3.195 N/A GLY 58.A N ALA 55.A O no hydrogen 3.170 N/A HIS 62.A ND1 ASP 39.A OD2 no hydrogen 3.219 N/A SER 63.A N ASP 39.A OD1 no hydrogen 2.778 N/A SER 63.A OG.A ASP 39.A O no hydrogen 3.271 N/A SER 63.A OG.A ASP 39.A OD1 no hydrogen 2.995 N/A ILE 64.A N ASP 39.A OD1 no hydrogen 3.247 N/A CYS 65.A N ASP 92.A O no hydrogen 2.979 N/A THR 66.A N GLY 75.A O no hydrogen 2.902 N/A SER 67.A N ASN 90.A O no hydrogen 2.919 N/A ASN 69.A N ILE 88.A O no hydrogen 2.910 N/A ASN 69.A ND2 ASP 87.A OD1 no hydrogen 3.054 N/A VAL 71.A N VAL 68.A O no hydrogen 2.994 N/A VAL 72.A N VAL 213.A O no hydrogen 2.673 N/A CYS 73.A N VAL 213.A O no hydrogen 3.434 N/A GLY 75.A N SER 67.A OG no hydrogen 3.097 N/A SER 78.A N THR 35.A OG1 no hydrogen 2.968 N/A ASN 80.A N SER 78.A OG no hydrogen 2.951 N/A LYS 81.A N SER 78.A O no hydrogen 3.387 N/A LEU 83.A N VAL 33.A O no hydrogen 2.911 N/A LYS 84.A N ASP 87.A OD2 no hydrogen 2.966 N/A LYS 84.A NZ ASP 87.A OD1 no hydrogen 2.777 N/A GLY 86.A N VAL 110.A O no hydrogen 2.970 N/A ASP 87.A N LYS 84.A O no hydrogen 3.066 N/A ILE 88.A N ASN 69.A OD1 no hydrogen 3.080 N/A LEU 89.A N TYR 108.A O no hydrogen 2.835 N/A ASN 90.A N SER 67.A O no hydrogen 2.798 N/A ASN 90.A ND2 ASN 105.A OD1 no hydrogen 2.963 N/A ASN 90.A ND2 GLN 223.A O no hydrogen 2.904 N/A ILE 91.A N MET 106.A O no hydrogen 3.181 N/A ASP 92.A N CYS 65.A O no hydrogen 2.946 N/A VAL 93.A N THR 104.A O no hydrogen 3.030 N/A THR 94.A OG1 ASP 103.A OD1 no hydrogen 3.426 N/A VAL 95.A N GLY 102.A O no hydrogen 2.982 N/A ILE 96.A N ILE 53.A O no hydrogen 2.868 N/A LYS 97.A N TYR 100.A O no hydrogen 2.848 N/A LYS 97.A NZ GLN 50.A O no hydrogen 3.296 N/A LYS 97.A NZ HIS 51.A O no hydrogen 3.514 N/A TYR 100.A N LYS 97.A O no hydrogen 3.272 N/A TYR 100.A OH GLU 7.A OE2 no hydrogen 2.442 N/A HIS 101.A ND1 ASP 103.A OD1 no hydrogen 2.779 N/A GLY 102.A N VAL 95.A O no hydrogen 2.881 N/A ASP 103.A N THR 227.A OG1 no hydrogen 3.022 N/A THR 104.A N VAL 93.A O no hydrogen 3.127 N/A THR 104.A OG1 GLU 225.A O no hydrogen 2.761 N/A ASN 105.A N GLU 225.A O no hydrogen 3.408 N/A MET 106.A N ILE 91.A O no hydrogen 3.241 N/A TYR 108.A N LEU 89.A O no hydrogen 2.700 N/A TYR 108.A OH LEU 22.A O no hydrogen 2.721 N/A VAL 110.A N ASP 87.A O no hydrogen 2.942 N/A GLY 112.A N ILE 109.A O no hydrogen 3.023 N/A THR 114.A OG1 GLY 86.A O no hydrogen 2.708 N/A SER 115.A N THR 114.A OG1 no hydrogen 2.773 N/A ALA 118.A N SER 115.A OG no hydrogen 2.916 N/A ASN 119.A N SER 115.A O no hydrogen 2.988 N/A ASN 119.A ND2 SER 115.A O no hydrogen 3.064 N/A ARG 120.A N ILE 116.A O no hydrogen 3.060 N/A ARG 120.A NH1 GLU 156.A O no hydrogen 2.858 N/A ARG 120.A NH2 GLU 156.A O no hydrogen 2.867 N/A LEU 121.A N LEU 117.A O no hydrogen 2.842 N/A CYS 122.A N ALA 118.A O no hydrogen 3.091 N/A CYS 122.A SG ALA 118.A O no hydrogen 3.501 N/A LYS 123.A N ASN 119.A O no hydrogen 3.038 N/A VAL 124.A N ARG 120.A O no hydrogen 2.801 N/A ALA 125.A N LEU 121.A O no hydrogen 2.935 N/A GLN 126.A N CYS 122.A O no hydrogen 3.015 N/A GLU 127.A N LYS 123.A O no hydrogen 2.954 N/A ALA 128.A N VAL 124.A O no hydrogen 2.781 N/A MET 129.A N ALA 125.A O no hydrogen 3.116 N/A TYR 130.A N GLN 126.A O no hydrogen 3.063 N/A TYR 130.A OH GLU 244.A OE2 no hydrogen 2.588 N/A ARG 131.A N GLU 127.A O no hydrogen 2.805 N/A ARG 131.A NE GLU 127.A OE2 no hydrogen 3.031 N/A GLY 132.A N ALA 128.A O no hydrogen 3.039 N/A MET 133.A N MET 129.A O no hydrogen 2.848 N/A ALA 134.A N TYR 130.A O no hydrogen 2.831 N/A THR 135.A N GLY 132.A O no hydrogen 3.215 N/A THR 135.A OG1 GLY 132.A O no hydrogen 2.931 N/A VAL 136.A N MET 133.A O no hydrogen 3.132 N/A ARG 137.A N SER 140.A OG no hydrogen 3.267 N/A ARG 137.A NH1 ALA 134.A O no hydrogen 2.633 N/A ASP 138.A N THR 231.A O no hydrogen 2.924 N/A GLY 139.A N LEU 185.A O no hydrogen 2.736 N/A SER 140.A N ARG 137.A O no hydrogen 2.934 N/A SER 140.A OG THR 135.A O no hydrogen 3.333 N/A SER 140.A OG ARG 137.A O no hydrogen 3.034 N/A TYR 141.A N ASP 144.A OD2 no hydrogen 2.846 N/A LEU 142.A N MET 183.A O no hydrogen 2.903 N/A GLY 143.A N THR 181.A O no hydrogen 2.793 N/A ASP 144.A N TYR 141.A O no hydrogen 3.060 N/A ILE 145.A N LEU 142.A O no hydrogen 3.145 N/A HIS 147.A N GLY 143.A O no hydrogen 3.068 N/A ALA 148.A N ASP 144.A O no hydrogen 2.978 N/A ILE 149.A N ILE 145.A O no hydrogen 2.997 N/A GLN 150.A N GLY 146.A O no hydrogen 2.817 N/A GLN 150.A NE2 GLU 154.A OE2 no hydrogen 3.098 N/A LYS 151.A N HIS 147.A O no hydrogen 2.969 N/A TYR 152.A N ALA 148.A O no hydrogen 3.154 N/A VAL 153.A N ILE 149.A O no hydrogen 2.886 N/A GLU 154.A N GLN 150.A O no hydrogen 2.987 N/A SER 155.A N LYS 151.A O no hydrogen 3.090 N/A SER 155.A OG TYR 152.A O no hydrogen 2.602 N/A GLU 156.A N TYR 152.A O no hydrogen 3.098 N/A GLU 156.A N VAL 153.A O no hydrogen 2.999 N/A ARG 157.A N GLU 154.A O no hydrogen 2.973 N/A PHE 158.A N VAL 153.A O no hydrogen 3.228 N/A SER 159.A N ASN 198.A O no hydrogen 3.102 N/A SER 159.A OG.A GLY 200.A O no hydrogen 2.755 N/A SER 159.A OG.B ASN 198.A O no hydrogen 3.443 N/A SER 159.A OG.B GLY 200.A O no hydrogen 2.777 N/A VAL 161.A N MET 196.A O no hydrogen 2.972 N/A CYS 165.A N LEU 174.A O no hydrogen 2.879 N/A CYS 165.A SG LEU 174.A O no hydrogen 3.783 N/A HIS 167.A N THR 192.A O no hydrogen 3.261 N/A HIS 167.A N THR 192.A OG1 no hydrogen 3.260 N/A HIS 167.A ND1 GLU 194.A OE2 no hydrogen 3.155 N/A GLY 168.A N GLN 172.A O no hydrogen 2.801 N/A ILE 169.A N THR 190.A O no hydrogen 3.293 N/A LEU 174.A N GLY 166.A O no hydrogen 2.740 N/A GLY 180.A N ASP 144.A OD1 no hydrogen 2.774 N/A THR 181.A N GLN 178.A O no hydrogen 3.397 N/A THR 181.A OG1 GLN 178.A O no hydrogen 2.471 N/A ARG 184.A NH1 TYR 141.A OH no hydrogen 3.190 N/A LEU 185.A N SER 140.A O no hydrogen 2.700 N/A ALA 187.A N ASP 138.A OD2 no hydrogen 2.798 N/A GLY 188.A N VAL 230.A O no hydrogen 2.853 N/A MET 189.A N GLU 186.A O no hydrogen 3.129 N/A THR 190.A OG1 ILE 169.A O no hydrogen 2.652 N/A PHE 191.A N ILE 228.A O no hydrogen 3.155 N/A THR 192.A N HIS 167.A O no hydrogen 2.784 N/A THR 192.A OG1 HIS 167.A O no hydrogen 3.303 N/A THR 192.A OG1 GLU 194.A OE2 no hydrogen 3.138 N/A ILE 193.A N HIS 226.A O no hydrogen 3.001 N/A GLU 194.A N CYS 165.A O no hydrogen 2.711 N/A VAL 197.A N ALA 222.A O no hydrogen 2.782 N/A ASN 198.A N SER 159.A O no hydrogen 2.846 N/A ASN 198.A ND2 VAL 201.A O no hydrogen 2.984 N/A ALA 199.A N LEU 220.A O no hydrogen 2.756 N/A VAL 201.A N ASP 217.A OD2 no hydrogen 2.830 N/A GLN 203.A N GLN 203.A OE1 no hydrogen 2.854 N/A LYS 205.A N VAL 214.A O no hydrogen 2.819 N/A LEU 207.A N THR 212.A O no hydrogen 2.802 N/A LYS 210.A N LEU 207.A O no hydrogen 2.892 N/A TRP 211.A N ASP 209.A OD1 no hydrogen 2.915 N/A THR 212.A N ASP 209.A OD1 no hydrogen 2.909 N/A THR 212.A OG1 ASP 209.A OD2 no hydrogen 2.753 N/A VAL 213.A N CYS 73.A O no hydrogen 3.179 N/A VAL 214.A N LYS 205.A O no hydrogen 2.925 N/A THR 215.A N HIS 70.A O no hydrogen 3.090 N/A THR 215.A OG1 LYS 219.A O no hydrogen 2.761 N/A LYS 216.A N GLN 203.A O no hydrogen 2.933 N/A HIS 218.A N THR 215.A O no hydrogen 3.438 N/A LYS 219.A N ASP 217.A OD1 no hydrogen 3.184 N/A SER 221.A N ASN 69.A O no hydrogen 3.174 N/A SER 221.A OG VAL 197.A O no hydrogen 3.350 N/A SER 221.A OG ASN 198.A OD1 no hydrogen 2.746 N/A ALA 222.A N VAL 197.A O no hydrogen 2.863 N/A GLN 223.A NE2 GLU 194.A O no hydrogen 3.065 N/A GLU 225.A N ASN 105.A O no hydrogen 3.049 N/A HIS 226.A N ILE 193.A O no hydrogen 3.137 N/A HIS 226.A ND1 THR 239.A OG1 no hydrogen 2.702 N/A HIS 226.A NE2 GLU 244.A OE2 no hydrogen 2.765 N/A THR 227.A N THR 239.A OG1 no hydrogen 2.949 N/A THR 227.A OG1 ASP 103.A O no hydrogen 2.761 N/A ILE 228.A N PHE 191.A O no hydrogen 2.801 N/A LEU 229.A N GLU 236.A O no hydrogen 2.827 N/A VAL 230.A N MET 189.A O no hydrogen 2.875 N/A THR 231.A N GLY 234.A O no hydrogen 2.843 N/A THR 233.A N THR 231.A OG1 no hydrogen 3.315 N/A GLY 234.A N THR 231.A OG1 no hydrogen 2.886 N/A GLU 236.A N LEU 229.A O no hydrogen 2.793 N/A LEU 238.A N THR 227.A O no hydrogen 2.883 N/A THR 239.A OG1 HIS 226.A ND1 no hydrogen 2.702 N/A ALA 240.A N VAL 237.A O no hydrogen 3.126 N/A ARG 241.A N GLU 244.A OE1 no hydrogen 3.050 N/A GLU 244.A N ARG 241.A O no hydrogen 2.862 N/A