Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6mja_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A ND2 MET 101.A O no hydrogen 3.186 N/A PHE 5.A N CYS 99.A O no hydrogen 3.005 N/A ARG 6.A N TRP 26.A O no hydrogen 2.760 N/A CYS 7.A N ALA 97.A O no hydrogen 2.666 N/A LEU 8.A N VAL 24.A O no hydrogen 2.844 N/A GLN 9.A N LEU 95.A O no hydrogen 2.819 N/A GLN 9.A NE2 SER 11.A OG no hydrogen 3.053 N/A MET 10.A N ASP 22.A O no hydrogen 2.817 N/A SER 11.A N ILE 93.A O no hydrogen 2.766 N/A SER 11.A OG THR 21.A OG1 no hydrogen 2.793 N/A SER 12.A N ARG 20.A O no hydrogen 2.955 N/A SER 12.A OG GLU 92.A OE1 no hydrogen 2.731 N/A PHE 13.A N ILE 91.A O no hydrogen 2.716 N/A ALA 14.A N TRP 18.A O no hydrogen 3.199 N/A SER 17.A N ASN 15.A OD1 no hydrogen 3.434 N/A SER 17.A OG ASN 15.A OD1 no hydrogen 3.237 N/A TRP 18.A N ASN 15.A OD1 no hydrogen 3.077 N/A ARG 20.A N SER 12.A O no hydrogen 3.006 N/A ARG 20.A NE ASP 22.A OD2 no hydrogen 2.768 N/A ARG 20.A NH2 ASP 22.A OD1 no hydrogen 3.056 N/A ARG 20.A NH2 ASP 22.A OD2 no hydrogen 3.400 N/A THR 21.A N ASN 37.A OD1 no hydrogen 2.758 N/A THR 21.A OG1 SER 11.A OG no hydrogen 2.793 N/A ASP 22.A N MET 10.A O no hydrogen 2.900 N/A SER 23.A N TRP 35.A O no hydrogen 2.954 N/A VAL 24.A N LEU 8.A O no hydrogen 3.014 N/A VAL 25.A N HIS 33.A O no hydrogen 3.092 N/A TRP 26.A N ARG 6.A O no hydrogen 2.747 N/A LEU 27.A N LEU 30.A O no hydrogen 2.902 N/A GLY 28.A N THR 4.A O no hydrogen 2.878 N/A LEU 30.A N LEU 27.A O no hydrogen 3.192 N/A GLN 31.A NE2 HIS 33.A O no hydrogen 3.010 N/A THR 32.A N VAL 25.A O no hydrogen 2.863 N/A THR 32.A OG1 VAL 25.A O no hydrogen 3.364 N/A THR 32.A OG1 HIS 33.A ND1 no hydrogen 2.815 N/A HIS 33.A N VAL 25.A O no hydrogen 3.515 N/A HIS 33.A ND1 THR 32.A OG1 no hydrogen 2.815 N/A ARG 34.A N SER 43.A O no hydrogen 2.990 N/A TRP 35.A N SER 23.A O no hydrogen 2.784 N/A TRP 35.A NE1 SER 39.A O no hydrogen 3.110 N/A ASN 37.A N ASP 22.A OD1 no hydrogen 2.904 N/A ASP 38.A N SER 36.A OG no hydrogen 3.096 N/A SER 39.A N SER 36.A O no hydrogen 3.240 N/A SER 39.A OG THR 41.A O no hydrogen 2.577 N/A THR 41.A N SER 39.A OG no hydrogen 3.207 N/A ILE 42.A N GLN 62.A OE1 no hydrogen 2.819 N/A SER 43.A N ARG 34.A O no hydrogen 2.778 N/A THR 45.A N THR 32.A O no hydrogen 3.029 N/A THR 45.A OG1 GLN 31.A O no hydrogen 2.842 N/A LYS 46.A N SER 49.A OG no hydrogen 3.054 N/A LYS 46.A NZ GLN 31.A O no hydrogen 3.051 N/A LYS 46.A NZ GLU 233.A OE1 no hydrogen 3.069 N/A LYS 46.A NZ GLU 233.A OE2 no hydrogen 2.735 N/A TRP 48.A NE1 ASP 177.A OD2 no hydrogen 3.161 N/A SER 49.A N LYS 46.A O no hydrogen 3.344 N/A SER 49.A OG THR 32.A O no hydrogen 2.510 N/A SER 49.A OG LYS 46.A O no hydrogen 3.118 N/A GLN 50.A NE2 LEU 53.A O no hydrogen 2.739 N/A GLN 50.A NE2 ASN 55.A OD1 no hydrogen 2.992 N/A GLY 51.A N TRP 48.A O no hydrogen 2.828 N/A LEU 53.A N GLN 50.A O no hydrogen 3.254 N/A GLN 57.A N SER 54.A OG no hydrogen 3.294 N/A GLN 57.A NE2 SER 54.A OG no hydrogen 3.097 N/A TRP 58.A N SER 54.A O no hydrogen 2.962 N/A GLU 59.A N ASN 55.A O no hydrogen 3.000 N/A LYS 60.A N GLN 56.A O no hydrogen 3.149 N/A LEU 61.A N GLN 57.A O no hydrogen 3.093 N/A GLN 62.A N TRP 58.A O no hydrogen 2.788 N/A HIS 63.A N GLU 59.A O no hydrogen 2.957 N/A MET 64.A N LYS 60.A O no hydrogen 3.209 N/A PHE 65.A N LEU 61.A O no hydrogen 3.173 N/A GLN 66.A N GLN 62.A O no hydrogen 2.820 N/A GLN 66.A NE2 ALA 40.A O no hydrogen 2.942 N/A VAL 67.A N HIS 63.A O no hydrogen 2.990 N/A TYR 68.A N MET 64.A O no hydrogen 2.988 N/A TYR 68.A OH GLN 9.A OE1 no hydrogen 2.527 N/A ARG 69.A N PHE 65.A O no hydrogen 2.913 N/A ARG 69.A NH1 SER 36.A O no hydrogen 2.916 N/A ARG 69.A NH1 SER 39.A O no hydrogen 3.218 N/A ARG 69.A NH2 SER 39.A O no hydrogen 2.752 N/A VAL 70.A N GLN 66.A O no hydrogen 3.464 N/A SER 71.A N VAL 67.A O no hydrogen 2.991 N/A SER 71.A OG VAL 67.A O no hydrogen 2.653 N/A PHE 72.A N TYR 68.A O no hydrogen 2.659 N/A THR 73.A N ARG 69.A O no hydrogen 3.174 N/A THR 73.A OG1 ARG 69.A O no hydrogen 2.872 N/A ARG 74.A N VAL 70.A O no hydrogen 3.270 N/A ASP 75.A N SER 71.A O no hydrogen 2.828 N/A ILE 76.A N PHE 72.A O no hydrogen 3.011 N/A GLN 77.A N THR 73.A O no hydrogen 3.365 N/A GLU 78.A N ARG 74.A O no hydrogen 2.907 N/A LEU 79.A N ASP 75.A O no hydrogen 2.797 N/A VAL 80.A N ILE 76.A O no hydrogen 2.942 N/A LYS 81.A N GLN 77.A O no hydrogen 3.323 N/A LYS 81.A NZ GLU 78.A OE1 no hydrogen 2.749 N/A MET 82.A N GLU 78.A O no hydrogen 3.013 N/A MET 83.A N LEU 79.A O no hydrogen 3.060 N/A MET 83.A N VAL 80.A O no hydrogen 3.319 N/A LYS 86.A N MET 83.A O no hydrogen 2.802 N/A TYR 89.A N ASP 88.A OD1 no hydrogen 2.988 N/A ILE 91.A N PHE 13.A O no hydrogen 2.743 N/A GLU 92.A N GLN 116.A OE1 no hydrogen 2.864 N/A ILE 93.A N SER 11.A O no hydrogen 2.791 N/A GLN 94.A N ALA 114.A O no hydrogen 2.996 N/A LEU 95.A N GLN 9.A O no hydrogen 2.903 N/A SER 96.A N HIS 112.A O no hydrogen 2.802 N/A ALA 97.A N CYS 7.A O no hydrogen 2.978 N/A GLY 98.A N PHE 110.A O no hydrogen 3.016 N/A CYS 99.A N PHE 5.A O no hydrogen 3.267 N/A GLU 100.A N GLU 108.A O no hydrogen 2.836 N/A MET 101.A N TYR 3.A O no hydrogen 3.066 N/A TYR 102.A N ALA 106.A O no hydrogen 2.833 N/A TYR 102.A OH GLU 100.A OE1 no hydrogen 3.039 N/A GLU 108.A N GLU 100.A O no hydrogen 3.120 N/A SER 109.A OG LEU 159.A O no hydrogen 2.576 N/A PHE 110.A N GLY 98.A O no hydrogen 2.892 N/A HIS 112.A N SER 96.A O no hydrogen 2.821 N/A VAL 113.A N VAL 121.A O no hydrogen 2.743 N/A ALA 114.A N GLN 94.A O no hydrogen 2.792 N/A PHE 115.A N LYS 118.A O no hydrogen 2.806 N/A GLN 116.A N GLU 92.A O no hydrogen 2.901 N/A GLN 116.A NE2 PRO 90.A O no hydrogen 3.024 N/A LYS 118.A N PHE 115.A O no hydrogen 3.108 N/A VAL 120.A N VAL 113.A O no hydrogen 2.994 N/A VAL 121.A N VAL 113.A O no hydrogen 3.284 N/A ARG 122.A N GLN 129.A O no hydrogen 2.929 N/A ARG 122.A NE GLN 129.A OE1 no hydrogen 2.623 N/A ARG 122.A NH2 GLN 129.A OE1 no hydrogen 2.818 N/A PHE 123.A N LEU 111.A O no hydrogen 3.030 N/A TRP 124.A N SER 127.A O no hydrogen 2.902 N/A SER 127.A N TRP 124.A O no hydrogen 3.255 N/A TRP 128.A N ASN 146.A OD1 no hydrogen 2.759 N/A GLN 129.A N ARG 122.A O no hydrogen 2.891 N/A VAL 131.A N VAL 120.A O no hydrogen 2.864 N/A ALA 134.A N VAL 131.A O no hydrogen 3.186 N/A LEU 138.A N PRO 135.A O no hydrogen 3.392 N/A ASP 139.A N SER 136.A O no hydrogen 2.932 N/A LEU 140.A N TRP 137.A O no hydrogen 3.372 N/A ILE 142.A N LEU 138.A O no hydrogen 2.988 N/A LYS 143.A N ASP 139.A O no hydrogen 3.099 N/A VAL 144.A N LEU 140.A O no hydrogen 2.971 N/A LEU 145.A N PRO 141.A O no hydrogen 2.780 N/A ASN 146.A N ILE 142.A O no hydrogen 2.914 N/A ASN 146.A ND2 TRP 128.A O no hydrogen 2.903 N/A ALA 147.A N VAL 144.A O no hydrogen 3.059 N/A ASP 148.A N LEU 145.A O no hydrogen 3.293 N/A THR 151.A N ASP 148.A OD1 no hydrogen 3.122 N/A THR 151.A OG1 ASP 148.A OD2 no hydrogen 2.601 N/A SER 152.A N ASP 148.A O no hydrogen 3.234 N/A SER 152.A OG THR 126.A O no hydrogen 2.767 N/A ALA 153.A N GLN 149.A O no hydrogen 2.882 N/A THR 154.A N GLY 150.A O no hydrogen 3.095 N/A THR 154.A OG1 GLY 150.A O no hydrogen 2.662 N/A VAL 155.A N THR 151.A O no hydrogen 2.833 N/A GLN 156.A N SER 152.A O no hydrogen 2.980 N/A GLN 156.A NE2 SER 152.A O no hydrogen 3.478 N/A GLN 156.A NE2 SER 152.A OG no hydrogen 3.068 N/A MET 157.A N ALA 153.A O no hydrogen 3.202 N/A LEU 158.A N THR 154.A O no hydrogen 2.907 N/A LEU 159.A N VAL 155.A O no hydrogen 2.775 N/A ASN 160.A N GLN 156.A O no hydrogen 2.771 N/A ASP 161.A N MET 157.A O no hydrogen 2.987 N/A THR 162.A N MET 157.A O no hydrogen 3.008 N/A THR 162.A OG1 MET 157.A O no hydrogen 3.405 N/A CYS 163.A N LEU 158.A O no hydrogen 2.997 N/A LEU 165.A N ASP 161.A O no hydrogen 3.278 N/A PHE 166.A N THR 162.A O no hydrogen 2.826 N/A VAL 167.A N CYS 163.A O no hydrogen 2.894 N/A ARG 168.A N PRO 164.A O no hydrogen 2.992 N/A ARG 168.A NH2 TYR 102.A O no hydrogen 2.836 N/A GLY 169.A N LEU 165.A O no hydrogen 3.216 N/A LEU 170.A N PHE 166.A O no hydrogen 2.970 N/A LEU 171.A N VAL 167.A O no hydrogen 2.933 N/A GLU 172.A N ARG 168.A O no hydrogen 3.278 N/A ALA 173.A N GLY 169.A O no hydrogen 2.941 N/A GLY 174.A N LEU 170.A O no hydrogen 2.854 N/A ASP 177.A N GLY 174.A O no hydrogen 3.130 N/A LEU 178.A N GLY 174.A O no hydrogen 2.936 N/A GLU 179.A N LYS 175.A O no hydrogen 3.044 N/A LYS 180.A NZ GLU 233.A O no hydrogen 3.484 N/A GLU 182.A N TYR 204.A O no hydrogen 2.868 N/A VAL 185.A N SER 201.A O no hydrogen 2.853 N/A TRP 187.A N HIS 199.A O no hydrogen 2.975 N/A SER 189.A N VAL 197.A O no hydrogen 3.080 N/A SER 189.A OG HIS 199.A NE2 no hydrogen 2.886 N/A VAL 191.A N GLN 195.A O no hydrogen 3.028 N/A ARG 194.A N VAL 243.A O no hydrogen 2.904 N/A GLN 195.A N VAL 191.A O no hydrogen 3.222 N/A LEU 196.A N LEU 241.A O no hydrogen 2.818 N/A VAL 197.A N SER 189.A O no hydrogen 2.733 N/A CYS 198.A N ALA 239.A O no hydrogen 2.900 N/A HIS 199.A N TRP 187.A O no hydrogen 2.818 N/A HIS 199.A ND1 TYR 236.A OH no hydrogen 2.781 N/A HIS 199.A NE2 SER 189.A OG no hydrogen 2.886 N/A VAL 200.A N LEU 237.A O no hydrogen 2.738 N/A SER 201.A N VAL 185.A O no hydrogen 3.015 N/A GLY 202.A N TRP 235.A O no hydrogen 2.923 N/A TYR 204.A N GLU 182.A O no hydrogen 3.164 N/A TYR 204.A OH ASP 29.A OD1 no hydrogen 2.828 N/A TRP 209.A N LYS 256.A O no hydrogen 2.951 N/A MET 211.A N ARG 254.A O no hydrogen 3.140 N/A TRP 212.A N THR 222.A OG1 no hydrogen 3.371 N/A TRP 212.A NE1 ALA 239.A O no hydrogen 2.971 N/A MET 213.A N ALA 252.A O no hydrogen 2.707 N/A ARG 214.A N GLN 217.A O no hydrogen 3.123 N/A ARG 214.A NH2 GLU 247.A O no hydrogen 3.468 N/A ARG 214.A NH2 ALA 249.A O no hydrogen 3.262 N/A GLN 217.A N ARG 214.A O no hydrogen 3.056 N/A GLN 219.A N TRP 212.A O no hydrogen 2.998 N/A THR 222.A N GLN 219.A O no hydrogen 3.293 N/A THR 222.A OG1 GLN 219.A O no hydrogen 2.716 N/A HIS 223.A N THR 240.A O no hydrogen 2.843 N/A ARG 224.A NH1 VAL 208.A O no hydrogen 3.127 N/A GLY 225.A N GLN 238.A O no hydrogen 2.933 N/A LEU 228.A N TYR 236.A O no hydrogen 2.787 N/A ASN 230.A N THR 234.A O no hydrogen 2.864 N/A ASN 230.A ND2 SER 201.A OG no hydrogen 3.314 N/A ASN 230.A ND2 THR 234.A OG1 no hydrogen 3.002 N/A THR 234.A OG1 ASP 232.A OD1 no hydrogen 2.711 N/A TRP 235.A N PHE 203.A O no hydrogen 2.898 N/A TRP 235.A NE1 ASP 29.A OD2 no hydrogen 3.022 N/A TYR 236.A N LEU 228.A O no hydrogen 2.666 N/A TYR 236.A OH HIS 199.A ND1 no hydrogen 2.781 N/A TYR 236.A OH GLN 238.A OE1 no hydrogen 3.030 N/A LEU 237.A N VAL 200.A O no hydrogen 2.750 N/A ALA 239.A N CYS 198.A O no hydrogen 3.037 N/A THR 240.A N HIS 223.A O no hydrogen 3.011 N/A THR 240.A OG1 HIS 223.A O no hydrogen 3.535 N/A LEU 241.A N LEU 196.A O no hydrogen 2.839 N/A VAL 243.A N ARG 194.A O no hydrogen 2.824 N/A GLY 246.A N GLU 248.A OE1 no hydrogen 2.679 N/A GLU 247.A N GLU 244.A O no hydrogen 3.086 N/A LEU 251.A N GLU 248.A O no hydrogen 3.273 N/A ALA 252.A N MET 213.A O no hydrogen 2.647 N/A CYS 253.A N LEU 267.A O no hydrogen 2.819 N/A ARG 254.A N MET 211.A O no hydrogen 3.044 N/A VAL 255.A N ILE 265.A O no hydrogen 2.923 N/A LYS 256.A N TRP 209.A O no hydrogen 2.853 N/A LYS 256.A NZ ASP 264.A OD2 no hydrogen 2.741 N/A SER 258.A OG GLN 181.A OE1 no hydrogen 2.854 N/A SER 259.A OG GLU 182.A O no hydrogen 3.202 N/A LEU 260.A N HIS 257.A O no hydrogen 2.988 N/A ASP 264.A N GLY 262.A O no hydrogen 2.984 N/A ILE 265.A N VAL 255.A O no hydrogen 3.096 N/A LEU 267.A N CYS 253.A O no hydrogen 3.083 N/A TRP 269.A N LEU 251.A O no hydrogen 3.130 N/A