Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4di1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 32.A OE2 no hydrogen 2.900 N/A PHE 3.A N GLU 32.A OE1 no hydrogen 2.697 N/A VAL 4.A N GLU 32.A OE1 no hydrogen 3.065 N/A SER 5.A N VAL 16.A O no hydrogen 2.842 N/A VAL 7.A N THR 14.A O no hydrogen 2.943 N/A ASP 9.A N LEU 12.A O no hydrogen 2.800 N/A GLN 10.A NE2 ASP 9.A OD1 no hydrogen 3.119 N/A LEU 12.A N ASP 9.A O no hydrogen 3.049 N/A ALA 13.A N ALA 48.A O no hydrogen 2.993 N/A THR 14.A N VAL 7.A O no hydrogen 2.755 N/A THR 14.A OG1 TYR 185.A OH no hydrogen 2.630 N/A LEU 15.A N VAL 50.A O no hydrogen 2.846 N/A VAL 16.A N SER 5.A O no hydrogen 2.808 N/A VAL 17.A N PHE 52.A O no hydrogen 2.974 N/A SER 18.A N PHE 3.A O no hydrogen 2.769 N/A ARG 19.A N ASN 23.A OD1 no hydrogen 2.837 N/A ARG 19.A NH1 ALA 24.A O no hydrogen 2.829 N/A ARG 19.A NH1 ASP 63.A OD2 no hydrogen 2.767 N/A ARG 19.A NH2 ASP 63.A OD2 no hydrogen 3.105 N/A ASN 23.A ND2 GLY 53.A O no hydrogen 2.971 N/A ASN 23.A ND2 PHE 58.A O no hydrogen 2.976 N/A MET 25.A N GLY 61.A O no hydrogen 2.810 N/A ARG 27.A N GLU 66.A OE1 no hydrogen 2.874 N/A ARG 27.A NE GLU 66.A OE2 no hydrogen 3.072 N/A ARG 27.A NH2 GLU 66.A OE2 no hydrogen 3.569 N/A GLN 28.A NE2 GLU 2.A OE1 no hydrogen 3.073 N/A GLN 28.A NE2 GLU 32.A OE2 no hydrogen 2.822 N/A VAL 29.A N THR 26.A OG1 no hydrogen 3.249 N/A TYR 30.A N THR 26.A O no hydrogen 3.059 N/A TYR 30.A OH ASP 62.A OD1 no hydrogen 2.531 N/A ARG 31.A N ARG 27.A O no hydrogen 3.108 N/A GLU 32.A N GLN 28.A O no hydrogen 2.968 N/A ILE 33.A N VAL 29.A O no hydrogen 2.848 N/A VAL 34.A N TYR 30.A O no hydrogen 2.949 N/A ALA 35.A N ARG 31.A O no hydrogen 3.073 N/A ALA 36.A N GLU 32.A O no hydrogen 2.967 N/A ALA 37.A N ILE 33.A O no hydrogen 2.910 N/A ASP 38.A N VAL 34.A O no hydrogen 3.026 N/A GLU 39.A N ALA 35.A O no hydrogen 2.987 N/A LEU 40.A N ALA 36.A O no hydrogen 3.024 N/A GLY 41.A N ALA 37.A O no hydrogen 3.161 N/A ARG 42.A N ASP 38.A O no hydrogen 3.166 N/A ARG 42.A N GLU 39.A O no hydrogen 3.167 N/A ARG 42.A NE GLU 39.A OE1 no hydrogen 3.008 N/A ARG 42.A NH2 GLU 39.A OE2 no hydrogen 2.703 N/A ARG 43.A N GLU 39.A O no hydrogen 3.219 N/A ARG 43.A NE ASP 45.A OD2 no hydrogen 2.920 N/A ARG 43.A NH2 ASP 45.A OD1 no hydrogen 2.483 N/A ARG 43.A NH2 ASP 45.A OD2 no hydrogen 3.468 N/A ILE 46.A N ARG 43.A O no hydrogen 3.162 N/A GLY 47.A N GLY 11.A O no hydrogen 2.709 N/A VAL 49.A N PRO 95.A O no hydrogen 3.011 N/A VAL 50.A N ALA 13.A O no hydrogen 2.884 N/A LEU 51.A N VAL 97.A O no hydrogen 2.741 N/A PHE 52.A N LEU 15.A O no hydrogen 2.969 N/A HIS 55.A NE2.A ASP 182.A OD1 no hydrogen 2.962 N/A PHE 58.A N THR 101.A O no hydrogen 2.791 N/A SER 59.A N TYR 103.A O no hydrogen 3.168 N/A SER 59.A OG ASN 23.A O no hydrogen 2.660 N/A ALA 60.A N THR 22.A O no hydrogen 2.972 N/A GLY 61.A N SER 59.A OG no hydrogen 3.044 N/A ASP 63.A N MET 25.A O no hydrogen 2.995 N/A GLU 66.A N ASP 63.A OD1 no hydrogen 2.869 N/A LEU 67.A N ASP 63.A O no hydrogen 3.164 N/A ARG 68.A N MET 64.A O no hydrogen 2.863 N/A ARG 68.A NH2 ALA 133.A O no hydrogen 3.221 N/A THR 69.A N GLU 66.A O no hydrogen 2.903 N/A THR 69.A OG1 GLU 66.A O no hydrogen 2.744 N/A LEU 70.A N LEU 67.A O no hydrogen 3.147 N/A ASN 71.A N GLU 74.A OE1 no hydrogen 2.915 N/A GLU 74.A N ASN 71.A OD1 no hydrogen 2.878 N/A ALA 75.A N ASN 71.A O no hydrogen 2.856 N/A ASP 76.A N ALA 72.A O no hydrogen 2.854 N/A THR 77.A N PRO 73.A O no hydrogen 3.086 N/A THR 77.A OG1 PRO 73.A O no hydrogen 3.404 N/A ALA 78.A N GLU 74.A O no hydrogen 2.801 N/A ALA 79.A N ALA 75.A O no hydrogen 2.808 N/A ARG 80.A N ASP 76.A O no hydrogen 2.985 N/A ARG 80.A NE ASP 76.A OD2 no hydrogen 2.816 N/A ARG 80.A NH2 ASP 76.A OD2 no hydrogen 3.473 N/A VAL 81.A N THR 77.A O no hydrogen 3.045 N/A ARG 82.A N ALA 78.A O no hydrogen 2.984 N/A ARG 82.A NE ASP 62.A OD1 no hydrogen 3.046 N/A ARG 82.A NH1 ASP 62.A OD1 no hydrogen 3.482 N/A LEU 83.A N ALA 79.A O no hydrogen 3.182 N/A GLU 84.A N ARG 80.A O no hydrogen 2.896 N/A ALA 85.A N VAL 81.A O no hydrogen 2.889 N/A ILE 86.A N ARG 82.A O no hydrogen 3.032 N/A ASP 87.A N LEU 83.A O no hydrogen 2.875 N/A ALA 88.A N GLU 84.A O no hydrogen 2.892 N/A VAL 89.A N ALA 85.A O no hydrogen 3.060 N/A ALA 90.A N ILE 86.A O no hydrogen 2.936 N/A ALA 91.A N ASP 87.A O no hydrogen 2.826 N/A ALA 91.A N ALA 88.A O no hydrogen 3.244 N/A ILE 92.A N VAL 89.A O no hydrogen 3.314 N/A LYS 94.A N ILE 92.A O no hydrogen 2.746 N/A LYS 94.A NZ LEU 40.A O no hydrogen 2.627 N/A LYS 94.A NZ GLY 41.A O no hydrogen 3.549 N/A LYS 94.A NZ ARG 43.A O no hydrogen 2.266 N/A LYS 94.A NZ ILE 46.A O no hydrogen 2.975 N/A THR 96.A N ASP 116.A OD2 no hydrogen 2.865 N/A THR 96.A OG1 ASP 116.A OD2 no hydrogen 3.448 N/A VAL 97.A N VAL 49.A O no hydrogen 2.836 N/A ALA 98.A N TRP 117.A O no hydrogen 2.843 N/A ALA 99.A N LEU 51.A O no hydrogen 2.825 N/A VAL 100.A N VAL 119.A O no hydrogen 2.784 N/A THR 101.A OG1 GLY 54.A O no hydrogen 2.679 N/A TYR 103.A N THR 101.A O no hydrogen 2.799 N/A ALA 104.A N LYS 125.A O no hydrogen 3.014 N/A LEU 105.A N SER 59.A O no hydrogen 3.015 N/A GLY 106.A N GLY 127.A O no hydrogen 2.763 N/A GLY 108.A N LEU 105.A O no hydrogen 2.807 N/A LEU 109.A N GLY 106.A O no hydrogen 3.003 N/A THR 110.A N GLY 106.A O no hydrogen 3.228 N/A THR 110.A OG1 GLY 106.A O no hydrogen 3.509 N/A LEU 111.A N ALA 107.A O no hydrogen 2.884 N/A ALA 112.A N GLY 108.A O no hydrogen 3.126 N/A LEU 113.A N LEU 109.A O no hydrogen 2.937 N/A ALA 114.A N THR 110.A O no hydrogen 3.044 N/A ALA 114.A N LEU 111.A O no hydrogen 3.081 N/A ALA 115.A N ALA 112.A O no hydrogen 3.188 N/A ASP 116.A N THR 96.A OG1 no hydrogen 3.005 N/A TRP 117.A N THR 96.A O no hydrogen 3.198 N/A ARG 118.A N ASP 176.A OD2 no hydrogen 2.846 N/A ARG 118.A NE LEU 174.A O no hydrogen 2.953 N/A ARG 118.A NH1 ALA 112.A O no hydrogen 2.913 N/A ARG 118.A NH1 ALA 115.A O no hydrogen 2.745 N/A ARG 118.A NH2 ASP 116.A O no hydrogen 3.453 N/A VAL 119.A N ALA 98.A O no hydrogen 2.857 N/A SER 120.A N ASP 177.A O no hydrogen 2.952 N/A SER 120.A OG GLY 121.A O no hydrogen 2.868 N/A GLY 121.A N VAL 100.A O no hydrogen 2.916 N/A ASP 122.A N VAL 179.A O no hydrogen 2.794 N/A VAL 124.A N GLY 121.A O no hydrogen 3.291 N/A LYS 125.A N GLY 102.A O no hydrogen 3.041 N/A PHE 126.A N PHE 164.A O no hydrogen 2.850 N/A GLY 127.A N ALA 104.A O no hydrogen 3.389 N/A GLU 130.A N GLU 130.A OE1 no hydrogen 2.784 N/A LEU 132.A N THR 129.A O no hydrogen 2.914 N/A ALA 133.A N GLU 130.A O no hydrogen 2.993 N/A GLY 134.A N ILE 131.A O no hydrogen 2.957 N/A LEU 135.A N GLU 130.A O no hydrogen 3.063 N/A GLY 141.A N GLY 138.A O no hydrogen 3.081 N/A ARG 144.A N GLY 140.A O no hydrogen 3.087 N/A ARG 144.A NH2 ASP 87.A OD1 no hydrogen 3.493 N/A LEU 145.A N GLY 141.A O no hydrogen 2.838 N/A THR 146.A N MET 142.A O no hydrogen 2.858 N/A THR 146.A OG1 MET 142.A O no hydrogen 2.713 N/A ARG 147.A N GLY 143.A O no hydrogen 3.106 N/A VAL 148.A N LEU 145.A O no hydrogen 3.105 N/A VAL 149.A N LEU 145.A O no hydrogen 2.997 N/A GLY 150.A N THR 146.A O no hydrogen 2.737 N/A ARG 153.A NH2 GLU 156.A OE1 no hydrogen 2.783 N/A ALA 154.A N GLY 150.A O no hydrogen 2.915 N/A LYS 155.A N SER 151.A O no hydrogen 2.875 N/A GLU 156.A N SER 152.A O no hydrogen 3.132 N/A LEU 157.A N ARG 153.A O no hydrogen 3.045 N/A VAL 158.A N ALA 154.A O no hydrogen 2.886 N/A PHE 159.A N LYS 155.A O no hydrogen 2.780 N/A SER 160.A N GLU 156.A O no hydrogen 3.288 N/A SER 160.A OG GLU 156.A O no hydrogen 2.760 N/A SER 160.A OG LEU 157.A O no hydrogen 3.241 N/A GLY 161.A N LEU 157.A O no hydrogen 2.911 N/A ARG 162.A N SER 160.A OG no hydrogen 3.060 N/A ARG 162.A NE GLU 156.A OE1 no hydrogen 3.460 N/A ARG 162.A NE GLU 156.A OE2 no hydrogen 2.634 N/A ARG 162.A NH1 GLU 168.A OE1 no hydrogen 2.913 N/A ARG 162.A NH1 GLU 168.A OE2 no hydrogen 3.447 N/A ARG 162.A NH2 GLU 156.A OE1 no hydrogen 2.802 N/A ARG 162.A NH2 GLU 156.A OE2 no hydrogen 3.548 N/A ARG 162.A NH2 GLU 168.A OE2 no hydrogen 2.798 N/A PHE 164.A N PHE 126.A O no hydrogen 2.800 N/A GLU 168.A N ASP 165.A OD1 no hydrogen 2.811 N/A ALA 169.A N ASP 165.A O no hydrogen 2.931 N/A LEU 170.A N ALA 166.A O no hydrogen 2.859 N/A ALA 171.A N GLU 167.A O no hydrogen 3.068 N/A LEU 172.A N GLU 168.A O no hydrogen 2.836 N/A GLY 173.A N LEU 170.A O no hydrogen 3.099 N/A LEU 174.A N ALA 169.A O no hydrogen 2.856 N/A ASP 176.A N ARG 118.A O no hydrogen 2.926 N/A ASP 177.A N ARG 118.A O no hydrogen 3.329 N/A MET 178.A N ASP 177.A OD1 no hydrogen 2.966 N/A VAL 179.A N SER 120.A O no hydrogen 2.963 N/A ASP 183.A N ALA 180.A O no hydrogen 2.789 N/A TYR 185.A OH THR 14.A OG1 no hydrogen 2.630 N/A SER 187.A N ASP 183.A O no hydrogen 2.881 N/A SER 187.A OG ASP 183.A O no hydrogen 2.748 N/A ALA 188.A N VAL 184.A O no hydrogen 2.969 N/A VAL 189.A N TYR 185.A O no hydrogen 2.825 N/A ALA 190.A N ASP 186.A O no hydrogen 3.005 N/A TRP 191.A N SER 187.A O no hydrogen 2.970 N/A ALA 192.A N ALA 188.A O no hydrogen 2.960 N/A ARG 193.A N VAL 189.A O no hydrogen 2.880 N/A ARG 193.A NH1 GLN 10.A O no hydrogen 3.186 N/A ARG 193.A NH2 ASP 9.A O no hydrogen 3.081 N/A ARG 194.A N ALA 190.A O no hydrogen 3.239 N/A ARG 194.A N TRP 191.A O no hydrogen 3.227 N/A TYR 195.A N ALA 192.A O no hydrogen 3.181 N/A LEU 196.A N ARG 193.A O no hydrogen 3.186 N/A CYS 198.A N TYR 195.A O no hydrogen 3.081 N/A CYS 198.A SG TYR 195.A O no hydrogen 3.524 N/A LEU 203.A N PRO 199.A O no hydrogen 3.038 N/A ALA 204.A N PRO 200.A O no hydrogen 3.017 N/A ALA 205.A N ARG 201.A O no hydrogen 3.043 N/A ALA 206.A N ALA 202.A O no hydrogen 2.883 N/A LYS 207.A N LEU 203.A O no hydrogen 2.830 N/A LYS 207.A NZ ILE 92.A O no hydrogen 2.781 N/A LYS 207.A NZ LYS 94.A O no hydrogen 2.906 N/A LYS 207.A NZ ASP 116.A OD1 no hydrogen 3.101 N/A LYS 207.A NZ ASP 116.A OD2 no hydrogen 2.623 N/A ALA 208.A N ALA 204.A O no hydrogen 2.996 N/A VAL 209.A N ALA 205.A O no hydrogen 3.036 N/A ILE 210.A N ALA 206.A O no hydrogen 2.941 N/A ASN 211.A N LYS 207.A O no hydrogen 2.934 N/A ASP 212.A N ALA 208.A O no hydrogen 3.038 N/A ASP 212.A N VAL 209.A O no hydrogen 3.099 N/A VAL 213.A N ILE 210.A O no hydrogen 3.132 N/A GLU 215.A N ASP 212.A O no hydrogen 2.992 N/A LEU 216.A N ASP 212.A O no hydrogen 3.073 N/A ARG 221.A N GLU 217.A O no hydrogen 2.922 N/A ARG 221.A NH1 LEU 216.A O no hydrogen 2.754 N/A ALA 222.A N ALA 218.A O no hydrogen 3.090 N/A ALA 223.A N THR 219.A O no hydrogen 3.068 N/A ALA 224.A N GLU 220.A O no hydrogen 2.971 N/A GLU 225.A N ARG 221.A O no hydrogen 2.895 N/A ARG 226.A N ALA 222.A O no hydrogen 3.001 N/A ARG 227.A N ALA 223.A O no hydrogen 2.904 N/A ARG 228.A N ALA 224.A O no hydrogen 3.085 N/A ARG 228.A NH2.B ASP 212.A OD2 no hydrogen 2.647 N/A TYR 229.A N GLU 225.A O no hydrogen 2.882 N/A VAL 230.A N ARG 226.A O no hydrogen 2.879 N/A GLU 231.A N ARG 227.A O no hydrogen 3.005 N/A LEU 232.A N TYR 229.A O no hydrogen 3.092 N/A PHE 233.A N VAL 230.A O no hydrogen 2.818 N/A ALA 234.A N GLU 231.A O no hydrogen 3.032 N/A GLN 237.A N ALA 234.A O no hydrogen 2.762 N/A ARG 238.A NH1 PHE 233.A O no hydrogen 2.786 N/A