Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ei1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N LEU 166.A O no hydrogen 2.817 N/A ILE 4.A N ARG 67.A O no hydrogen 2.761 N/A GLY 7.A N GLY 65.A O no hydrogen 2.778 N/A TYR 8.A N GLY 65.A O no hydrogen 3.179 N/A TYR 8.A OH GLU 116.A OE1 no hydrogen 2.686 N/A MET 9.A N ARG 50.A O no hydrogen 2.961 N/A GLY 10.A N TYR 63.A O no hydrogen 2.862 N/A ILE 11.A N VAL 52.A O no hydrogen 2.887 N/A SER 12.A N ASP 60.A O no hydrogen 2.942 N/A SER 12.A OG GLU 62.A OE2 no hydrogen 2.678 N/A VAL 13.A N HIS 54.A O no hydrogen 2.872 N/A LYS 14.A N ASP 59.A OD1 no hydrogen 3.050 N/A ALA 18.A N ASP 15.A OD1 no hydrogen 3.110 N/A TRP 19.A N ASP 15.A O no hydrogen 3.083 N/A TRP 19.A NE1 SER 252.A OG no hydrogen 2.948 N/A LYS 20.A N PRO 16.A O no hydrogen 2.892 N/A SER 21.A N ASP 17.A O no hydrogen 3.199 N/A SER 21.A OG ASP 17.A O no hydrogen 3.559 N/A PHE 22.A N ALA 18.A O no hydrogen 2.894 N/A ALA 23.A N TRP 19.A O no hydrogen 2.834 N/A THR 24.A N LYS 20.A O no hydrogen 3.091 N/A THR 24.A OG1 LYS 20.A O no hydrogen 2.866 N/A THR 24.A OG1 SER 21.A O no hydrogen 3.273 N/A THR 24.A OG1 ASP 25.A OD1 no hydrogen 3.463 N/A ASP 25.A N SER 21.A O no hydrogen 2.879 N/A MET 26.A N PHE 22.A O no hydrogen 2.930 N/A GLY 28.A N THR 24.A O no hydrogen 2.988 N/A LEU 29.A N ALA 23.A O no hydrogen 2.976 N/A GLN 30.A N ARG 43.A O no hydrogen 3.147 N/A LEU 32.A N TYR 41.A O no hydrogen 2.890 N/A GLY 35.A N ASP 33.A OD1 no hydrogen 2.864 N/A ARG 39.A NE ASP 38.A OD1 no hydrogen 3.011 N/A ARG 39.A NH1 GLU 98.A OE2 no hydrogen 2.782 N/A ARG 39.A NH2 ASP 38.A OD2 no hydrogen 2.895 N/A ARG 39.A NH2 GLU 98.A OE2 no hydrogen 3.436 N/A PHE 40.A N VAL 53.A O no hydrogen 2.991 N/A TYR 41.A N LEU 32.A O no hydrogen 2.867 N/A TYR 41.A OH GLU 36.A OE1 no hydrogen 2.539 N/A LEU 42.A N ILE 51.A O no hydrogen 2.863 N/A ARG 43.A N GLN 30.A O no hydrogen 2.821 N/A ARG 43.A NE TRP 47.A O no hydrogen 3.062 N/A ARG 43.A NE HIS 48.A O no hydrogen 3.114 N/A ARG 43.A NH1 GLN 30.A OE1 no hydrogen 3.118 N/A ARG 43.A NH1 ASN 127.A O no hydrogen 2.946 N/A ARG 43.A NH1 PRO 128.A O no hydrogen 3.563 N/A ARG 43.A NH2 TYR 46.A O no hydrogen 3.093 N/A ARG 43.A NH2 TRP 47.A O no hydrogen 3.127 N/A ARG 43.A NH2 ASN 127.A O no hydrogen 2.869 N/A TRP 47.A N ASP 45.A OD1 no hydrogen 2.977 N/A HIS 48.A N ARG 122.A O no hydrogen 3.015 N/A HIS 48.A ND1 HIS 49.A ND1 no hydrogen 2.790 N/A HIS 48.A NE2 GLU 34.A OE2 no hydrogen 2.722 N/A HIS 49.A ND1 HIS 48.A ND1 no hydrogen 2.790 N/A ARG 50.A N LEU 42.A O no hydrogen 2.947 N/A ARG 50.A NE ASP 45.A OD1 no hydrogen 3.440 N/A ARG 50.A NE ASP 45.A OD2 no hydrogen 3.062 N/A ARG 50.A NH1 GLU 5.A OE2 no hydrogen 2.952 N/A ARG 50.A NH1 GLY 7.A O no hydrogen 2.981 N/A ARG 50.A NH2 ASP 45.A OD2 no hydrogen 2.888 N/A ILE 51.A N LEU 42.A O no hydrogen 3.174 N/A VAL 52.A N MET 9.A O no hydrogen 2.833 N/A VAL 53.A N PHE 40.A O no hydrogen 2.829 N/A HIS 54.A N ILE 11.A O no hydrogen 2.822 N/A HIS 54.A NE2 TYR 63.A OH no hydrogen 2.715 N/A HIS 55.A N ASP 38.A O no hydrogen 2.893 N/A GLN 58.A N SER 12.A OG no hydrogen 3.002 N/A GLN 58.A NE2 SER 12.A OG no hydrogen 3.062 N/A ASP 60.A N SER 12.A O no hydrogen 3.196 N/A LEU 61.A N ASP 60.A OD1 no hydrogen 2.751 N/A GLU 62.A N GLY 10.A O no hydrogen 2.733 N/A TYR 63.A N GLY 10.A O no hydrogen 3.214 N/A TYR 63.A OH HIS 54.A NE2 no hydrogen 2.715 N/A LEU 64.A N PRO 114.A O no hydrogen 3.126 N/A GLY 65.A N TYR 8.A O no hydrogen 2.775 N/A TRP 66.A N GLU 116.A O no hydrogen 2.807 N/A ARG 67.A N GLU 5.A O no hydrogen 2.935 N/A ARG 67.A NH1 GLU 5.A OE1 no hydrogen 2.906 N/A VAL 68.A N PHE 118.A O no hydrogen 2.857 N/A PHE 74.A N GLY 70.A O no hydrogen 2.985 N/A GLU 75.A N LYS 71.A O no hydrogen 2.894 N/A ALA 76.A N PRO 72.A O no hydrogen 3.014 N/A LEU 77.A N GLU 73.A O no hydrogen 2.931 N/A GLY 78.A N PHE 74.A O no hydrogen 3.008 N/A GLN 79.A N GLU 75.A O no hydrogen 3.149 N/A GLN 79.A NE2 GLN 79.A O no hydrogen 3.560 N/A GLN 79.A NE2 ASP 83.A OD2 no hydrogen 2.953 N/A LYS 80.A N ALA 76.A O no hydrogen 2.950 N/A LYS 80.A NZ LEU 165.A O no hydrogen 3.002 N/A LEU 81.A N LEU 77.A O no hydrogen 2.960 N/A ILE 82.A N GLY 78.A O no hydrogen 3.056 N/A ASP 83.A N GLN 79.A O no hydrogen 2.838 N/A ALA 84.A N LYS 80.A O no hydrogen 3.072 N/A GLY 85.A N ILE 82.A O no hydrogen 3.007 N/A TYR 86.A N LEU 81.A O no hydrogen 2.939 N/A LYS 87.A NZ GLY 85.A O no hydrogen 3.036 N/A ARG 89.A N LYS 106.A O no hydrogen 2.960 N/A ARG 89.A NH1 GLU 95.A OE1 no hydrogen 2.696 N/A ARG 89.A NH2 GLU 95.A OE1 no hydrogen 3.499 N/A ARG 89.A NH2 GLU 95.A OE2 no hydrogen 2.791 N/A CYS 91.A N LEU 104.A O no hydrogen 2.906 N/A CYS 91.A SG ARG 89.A O no hydrogen 4.031 N/A CYS 91.A SG GLU 95.A OE1 no hydrogen 3.840 N/A CYS 91.A SG GLU 95.A OE2 no hydrogen 3.836 N/A GLU 95.A N ASP 92.A OD1 no hydrogen 3.136 N/A ALA 96.A N ASP 92.A O no hydrogen 3.032 N/A GLN 97.A N LYS 93.A O no hydrogen 2.839 N/A GLU 98.A N VAL 94.A O no hydrogen 2.979 N/A ARG 99.A N GLU 95.A O no hydrogen 3.455 N/A ARG 99.A NE GLU 116.A OE1 no hydrogen 2.827 N/A ARG 99.A NE GLU 116.A OE2 no hydrogen 3.293 N/A ARG 99.A NH2 GLU 116.A OE2 no hydrogen 2.776 N/A MET 100.A N GLN 97.A O no hydrogen 3.014 N/A VAL 101.A N ALA 96.A O no hydrogen 3.096 N/A LEU 102.A N TRP 119.A O no hydrogen 3.085 N/A LEU 102.A N GLY 120.A O no hydrogen 3.079 N/A GLY 103.A N TRP 119.A O no hydrogen 3.247 N/A MET 105.A N ILE 117.A O no hydrogen 2.866 N/A LYS 106.A N ARG 89.A O no hydrogen 2.858 N/A LYS 106.A NZ GLU 95.A OE2 no hydrogen 2.796 N/A THR 107.A N THR 115.A O no hydrogen 2.813 N/A THR 107.A OG1 LYS 87.A O no hydrogen 2.687 N/A GLU 108.A N THR 107.A OG1 no hydrogen 2.749 N/A ASP 109.A N ASN 113.A O no hydrogen 3.002 N/A GLY 111.A N ASP 109.A OD1 no hydrogen 2.960 N/A GLY 112.A N ASP 109.A O no hydrogen 2.927 N/A ASN 113.A N ASP 109.A OD1 no hydrogen 2.944 N/A ASN 113.A ND2 ASP 109.A OD2 no hydrogen 3.096 N/A ASN 113.A ND2 ARG 152.A O no hydrogen 2.896 N/A THR 115.A N THR 107.A O no hydrogen 2.935 N/A THR 115.A OG1 ASN 113.A O no hydrogen 2.830 N/A GLU 116.A N LEU 64.A O no hydrogen 2.785 N/A ILE 117.A N MET 105.A O no hydrogen 3.015 N/A PHE 118.A N TRP 66.A O no hydrogen 2.979 N/A TRP 119.A N GLY 103.A O no hydrogen 3.089 N/A ARG 122.A NE ASP 124.A OD1 no hydrogen 2.863 N/A ARG 122.A NH2 ASP 124.A OD1 no hydrogen 3.426 N/A ARG 122.A NH2 ASP 124.A OD2 no hydrogen 3.344 N/A ASP 124.A N TYR 46.A O no hydrogen 2.803 N/A ASN 127.A N ASP 124.A O no hydrogen 2.917 N/A HIS 130.A N GLN 30.A OE1 no hydrogen 2.994 N/A GLY 132.A N GLY 28.A O no hydrogen 3.182 N/A ARG 133.A NH1 ASP 25.A O no hydrogen 3.176 N/A ARG 133.A NH1 MET 26.A O no hydrogen 2.978 N/A ARG 133.A NH1 THR 220.A OG1 no hydrogen 3.132 N/A ARG 133.A NH2 ASP 216.A O no hydrogen 3.387 N/A ARG 133.A NH2 THR 220.A OG1 no hydrogen 2.837 N/A HIS 136.A N ASP 216.A OD1 no hydrogen 2.810 N/A GLY 137.A N ASP 216.A OD2 no hydrogen 2.773 N/A LYS 138.A N THR 212.A OG1 no hydrogen 2.963 N/A VAL 140.A N GLU 210.A O no hydrogen 2.815 N/A THR 141.A OG1 ASP 45.A OD2 no hydrogen 2.621 N/A GLN 144.A N THR 141.A O no hydrogen 2.979 N/A GLY 145.A N GLY 142.A O no hydrogen 3.061 N/A LEU 146.A N LEU 6.A O no hydrogen 2.973 N/A HIS 148.A N MET 208.A O no hydrogen 3.302 N/A CYS 149.A N SER 192.A O no hydrogen 3.232 N/A ILE 150.A N HIS 206.A O no hydrogen 3.173 N/A VAL 151.A N ALA 194.A O no hydrogen 3.257 N/A ARG 152.A N ARG 203.A O no hydrogen 2.832 N/A ARG 152.A NH1 ALA 200.A O no hydrogen 2.786 N/A GLN 153.A NE2 ASP 109.A OD2 no hydrogen 2.841 N/A GLU 158.A N ASP 155.A OD2 no hydrogen 3.109 N/A ALA 159.A N ASP 155.A O no hydrogen 2.950 N/A HIS 160.A N VAL 156.A O no hydrogen 2.841 N/A HIS 160.A NE2 GLY 170.A O no hydrogen 2.678 N/A LYS 161.A N ALA 157.A O no hydrogen 3.002 N/A LYS 161.A NZ TYR 86.A OH no hydrogen 2.907 N/A PHE 162.A N GLU 158.A O no hydrogen 3.038 N/A TYR 163.A N ALA 159.A O no hydrogen 2.953 N/A TYR 163.A OH ASP 109.A OD2 no hydrogen 2.655 N/A SER 164.A N HIS 160.A O no hydrogen 2.837 N/A SER 164.A OG HIS 160.A O no hydrogen 2.717 N/A LEU 165.A N LYS 161.A O no hydrogen 3.022 N/A LEU 166.A N PHE 162.A O no hydrogen 3.157 N/A GLY 167.A N SER 164.A O no hydrogen 2.978 N/A PHE 168.A N TYR 163.A O no hydrogen 3.004 N/A ARG 169.A N HIS 185.A O no hydrogen 2.972 N/A ARG 169.A NE ASP 267.A O no hydrogen 3.250 N/A ARG 169.A NH2 ASP 267.A O no hydrogen 3.333 N/A VAL 172.A N ASP 171.A OD1 no hydrogen 2.761 N/A GLU 173.A N LEU 181.A O no hydrogen 2.882 N/A TYR 174.A N LEU 181.A O no hydrogen 3.369 N/A TYR 174.A OH ASN 240.A OD1 no hydrogen 3.390 N/A TYR 174.A OH ASP 275.A OD1 no hydrogen 2.713 N/A ARG 175.A N TYR 272.A O no hydrogen 2.995 N/A ARG 175.A NE GLU 180.A OE2 no hydrogen 2.681 N/A ARG 175.A NH2 GLU 180.A OE2 no hydrogen 3.365 N/A ILE 176.A N ALA 179.A O no hydrogen 2.824 N/A ALA 179.A N ILE 176.A O no hydrogen 2.852 N/A LEU 181.A N TYR 174.A O no hydrogen 3.074 N/A SER 182.A N PHE 195.A O no hydrogen 2.849 N/A PHE 183.A N ASP 171.A O no hydrogen 3.098 N/A MET 184.A N ILE 193.A O no hydrogen 2.852 N/A HIS 185.A N ARG 169.A O no hydrogen 2.844 N/A HIS 185.A NE2 ASP 267.A OD1 no hydrogen 2.778 N/A ASN 187.A ND2 ILE 4.A O no hydrogen 2.819 N/A ARG 189.A N ASN 187.A OD1 no hydrogen 2.864 N/A ARG 189.A NE GLN 144.A O no hydrogen 2.803 N/A ARG 189.A NH1 GLU 210.A OE1 no hydrogen 2.991 N/A ARG 189.A NH2 VAL 140.A O no hydrogen 2.900 N/A ARG 189.A NH2 GLN 144.A O no hydrogen 3.523 N/A ARG 189.A NH2 GLY 145.A O no hydrogen 2.986 N/A HIS 191.A ND1 ASP 190.A OD2 no hydrogen 3.023 N/A SER 192.A N MET 184.A O no hydrogen 2.897 N/A ILE 193.A N MET 184.A O no hydrogen 3.314 N/A ALA 194.A N CYS 149.A O no hydrogen 2.997 N/A PHE 195.A N SER 182.A O no hydrogen 2.952 N/A LYS 202.A NZ ASP 59.A O no hydrogen 2.885 N/A LYS 202.A NZ SER 252.A O no hydrogen 3.210 N/A ARG 203.A N ASP 60.A OD2 no hydrogen 2.769 N/A ARG 203.A NH1 LEU 61.A O no hydrogen 2.969 N/A LEU 204.A N ASP 60.A OD1 no hydrogen 3.095 N/A ASN 205.A N ILE 150.A O no hydrogen 2.943 N/A ASN 205.A ND2 GLY 287.A O no hydrogen 3.523 N/A HIS 206.A ND1 ASN 205.A OD1 no hydrogen 2.840 N/A LEU 207.A N LEU 255.A O no hydrogen 3.091 N/A MET 208.A N HIS 148.A O no hydrogen 2.826 N/A LEU 209.A N GLU 257.A O no hydrogen 3.201 N/A TYR 211.A N GLY 259.A O no hydrogen 2.851 N/A TYR 211.A OH LEU 27.A O no hydrogen 2.657 N/A THR 212.A N LYS 138.A O no hydrogen 2.944 N/A THR 212.A OG1 LYS 138.A O no hydrogen 3.315 N/A THR 212.A OG1 HIS 213.A ND1 no hydrogen 2.744 N/A HIS 213.A ND1 THR 212.A OG1 no hydrogen 2.744 N/A GLU 215.A N GLU 215.A OE2 no hydrogen 2.825 N/A ASP 216.A N HIS 213.A O no hydrogen 3.069 N/A LEU 217.A N HIS 213.A O no hydrogen 3.366 N/A GLY 218.A N MET 214.A O no hydrogen 2.911 N/A TYR 219.A N GLU 215.A O no hydrogen 2.986 N/A THR 220.A N ASP 216.A O no hydrogen 2.864 N/A THR 220.A OG1 MET 26.A O no hydrogen 3.283 N/A THR 220.A OG1 TYR 211.A OH no hydrogen 2.731 N/A THR 220.A OG1 ASP 216.A O no hydrogen 3.174 N/A HIS 221.A N LEU 217.A O no hydrogen 2.907 N/A GLN 222.A N GLY 218.A O no hydrogen 2.939 N/A GLN 223.A N TYR 219.A O no hydrogen 2.893 N/A GLN 223.A NE2 ASP 25.A O no hydrogen 2.996 N/A PHE 224.A N THR 220.A O no hydrogen 3.086 N/A VAL 225.A N HIS 221.A O no hydrogen 3.048 N/A LYS 226.A N GLN 222.A O no hydrogen 2.798 N/A ASN 227.A N GLN 223.A O no hydrogen 3.033 N/A ASN 227.A ND2 GLN 223.A O no hydrogen 2.940 N/A GLU 228.A N VAL 225.A O no hydrogen 3.127 N/A ILE 229.A N PHE 224.A O no hydrogen 2.965 N/A ALA 232.A N TYR 247.A O no hydrogen 2.802 N/A LEU 233.A N TYR 247.A O no hydrogen 3.503 N/A GLN 234.A N GLY 280.A O no hydrogen 2.895 N/A GLN 234.A NE2 GLU 282.A OE1 no hydrogen 2.828 N/A GLY 236.A N THR 245.A O no hydrogen 2.981 N/A ILE 237.A N PHE 277.A O no hydrogen 2.989 N/A HIS 238.A N ALA 243.A O no hydrogen 3.252 N/A HIS 238.A ND1 ASP 275.A OD2 no hydrogen 2.822 N/A HIS 238.A NE2 GLU 257.A OE2 no hydrogen 2.667 N/A ALA 239.A N ASP 275.A OD1 no hydrogen 2.860 N/A ASN 240.A N TYR 174.A OH no hydrogen 3.126 N/A ASN 240.A ND2 GLU 173.A OE1 no hydrogen 3.040 N/A ASP 241.A N ASN 240.A OD1 no hydrogen 2.753 N/A LYS 242.A N HIS 238.A O no hydrogen 2.917 N/A LYS 242.A NZ ALA 239.A O no hydrogen 2.859 N/A LYS 242.A NZ ASN 240.A O no hydrogen 2.971 N/A ALA 243.A N ASP 241.A OD1 no hydrogen 2.941 N/A LEU 244.A N TRP 260.A O no hydrogen 2.881 N/A THR 245.A N GLY 236.A O no hydrogen 2.930 N/A THR 245.A OG1 GLU 257.A OE2 no hydrogen 2.813 N/A THR 245.A OG1 HIS 279.A NE2 no hydrogen 2.828 N/A PHE 246.A N PRO 258.A O no hydrogen 3.287 N/A TYR 247.A N LEU 233.A O no hydrogen 2.978 N/A GLY 248.A N ILE 256.A O no hydrogen 2.883 N/A ALA 249.A N ASP 230.A O no hydrogen 2.898 N/A THR 250.A N TRP 254.A O no hydrogen 3.057 N/A THR 250.A OG1 TRP 254.A O no hydrogen 2.885 N/A SER 252.A N THR 250.A OG1 no hydrogen 3.144 N/A SER 252.A OG ASP 59.A OD1 no hydrogen 2.685 N/A GLY 253.A N THR 250.A O no hydrogen 2.966 N/A LEU 255.A N ASN 205.A O no hydrogen 3.154 N/A ILE 256.A N GLY 248.A O no hydrogen 2.857 N/A GLU 257.A N LEU 207.A O no hydrogen 2.743 N/A GLY 259.A N LEU 209.A O no hydrogen 2.957 N/A TRP 260.A N LEU 244.A O no hydrogen 2.883 N/A TRP 260.A NE1 THR 212.A O no hydrogen 2.950 N/A ARG 261.A NE LYS 242.A O no hydrogen 3.332 N/A ARG 261.A NE ARG 261.A O no hydrogen 3.446 N/A ARG 261.A NH2 LYS 242.A O no hydrogen 2.738 N/A GLY 262.A N GLU 210.A OE2 no hydrogen 3.043 N/A ALA 263.A N ASP 241.A O no hydrogen 2.703 N/A ALA 265.A N ALA 188.A O no hydrogen 2.831 N/A TYR 272.A N GLU 173.A O no hydrogen 2.817 N/A TYR 272.A OH GLU 270.A OE1 no hydrogen 2.499 N/A ASP 275.A N LEU 292.A O no hydrogen 2.790 N/A ILE 276.A N ILE 237.A O no hydrogen 2.976 N/A HIS 279.A N LEU 235.A O no hydrogen 3.038 N/A HIS 279.A ND1 ASP 275.A OD2 no hydrogen 2.874 N/A HIS 279.A NE2 THR 245.A OG1 no hydrogen 2.828 N/A GLU 282.A N ALA 232.A O no hydrogen 2.934 N/A ALA 283.A N ILE 231.A O no hydrogen 2.947 N/A TYR 286.A OH ASP 230.A OD2 no hydrogen 2.678 N/A SER 293.A OG GLY 278.A O no hydrogen 2.892 N/A