Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2he7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 3.A N VAL 19.A O no hydrogen 2.766 N/A CYS 5.A N CYS 17.A O no hydrogen 2.765 N/A LYS 6.A N TRP 73.A O no hydrogen 2.944 N/A LYS 6.A NZ GLU 14.A OE1 no hydrogen 3.433 N/A LYS 6.A NZ THR 16.A OG1 no hydrogen 2.903 N/A VAL 7.A N TYR 15.A O no hydrogen 2.782 N/A ILE 8.A N PHE 75.A O no hydrogen 2.760 N/A LEU 9.A N SER 13.A O no hydrogen 2.767 N/A GLY 12.A N LEU 9.A O no hydrogen 2.892 N/A SER 13.A N ASP 11.A OD1 no hydrogen 2.969 N/A SER 13.A OG ASP 11.A OD1 no hydrogen 2.532 N/A TYR 15.A N VAL 7.A O no hydrogen 2.850 N/A CYS 17.A N CYS 5.A O no hydrogen 3.098 N/A VAL 19.A N MET 3.A O no hydrogen 2.917 N/A LYS 21.A N.A LYS 1.A O no hydrogen 3.244 N/A LYS 21.A N.B LYS 1.A O no hydrogen 3.267 N/A ARG 22.A N.A GLU 20.A OE1 no hydrogen 3.096 N/A ARG 22.A N.B GLU 20.A OE1 no hydrogen 3.141 N/A ARG 22.A NE.A GLU 20.A OE1 no hydrogen 3.061 N/A ARG 22.A NH2.A GLU 20.A OE1 no hydrogen 3.442 N/A SER 23.A N GLU 20.A O no hydrogen 2.922 N/A SER 23.A OG GLU 20.A O no hydrogen 2.707 N/A GLY 25.A N LYS 62.A O no hydrogen 3.040 N/A GLN 26.A N PRO 60.A O no hydrogen 3.000 N/A GLN 26.A NE2 ASP 30.A OD1 no hydrogen 2.890 N/A VAL 27.A N ARG 24.A O no hydrogen 3.149 N/A PHE 29.A N GLY 25.A O no hydrogen 2.975 N/A ASP 30.A N GLN 26.A O no hydrogen 2.833 N/A LYS 31.A N VAL 27.A O no hydrogen 3.185 N/A VAL 32.A N LEU 28.A O no hydrogen 2.988 N/A CYS 33.A N PHE 29.A O no hydrogen 2.964 N/A CYS 33.A SG PHE 29.A O no hydrogen 3.381 N/A GLU 34.A N ASP 30.A O no hydrogen 3.053 N/A HIS 35.A N LYS 31.A O no hydrogen 2.931 N/A LEU 36.A N VAL 32.A O no hydrogen 3.080 N/A ASN 37.A N GLU 34.A O no hydrogen 3.139 N/A LEU 38.A N CYS 33.A O no hydrogen 2.863 N/A LYS 41.A N LEU 39.A O no hydrogen 2.897 N/A LYS 41.A NZ ASP 30.A OD1 no hydrogen 2.534 N/A PHE 44.A N LYS 41.A O no hydrogen 3.462 N/A GLY 45.A N ASN 78.A O no hydrogen 2.925 N/A THR 47.A N SER 76.A O no hydrogen 2.955 N/A TYR 48.A N ASN 56.A O no hydrogen 2.995 N/A TYR 48.A OH GLN 67.A O no hydrogen 3.424 N/A ARG 49.A NH1 ASN 53.A O no hydrogen 2.798 N/A ASP 50.A N GLN 54.A O no hydrogen 3.001 N/A GLU 52.A N.B ASP 50.A OD1 no hydrogen 2.946 N/A GLU 52.A N.C ASP 50.A OD1 no hydrogen 2.911 N/A ASN 53.A N ASP 50.A O no hydrogen 2.959 N/A GLN 54.A N ASP 50.A OD1 no hydrogen 2.955 N/A GLN 54.A NE2 GLU 52.A O.A no hydrogen 2.850 N/A GLN 54.A NE2 GLU 52.A O.B no hydrogen 2.731 N/A GLN 54.A NE2 GLU 52.A O.C no hydrogen 3.143 N/A ASN 56.A N TYR 48.A O no hydrogen 2.850 N/A ASN 56.A ND2 ASP 50.A OD2 no hydrogen 3.126 N/A ASN 56.A ND2 GLN 54.A O no hydrogen 2.917 N/A LEU 58.A N LEU 46.A O no hydrogen 2.736 N/A ASP 59.A N GLN 67.A OE1 no hydrogen 2.871 N/A ALA 61.A N ASP 59.A OD1 no hydrogen 2.956 N/A LYS 62.A N ASP 59.A O no hydrogen 3.367 N/A ILE 64.A N SER 23.A O no hydrogen 2.984 N/A LYS 66.A N GLU 63.A O no hydrogen 3.252 N/A GLN 67.A N ILE 64.A O no hydrogen 2.809 N/A GLN 67.A NE2 ASP 59.A O no hydrogen 2.932 N/A GLN 67.A NE2 LYS 62.A O no hydrogen 3.128 N/A GLN 67.A NE2 GLU 63.A O no hydrogen 3.288 N/A VAL 68.A N ILE 64.A O no hydrogen 2.777 N/A ARG 69.A NE.B LYS 66.A O no hydrogen 3.088 N/A ALA 72.A N SER 70.A OG no hydrogen 2.982 N/A HIS 74.A N.A ALA 72.A O no hydrogen 2.955 N/A HIS 74.A N.B ALA 72.A O no hydrogen 2.915 N/A PHE 75.A N LYS 6.A O no hydrogen 2.816 N/A SER 76.A N THR 47.A O no hydrogen 2.933 N/A SER 76.A OG ASN 78.A OD1 no hydrogen 2.976 N/A PHE 77.A N ILE 8.A O no hydrogen 2.872 N/A ASN 78.A N GLY 45.A O no hydrogen 3.015 N/A ASN 78.A ND2 GLN 101.A OE1 no hydrogen 3.023 N/A VAL 79.A N GLN 101.A OE1 no hydrogen 2.912 N/A LYS 80.A N.A TYR 43.A O no hydrogen 2.750 N/A LYS 80.A N.B TYR 43.A O no hydrogen 2.754 N/A LYS 80.A NZ.A GLU 275.A OE1 no hydrogen 2.851 N/A LYS 80.A NZ.B GLU 275.A OE1 no hydrogen 2.588 N/A PHE 81.A N TYR 43.A O no hydrogen 2.931 N/A TYR 82.A OH ASP 105.A OD2 no hydrogen 2.715 N/A ALA 87.A N ASP 85.A OD1 no hydrogen 3.282 N/A GLN 88.A N ASP 85.A O no hydrogen 3.128 N/A GLN 88.A NE2 ASP 85.A OD2 no hydrogen 2.828 N/A LEU 89.A N PRO 86.A O no hydrogen 3.080 N/A SER 90.A N GLU 40.A OE2 no hydrogen 2.919 N/A SER 90.A OG GLU 40.A OE2 no hydrogen 3.541 N/A GLU 91.A N GLU 40.A OE1 no hydrogen 2.964 N/A THR 94.A OG1 GLU 40.A OE1 no hydrogen 2.668 N/A ARG 95.A NH1 PRO 86.A O no hydrogen 3.028 N/A ARG 95.A NH1 LEU 89.A O no hydrogen 2.868 N/A ARG 95.A NH2 ASP 92.A OD1 no hydrogen 2.863 N/A TYR 96.A N ASP 92.A O no hydrogen 2.877 N/A TYR 96.A OH GLU 129.A OE2 no hydrogen 2.923 N/A TYR 97.A N ILE 93.A O no hydrogen 2.938 N/A TYR 97.A OH LEU 36.A O no hydrogen 2.522 N/A LEU 98.A N THR 94.A O no hydrogen 3.044 N/A CYS 99.A N ARG 95.A O no hydrogen 2.944 N/A CYS 99.A SG ARG 95.A O no hydrogen 3.328 N/A CYS 99.A SG GLU 176.A O no hydrogen 3.981 N/A LEU 100.A N TYR 96.A O no hydrogen 2.955 N/A GLN 101.A N TYR 97.A O no hydrogen 3.033 N/A GLN 101.A NE2 GLN 101.A O no hydrogen 3.272 N/A GLN 101.A NE2 ASP 105.A OD1 no hydrogen 3.127 N/A LEU 102.A N LEU 98.A O no hydrogen 2.998 N/A ARG 103.A N CYS 99.A O no hydrogen 2.880 N/A ARG 103.A NH1 GLU 129.A OE2 no hydrogen 3.295 N/A ARG 103.A NH2 GLU 129.A OE2 no hydrogen 3.083 N/A ASP 104.A N LEU 100.A O no hydrogen 3.256 N/A ASP 105.A N GLN 101.A O no hydrogen 2.784 N/A ILE 106.A N LEU 102.A O no hydrogen 2.890 N/A VAL 107.A N ARG 103.A O no hydrogen 2.926 N/A SER 108.A N ASP 104.A O no hydrogen 2.946 N/A SER 108.A OG ASP 104.A O no hydrogen 2.872 N/A SER 108.A OG ASP 105.A O no hydrogen 3.232 N/A GLY 109.A N ILE 106.A O no hydrogen 2.956 N/A ARG 110.A N SER 108.A OG no hydrogen 3.394 N/A ARG 110.A NE ASP 105.A OD1 no hydrogen 3.408 N/A ARG 110.A NH2 ASP 104.A OD2 no hydrogen 2.876 N/A ARG 110.A NH2 ASP 105.A OD1 no hydrogen 2.791 N/A LEU 111.A N ASP 105.A O no hydrogen 2.851 N/A SER 114.A OG THR 117.A OG1 no hydrogen 3.227 N/A THR 117.A N SER 114.A OG no hydrogen 3.215 N/A THR 117.A OG1 SER 114.A OG no hydrogen 3.227 N/A LEU 118.A N SER 114.A O no hydrogen 2.934 N/A ALA 119.A N PHE 115.A O no hydrogen 3.000 N/A LEU 120.A N VAL 116.A O no hydrogen 3.070 N/A LEU 121.A N THR 117.A O no hydrogen 2.768 N/A GLY 122.A N LEU 118.A O no hydrogen 2.973 N/A SER 123.A N ALA 119.A O no hydrogen 3.040 N/A SER 123.A OG LEU 120.A O no hydrogen 2.857 N/A SER 123.A OG HIS 167.A NE2 no hydrogen 2.587 N/A TYR 124.A N LEU 120.A O no hydrogen 3.263 N/A THR 125.A N LEU 121.A O no hydrogen 3.113 N/A THR 125.A OG1 LEU 121.A O no hydrogen 3.338 N/A VAL 126.A N GLY 122.A O no hydrogen 2.820 N/A GLN 127.A N SER 123.A O no hydrogen 2.969 N/A GLN 127.A NE2 ASP 132.A OD1 no hydrogen 2.977 N/A GLN 127.A NE2 MET 170.A O no hydrogen 3.024 N/A SER 128.A N TYR 124.A O no hydrogen 2.873 N/A SER 128.A OG GLU 176.A OE2 no hydrogen 2.593 N/A GLU 129.A N THR 125.A O no hydrogen 2.869 N/A LEU 130.A N VAL 126.A O no hydrogen 2.814 N/A GLY 131.A N GLN 127.A O no hydrogen 2.968 N/A ASP 136.A N ASP 134.A OD1 no hydrogen 2.939 N/A GLU 137.A N ASP 134.A O no hydrogen 2.966 N/A CYS 138.A N ASP 134.A O no hydrogen 2.600 N/A TYR 142.A N GLY 139.A O no hydrogen 3.048 N/A TYR 142.A OH HIS 164.A ND1 no hydrogen 2.795 N/A SER 144.A N ASP 141.A O no hydrogen 3.189 N/A SER 144.A OG ASP 141.A O no hydrogen 3.027 N/A SER 144.A OG GLU 157.A OE2 no hydrogen 3.466 N/A PHE 148.A N HIS 152.A NE2 no hydrogen 3.028 N/A LEU 156.A N THR 153.A OG1 no hydrogen 3.222 N/A GLU 157.A N THR 153.A O no hydrogen 3.289 N/A ASP 158.A N LYS 154.A O no hydrogen 2.792 N/A LYS 159.A N GLU 155.A O no hydrogen 3.169 N/A VAL 160.A N LEU 156.A O no hydrogen 3.024 N/A ILE 161.A N GLU 157.A O no hydrogen 3.319 N/A GLU 162.A N ASP 158.A O no hydrogen 3.144 N/A LEU 163.A N LYS 159.A O no hydrogen 2.843 N/A HIS 164.A N VAL 160.A O no hydrogen 2.759 N/A HIS 164.A ND1 TYR 142.A OH no hydrogen 2.795 N/A HIS 164.A NE2 GLY 131.A O no hydrogen 2.743 N/A LYS 165.A N ILE 161.A O no hydrogen 3.066 N/A SER 166.A OG LEU 163.A O no hydrogen 2.438 N/A HIS 167.A N HIS 164.A O no hydrogen 2.989 N/A HIS 167.A NE2 SER 123.A OG no hydrogen 2.587 N/A GLY 169.A N ASP 132.A OD1 no hydrogen 2.794 N/A MET 170.A N HIS 167.A O no hydrogen 2.879 N/A GLU 174.A N THR 171.A OG1 no hydrogen 3.383 N/A ALA 175.A N THR 171.A O no hydrogen 3.015 N/A GLU 176.A N PRO 172.A O no hydrogen 2.832 N/A MET 177.A N ALA 173.A O no hydrogen 2.943 N/A HIS 178.A N GLU 174.A O no hydrogen 3.058 N/A HIS 178.A NE2 GLU 174.A OE2 no hydrogen 2.967 N/A PHE 179.A N ALA 175.A O no hydrogen 2.982 N/A LEU 180.A N GLU 176.A O no hydrogen 3.005 N/A GLU 181.A N MET 177.A O no hydrogen 2.917 N/A ASN 182.A N HIS 178.A O no hydrogen 3.136 N/A ASN 182.A ND2 HIS 178.A O no hydrogen 2.798 N/A ALA 183.A N PHE 179.A O no hydrogen 2.858 N/A LYS 184.A N LEU 180.A O no hydrogen 2.920 N/A LYS 184.A NZ GLU 181.A OE2 no hydrogen 3.559 N/A LYS 185.A N ASN 182.A O no hydrogen 3.422 N/A LYS 185.A NZ GLU 181.A O no hydrogen 3.422 N/A LEU 186.A N ALA 183.A O no hydrogen 2.993 N/A TYR 189.A N LEU 186.A O no hydrogen 3.181 N/A TYR 189.A OH PRO 83.A O no hydrogen 2.689 N/A VAL 191.A N MET 188.A O no hydrogen 3.123 N/A ASP 192.A N VAL 208.A O no hydrogen 2.991 N/A HIS 194.A N LEU 206.A O no hydrogen 2.777 N/A HIS 194.A NE2 ASP 192.A OD2 no hydrogen 2.934 N/A ALA 196.A N ILE 204.A O no hydrogen 3.082 N/A LYS 197.A N LYS 259.A O no hydrogen 2.765 N/A ASP 198.A N VAL 202.A O no hydrogen 3.065 N/A SER 199.A OG GLU 200.A OE2.B no hydrogen 2.875 N/A GLU 200.A N.A ASP 198.A OD1 no hydrogen 2.674 N/A GLU 200.A N.B ASP 198.A OD1 no hydrogen 2.640 N/A GLY 201.A N ASP 198.A O no hydrogen 3.177 N/A VAL 202.A N ASP 198.A OD1 no hydrogen 3.075 N/A ILE 204.A N ALA 196.A O no hydrogen 2.960 N/A MET 205.A N TYR 216.A O no hydrogen 3.029 N/A LEU 206.A N HIS 194.A O no hydrogen 2.866 N/A GLY 207.A N LEU 214.A O no hydrogen 2.873 N/A VAL 208.A N ASP 192.A O no hydrogen 2.947 N/A CYS 209.A N GLY 212.A O no hydrogen 3.148 N/A CYS 209.A SG SER 211.A OG no hydrogen 3.242 N/A CYS 209.A SG GLY 212.A O no hydrogen 3.711 N/A LEU 213.A N PHE 225.A O no hydrogen 2.901 N/A LEU 214.A N GLY 207.A O no hydrogen 2.751 N/A ILE 215.A N ASN 223.A O no hydrogen 3.064 N/A TYR 216.A N MET 205.A O no hydrogen 2.881 N/A ARG 217.A N LEU 220.A O no hydrogen 2.883 N/A LEU 220.A N ARG 217.A O no hydrogen 3.068 N/A ILE 222.A N ILE 215.A O no hydrogen 2.730 N/A ASN 223.A N ILE 215.A O no hydrogen 3.369 N/A ARG 224.A N ASN 223.A OD1 no hydrogen 2.806 N/A PHE 225.A N LEU 213.A O no hydrogen 2.824 N/A TRP 227.A N SER 211.A O no hydrogen 3.280 N/A TRP 227.A NE1 CYS 209.A O no hydrogen 2.770 N/A LYS 229.A N ALA 226.A O no hydrogen 3.117 N/A LYS 229.A NZ GLU 250.A OE2 no hydrogen 2.754 N/A VAL 230.A N TRP 227.A O no hydrogen 3.010 N/A LEU 231.A N LYS 243.A O no hydrogen 2.751 N/A SER 234.A N.A TYR 241.A O no hydrogen 3.077 N/A SER 234.A N.B TYR 241.A O no hydrogen 3.057 N/A LYS 236.A N ASN 239.A O no hydrogen 2.855 N/A ASN 239.A N LYS 236.A O no hydrogen 2.838 N/A PHE 240.A N PHE 258.A O no hydrogen 3.147 N/A TYR 241.A N SER 234.A O.A no hydrogen 2.870 N/A TYR 241.A N SER 234.A O.B no hydrogen 2.895 N/A ILE 242.A N ILE 256.A O no hydrogen 2.933 N/A LYS 243.A N LYS 232.A O no hydrogen 2.946 N/A LYS 243.A NZ GLU 253.A OE1 no hydrogen 3.479 N/A ILE 244.A N SER 254.A O no hydrogen 2.936 N/A GLU 250.A N GLY 247.A O no hydrogen 3.256 N/A SER 254.A N ILE 244.A O no hydrogen 2.806 N/A ILE 256.A N ILE 242.A O no hydrogen 2.829 N/A PHE 258.A N PHE 240.A O no hydrogen 2.958 N/A LYS 259.A N LYS 197.A O no hydrogen 2.679 N/A LYS 259.A NZ ASN 238.A OD1.B no hydrogen 3.380 N/A LYS 259.A NZ ASN 239.A OD1 no hydrogen 2.886 N/A LEU 260.A N ASN 238.A O.A no hydrogen 2.841 N/A LEU 260.A N ASN 238.A O.B no hydrogen 2.935 N/A ARG 264.A NE GLU 52.A OE1.B no hydrogen 2.758 N/A ARG 264.A NH2 GLU 52.A OE1.A no hydrogen 3.372 N/A ARG 264.A NH2 GLU 52.A OE1.B no hydrogen 2.930 N/A ARG 264.A NH2 GLU 52.A OE1.C no hydrogen 2.705 N/A ALA 265.A N ASN 262.A OD1 no hydrogen 2.867 N/A ALA 266.A N ASN 262.A O no hydrogen 3.233 N/A LYS 267.A N HIS 263.A O no hydrogen 2.872 N/A LYS 267.A NZ TYR 235.A OH no hydrogen 3.171 N/A ARG 268.A N ARG 264.A O no hydrogen 2.927 N/A ARG 268.A NH1 GLU 52.A OE2.A no hydrogen 3.102 N/A LEU 269.A N ALA 265.A O no hydrogen 3.048 N/A TRP 270.A N ALA 266.A O no hydrogen 2.965 N/A TRP 270.A NE1 ILE 233.A O no hydrogen 3.182 N/A LYS 271.A N LYS 267.A O no hydrogen 2.949 N/A VAL 272.A N.A ARG 268.A O no hydrogen 3.073 N/A VAL 272.A N.B ARG 268.A O no hydrogen 3.089 N/A CYS 273.A N LEU 269.A O no hydrogen 2.897 N/A CYS 273.A SG LEU 269.A O no hydrogen 3.355 N/A VAL 274.A N TRP 270.A O no hydrogen 2.987 N/A GLU 275.A N LYS 271.A O no hydrogen 2.939 N/A HIS 276.A N VAL 272.A O.A no hydrogen 3.118 N/A HIS 276.A N VAL 272.A O.B no hydrogen 2.729 N/A HIS 276.A ND1 VAL 272.A O.A no hydrogen 2.756 N/A HIS 277.A N CYS 273.A O no hydrogen 2.749 N/A THR 278.A N VAL 274.A O no hydrogen 2.864 N/A THR 278.A OG1 VAL 274.A O no hydrogen 2.787 N/A PHE 279.A N GLU 275.A O no hydrogen 2.916 N/A PHE 280.A N HIS 276.A O no hydrogen 3.030 N/A ARG 281.A N HIS 277.A O no hydrogen 3.175 N/A ARG 281.A NH2 HIS 277.A NE2 no hydrogen 3.393 N/A LEU 282.A N THR 278.A O no hydrogen 3.172 N/A