Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5hbe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N ASP 3.A OD2 no hydrogen 2.905 N/A PHE 6.A N ASP 3.A OD2 no hydrogen 3.199 N/A LYS 7.A N ASP 3.A O no hydrogen 2.950 N/A VAL 8.A N TYR 4.A O no hydrogen 2.958 N/A LYS 9.A N ASP 5.A O no hydrogen 2.946 N/A LYS 9.A NZ GLU 13.A OE2 no hydrogen 3.514 N/A LEU 10.A N PHE 6.A O no hydrogen 3.220 N/A SER 11.A N LYS 7.A O no hydrogen 2.885 N/A SER 12.A N VAL 8.A O no hydrogen 2.848 N/A GLU 13.A N LYS 9.A O no hydrogen 3.031 N/A GLU 18.A N GLU 18.A OE1 no hydrogen 2.973 N/A ASP 19.A N ARG 16.A O no hydrogen 3.156 N/A LEU 20.A N ARG 16.A O no hydrogen 3.268 N/A LEU 20.A N VAL 17.A O no hydrogen 3.252 N/A PHE 21.A N VAL 17.A O no hydrogen 3.088 N/A GLU 22.A N LYS 40.A O no hydrogen 2.823 N/A CYS 26.A N TYR 23.A O no hydrogen 3.265 N/A CYS 26.A SG GLU 24.A O no hydrogen 3.841 N/A LYS 27.A NZ HIS 35.A ND1 no hydrogen 2.986 N/A VAL 28.A N VAL 36.A O no hydrogen 2.955 N/A GLY 29.A N VAL 36.A O no hydrogen 3.334 N/A ARG 30.A NH1 GLY 34.A O no hydrogen 3.220 N/A GLY 31.A N GLY 34.A O no hydrogen 3.113 N/A GLY 34.A N GLY 31.A O no hydrogen 3.357 N/A HIS 35.A N GLN 54.A O no hydrogen 3.202 N/A VAL 36.A N GLY 29.A O no hydrogen 3.014 N/A TYR 37.A N LEU 52.A O no hydrogen 2.702 N/A LYS 38.A N CYS 26.A O no hydrogen 2.729 N/A ALA 39.A N TYR 50.A O no hydrogen 2.773 N/A LYS 40.A N GLU 22.A O no hydrogen 3.113 N/A LYS 40.A NZ ASP 47.A O no hydrogen 2.743 N/A LYS 40.A NZ ASP 47.A OD2 no hydrogen 3.554 N/A LYS 40.A NZ ASP 49.A OD1 no hydrogen 2.978 N/A LYS 42.A N LEU 20.A O no hydrogen 2.779 N/A LYS 42.A NZ GLU 18.A O no hydrogen 2.883 N/A LYS 45.A N ASP 43.A O no hydrogen 2.663 N/A LYS 48.A NZ TYR 50.A OH no hydrogen 3.128 N/A TYR 50.A N ALA 39.A O no hydrogen 2.935 N/A TYR 50.A OH ASP 46.A OD1 no hydrogen 3.253 N/A TYR 50.A OH ASP 46.A OD2 no hydrogen 2.676 N/A ALA 51.A N PHE 98.A O no hydrogen 2.815 N/A LEU 52.A N TYR 37.A O no hydrogen 2.837 N/A LYS 53.A N LEU 96.A O no hydrogen 2.974 N/A LYS 53.A NZ GLU 67.A OE1 no hydrogen 3.137 N/A LYS 53.A NZ GLU 67.A OE2 no hydrogen 2.663 N/A GLN 54.A N HIS 35.A O no hydrogen 3.015 N/A ILE 55.A N VAL 94.A O no hydrogen 2.827 N/A GLU 56.A N TYR 33.A O no hydrogen 3.013 N/A GLY 59.A N ARG 92.A O no hydrogen 2.839 N/A ALA 64.A N SER 61.A OG no hydrogen 3.339 N/A CYS 65.A N SER 61.A O no hydrogen 2.764 N/A ARG 66.A N MET 62.A O no hydrogen 2.950 N/A ARG 66.A NE PHE 173.A O no hydrogen 2.990 N/A GLU 67.A N SER 63.A O no hydrogen 3.017 N/A ILE 68.A N ALA 64.A O no hydrogen 3.048 N/A ALA 69.A N CYS 65.A O no hydrogen 2.915 N/A LEU 70.A N ARG 66.A O no hydrogen 2.972 N/A LEU 71.A N GLU 67.A O no hydrogen 3.151 N/A ARG 72.A N ILE 68.A O no hydrogen 2.979 N/A ARG 72.A NH1 ARG 72.A O no hydrogen 3.247 N/A GLU 73.A N LEU 70.A O no hydrogen 2.944 N/A LEU 74.A N LEU 70.A O no hydrogen 2.838 N/A LYS 75.A N TYR 138.A OH no hydrogen 3.101 N/A HIS 76.A NE2 ASP 134.A OD1 no hydrogen 3.135 N/A ASN 78.A N HIS 76.A ND1 no hydrogen 3.092 N/A ASN 78.A ND2 GLN 131.A OE1 no hydrogen 3.040 N/A ASN 78.A ND2 VAL 166.A O no hydrogen 3.017 N/A VAL 79.A N HIS 76.A O no hydrogen 3.274 N/A ILE 80.A N ILE 168.A O no hydrogen 2.951 N/A GLN 83.A N LEU 97.A O no hydrogen 2.724 N/A GLN 83.A NE2 ASP 99.A OD2 no hydrogen 3.187 N/A LYS 84.A NZ GLU 15.A OE1 no hydrogen 3.447 N/A LYS 84.A NZ GLU 15.A OE2 no hydrogen 2.748 N/A PHE 86.A N TRP 95.A O no hydrogen 2.916 N/A SER 88.A N LYS 93.A O no hydrogen 3.030 N/A SER 88.A OG ASP 91.A OD1 no hydrogen 2.674 N/A LYS 93.A NZ GLY 57.A O no hydrogen 2.914 N/A TRP 95.A N PHE 86.A O no hydrogen 2.885 N/A LEU 96.A N LYS 53.A O no hydrogen 2.857 N/A LEU 97.A N LYS 84.A O no hydrogen 2.888 N/A PHE 98.A N ALA 51.A O no hydrogen 2.812 N/A TYR 100.A OH GLU 102.A OE2 no hydrogen 2.802 N/A HIS 103.A N VAL 156.A O no hydrogen 3.126 N/A LEU 105.A N ILE 154.A O.A no hydrogen 3.041 N/A LEU 105.A N ILE 154.A O.B no hydrogen 3.080 N/A TRP 106.A N PRO 151.A O no hydrogen 3.089 N/A HIS 107.A N ASP 104.A OD1 no hydrogen 2.853 N/A HIS 107.A ND1 ASP 104.A OD1 no hydrogen 2.729 N/A HIS 107.A ND1 ASP 104.A OD2 no hydrogen 3.064 N/A ILE 108.A N ASP 104.A O no hydrogen 2.984 N/A ILE 109.A N LEU 105.A O no hydrogen 2.869 N/A LYS 110.A N TRP 106.A O no hydrogen 3.153 N/A PHE 111.A N HIS 107.A O no hydrogen 3.015 N/A HIS 112.A N ILE 108.A O no hydrogen 3.140 N/A ARG 113.A N ILE 109.A O no hydrogen 2.893 N/A ALA 114.A N LYS 110.A O no hydrogen 2.868 N/A SER 115.A N PHE 111.A O no hydrogen 3.028 N/A SER 115.A OG PHE 111.A O no hydrogen 2.783 N/A SER 115.A OG HIS 112.A O no hydrogen 3.072 N/A LYS 116.A N HIS 112.A O no hydrogen 2.803 N/A LYS 126.A NZ TYR 317.A O no hydrogen 2.967 N/A LYS 126.A NZ PRO 322.A O no hydrogen 2.624 N/A SER 127.A N GLY 123.A O no hydrogen 3.110 N/A SER 127.A OG GLY 123.A O no hydrogen 2.733 N/A SER 127.A OG THR 325.A OG1 no hydrogen 3.331 N/A LEU 128.A N MET 124.A O no hydrogen 2.874 N/A LEU 129.A N VAL 125.A O no hydrogen 2.785 N/A TYR 130.A N LYS 126.A O no hydrogen 2.861 N/A GLN 131.A N SER 127.A O no hydrogen 3.111 N/A GLN 131.A NE2 THR 325.A O no hydrogen 2.980 N/A GLN 131.A NE2 SER 326.A O no hydrogen 3.113 N/A ILE 132.A N LEU 128.A O no hydrogen 2.911 N/A LEU 133.A N LEU 129.A O no hydrogen 2.874 N/A ASP 134.A N TYR 130.A O no hydrogen 2.861 N/A GLY 135.A N GLN 131.A O no hydrogen 3.023 N/A ILE 136.A N ILE 132.A O no hydrogen 3.028 N/A HIS 137.A N LEU 133.A O no hydrogen 2.992 N/A TYR 138.A N ASP 134.A O no hydrogen 3.166 N/A LEU 139.A N GLY 135.A O no hydrogen 3.212 N/A HIS 140.A N ILE 136.A O no hydrogen 2.945 N/A HIS 140.A NE2 ASP 204.A OD2 no hydrogen 3.095 N/A ALA 141.A N HIS 137.A O no hydrogen 2.892 N/A ASN 142.A N TYR 138.A O no hydrogen 3.264 N/A ASN 142.A ND2 TYR 138.A O no hydrogen 2.725 N/A TRP 143.A N HIS 140.A O no hydrogen 3.096 N/A VAL 144.A N LEU 139.A O no hydrogen 2.789 N/A HIS 146.A N ASP 204.A OD2 no hydrogen 2.705 N/A HIS 146.A NE2 ALA 169.A O no hydrogen 2.779 N/A ARG 147.A N ASP 204.A OD1 no hydrogen 2.931 N/A ARG 147.A NE ASN 178.A OD1 no hydrogen 3.167 N/A ARG 147.A NH1 GLY 172.A O no hydrogen 2.943 N/A ARG 147.A NH1 PHE 173.A O no hydrogen 3.341 N/A ARG 147.A NH2 ASN 178.A OD1 no hydrogen 2.738 N/A ASP 148.A N HIS 146.A ND1 no hydrogen 3.270 N/A LYS 150.A N ASN 153.A OD1.B no hydrogen 3.149 N/A ASN 153.A N.A LYS 150.A O no hydrogen 2.932 N/A ASN 153.A N.B LYS 150.A O no hydrogen 3.000 N/A ASN 153.A ND2.A ASP 148.A O no hydrogen 3.022 N/A ASN 153.A ND2.B ASP 148.A O no hydrogen 2.786 N/A ILE 154.A N.A LYS 150.A O no hydrogen 3.311 N/A ILE 154.A N.B PRO 151.A O no hydrogen 3.350 N/A LEU 155.A N LYS 167.A O no hydrogen 2.723 N/A VAL 156.A N HIS 103.A O no hydrogen 2.694 N/A MET 157.A N ARG 165.A O no hydrogen 3.091 N/A ARG 163.A N GLY 160.A O no hydrogen 3.127 N/A ARG 163.A NE GLU 159.A OE1 no hydrogen 3.258 N/A ARG 163.A NH1 ASP 327.A OD2 no hydrogen 3.059 N/A ARG 163.A NH1 CYS 332.A O no hydrogen 3.021 N/A ARG 163.A NH2 GLU 159.A OE2 no hydrogen 3.147 N/A ARG 163.A NH2 CYS 332.A O no hydrogen 2.758 N/A GLY 164.A N MET 157.A O no hydrogen 2.953 N/A ARG 165.A N GLU 162.A O no hydrogen 3.008 N/A ARG 165.A NH1 GLU 162.A OE1 no hydrogen 2.769 N/A VAL 166.A N GLN 131.A OE1 no hydrogen 3.008 N/A LYS 167.A N LEU 155.A O no hydrogen 2.682 N/A LYS 167.A NZ PRO 77.A O no hydrogen 2.816 N/A LYS 167.A NZ GLU 162.A OE1 no hydrogen 2.742 N/A LYS 167.A NZ GLU 162.A OE2 no hydrogen 3.477 N/A ILE 168.A N ASN 78.A O no hydrogen 2.923 N/A ALA 169.A N ASN 153.A O.B no hydrogen 3.374 N/A GLY 172.A N HIS 146.A O no hydrogen 2.733 N/A ARG 175.A NE ALA 174.A O no hydrogen 3.227 N/A ARG 175.A NH1 TYR 199.A OH no hydrogen 3.353 N/A ASN 178.A N ARG 175.A O no hydrogen 3.161 N/A ASN 178.A ND2 TYR 199.A O no hydrogen 3.460 N/A SER 179.A N LEU 176.A O no hydrogen 2.970 N/A SER 179.A OG ARG 197.A O no hydrogen 2.959 N/A TYR 187.A OH GLU 214.A OE1 no hydrogen 2.633 N/A ARG 188.A N PHE 185.A O no hydrogen 3.282 N/A GLU 191.A N GLU 191.A OE1 no hydrogen 2.939 N/A LEU 193.A N ALA 189.A O no hydrogen 3.367 N/A LEU 194.A N PRO 190.A O no hydrogen 2.913 N/A LEU 194.A N GLU 191.A O no hydrogen 3.094 N/A GLY 195.A N LEU 192.A O no hydrogen 3.272 N/A ALA 196.A N GLU 191.A O no hydrogen 2.961 N/A TYR 199.A N ASN 178.A O no hydrogen 3.234 N/A LYS 201.A NZ HIS 140.A O no hydrogen 3.197 N/A ILE 203.A N THR 200.A OG1 no hydrogen 3.043 N/A ILE 205.A N LYS 201.A O no hydrogen 3.073 N/A TRP 206.A N ALA 202.A O no hydrogen 2.943 N/A ALA 207.A N ILE 203.A O no hydrogen 3.356 N/A ILE 208.A N ASP 204.A O no hydrogen 3.083 N/A GLY 209.A N ILE 205.A O no hydrogen 3.115 N/A CYS 210.A N TRP 206.A O no hydrogen 3.044 N/A CYS 210.A SG TRP 186.A O no hydrogen 3.757 N/A CYS 210.A SG TRP 206.A O no hydrogen 3.706 N/A ILE 211.A N ALA 207.A O no hydrogen 3.020 N/A PHE 212.A N ILE 208.A O no hydrogen 2.947 N/A ALA 213.A N GLY 209.A O no hydrogen 3.097 N/A GLU 214.A N CYS 210.A O no hydrogen 2.944 N/A LEU 215.A N ILE 211.A O no hydrogen 2.805 N/A LEU 216.A N PHE 212.A O no hydrogen 3.127 N/A THR 217.A N ALA 213.A O no hydrogen 3.066 N/A THR 217.A OG1 ALA 213.A O no hydrogen 2.945 N/A SER 218.A N GLU 214.A O no hydrogen 2.652 N/A GLU 219.A N THR 217.A OG1 no hydrogen 3.085 N/A HIS 223.A N PRO 220.A O no hydrogen 3.084 N/A CYS 224.A SG ARG 225.A O no hydrogen 4.011 N/A ASN 228.A ND2 TYR 230.A O no hydrogen 3.358 N/A TYR 230.A OH ASP 265.A OD2 no hydrogen 2.791 N/A HIS 232.A ND1 ASP 233.A OD1 no hydrogen 3.001 N/A GLN 234.A NE2 PHE 222.A O no hydrogen 3.306 N/A GLN 234.A NE2 GLN 234.A O no hydrogen 2.866 N/A LEU 235.A N HIS 231.A O no hydrogen 3.237 N/A ASP 236.A N HIS 232.A O no hydrogen 2.909 N/A ARG 237.A N ASP 233.A O no hydrogen 3.267 N/A ARG 237.A NE ILE 221.A O no hydrogen 2.832 N/A ARG 237.A NH2 ILE 221.A O no hydrogen 2.783 N/A ILE 238.A N GLN 234.A O no hydrogen 3.245 N/A PHE 239.A N LEU 235.A O no hydrogen 3.065 N/A ASN 240.A N ASP 236.A O no hydrogen 2.928 N/A VAL 241.A N ARG 237.A O no hydrogen 2.970 N/A MET 242.A N ILE 238.A O no hydrogen 2.657 N/A GLY 243.A N PHE 239.A O no hydrogen 2.769 N/A ALA 246.A N ASP 249.A OD2 no hydrogen 3.135 N/A ASP 249.A N ALA 246.A O no hydrogen 3.116 N/A ILE 253.A N TRP 250.A O no hydrogen 3.347 N/A LYS 255.A N ASP 252.A O no hydrogen 2.719 N/A MET 256.A N ILE 253.A O no hydrogen 3.159 N/A GLU 258.A N LEU 194.A O no hydrogen 3.240 N/A HIS 259.A N MET 256.A O no hydrogen 3.102 N/A THR 261.A OG1 GLU 258.A OE1 no hydrogen 3.272 N/A LEU 262.A N GLU 258.A O no hydrogen 3.125 N/A MET 263.A N HIS 259.A O no hydrogen 3.042 N/A LYS 264.A N SER 260.A O no hydrogen 3.140 N/A ASP 265.A N THR 261.A O no hydrogen 2.921 N/A PHE 266.A N LEU 262.A O no hydrogen 2.748 N/A ARG 268.A NH1 PHE 244.A O no hydrogen 3.411 N/A ARG 268.A NH1 PRO 245.A O no hydrogen 3.350 N/A ARG 268.A NH2 PRO 245.A O no hydrogen 3.153 N/A THR 270.A N ARG 267.A O no hydrogen 3.125 N/A THR 270.A OG1 ARG 267.A O no hydrogen 2.874 N/A TYR 271.A N ARG 268.A O no hydrogen 3.110 N/A TYR 271.A OH ASP 236.A OD1 no hydrogen 2.584 N/A THR 272.A OG1 ASN 269.A O no hydrogen 2.702 N/A CYS 274.A SG ASN 240.A O no hydrogen 3.355 N/A LYS 278.A N SER 275.A OG no hydrogen 3.272 N/A TYR 279.A N SER 275.A O no hydrogen 3.091 N/A MET 280.A N LEU 276.A O no hydrogen 3.071 N/A GLU 281.A N ILE 277.A O no hydrogen 3.032 N/A LYS 282.A N LYS 278.A O no hydrogen 3.264 N/A HIS 283.A N TYR 279.A O no hydrogen 3.369 N/A LYS 284.A N GLU 281.A O no hydrogen 3.350 N/A VAL 285.A N MET 280.A O no hydrogen 2.983 N/A ASP 288.A N ASP 288.A OD1 no hydrogen 2.618 N/A SER 289.A N LYS 286.A O no hydrogen 3.303 N/A SER 289.A OG LYS 286.A O no hydrogen 2.734 N/A LYS 290.A NZ GLU 320.A OE2 no hydrogen 3.064 N/A PHE 292.A N SER 289.A OG no hydrogen 3.128 N/A HIS 293.A N SER 289.A O no hydrogen 3.231 N/A LEU 294.A N LYS 290.A O no hydrogen 3.122 N/A LEU 295.A N ALA 291.A O no hydrogen 3.344 N/A GLN 296.A N PHE 292.A O no hydrogen 3.038 N/A LYS 297.A N HIS 293.A O no hydrogen 3.343 N/A LEU 298.A N LEU 294.A O no hydrogen 3.072 N/A LEU 299.A N LEU 295.A O no hydrogen 2.730 N/A THR 300.A OG1 GLN 296.A O no hydrogen 3.035 N/A THR 300.A OG1 LYS 297.A O no hydrogen 3.010 N/A THR 300.A OG1 LYS 305.A O no hydrogen 3.493 N/A ILE 304.A N ASP 302.A OD1 no hydrogen 3.200 N/A LYS 305.A N ASP 302.A O no hydrogen 3.117 N/A LYS 305.A NZ LYS 248.A O no hydrogen 3.003 N/A ARG 306.A N PRO 303.A O no hydrogen 3.314 N/A ARG 306.A NE THR 300.A O no hydrogen 2.825 N/A ARG 306.A NH1 GLU 191.A OE2 no hydrogen 3.215 N/A ARG 306.A NH1 ALA 202.A O no hydrogen 2.921 N/A ARG 306.A NH2 GLU 191.A OE1 no hydrogen 3.124 N/A ARG 306.A NH2 THR 300.A O no hydrogen 2.998 N/A ARG 306.A NH2 MET 301.A O no hydrogen 2.940 N/A ILE 307.A N LYS 297.A O no hydrogen 3.312 N/A THR 308.A N GLN 311.A OE1 no hydrogen 3.203 N/A THR 308.A OG1 GLU 310.A OE2 no hydrogen 2.676 N/A THR 308.A OG1 GLN 311.A OE1 no hydrogen 3.372 N/A GLN 311.A N THR 308.A OG1 no hydrogen 3.120 N/A ALA 312.A N THR 308.A O no hydrogen 3.030 N/A MET 313.A N SER 309.A O no hydrogen 3.017 N/A ASP 315.A N ALA 312.A O no hydrogen 3.121 N/A TYR 317.A N ASP 315.A OD2 no hydrogen 2.855 N/A PHE 318.A N ASP 315.A O no hydrogen 3.322 N/A LEU 319.A N PRO 316.A O no hydrogen 2.917 N/A THR 325.A N SER 127.A OG no hydrogen 2.980 N/A THR 325.A OG1 SER 127.A OG no hydrogen 3.331 N/A THR 325.A OG1 ASP 327.A O no hydrogen 2.507 N/A VAL 328.A N GLY 164.A O no hydrogen 2.757 N/A PHE 329.A N ASP 327.A OD1 no hydrogen 2.951 N/A ALA 330.A N ASP 327.A O no hydrogen 2.954 N/A GLY 331.A N ASP 327.A OD2 no hydrogen 3.227 N/A CYS 332.A N PHE 329.A O no hydrogen 2.970 N/A CYS 332.A SG PHE 329.A O no hydrogen 3.250 N/A CYS 332.A SG ALA 330.A O no hydrogen 4.006 N/A TYR 336.A OH HIS 112.A NE2 no hydrogen 2.737 N/A ARG 339.A N GLU 102.A OE2 no hydrogen 3.202 N/A ARG 339.A NE ALA 101.A O no hydrogen 2.889 N/A ARG 339.A NH1 ASP 104.A OD2 no hydrogen 2.598 N/A ARG 339.A NH2 ALA 101.A O no hydrogen 2.710 N/A ARG 339.A NH2 ASP 104.A OD2 no hydrogen 2.999 N/A