Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e93_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 PRO 89.A O no hydrogen 2.816 N/A TYR 6.A N VAL 17.A O no hydrogen 2.884 N/A TYR 6.A OH TYR 21.A O no hydrogen 2.553 N/A GLN 8.A N TRP 15.A O no hydrogen 2.939 N/A LEU 10.A N THR 13.A O no hydrogen 2.628 N/A THR 13.A OG1 ASN 11.A O no hydrogen 3.530 N/A TRP 15.A N GLN 8.A O no hydrogen 2.707 N/A GLU 16.A N TYR 100.A OH no hydrogen 2.931 N/A VAL 17.A N TYR 6.A O no hydrogen 3.078 N/A GLU 19.A N THR 4.A O no hydrogen 2.953 N/A ARG 20.A NE ASP 40.A OD1 no hydrogen 2.770 N/A ARG 20.A NH2 ASP 40.A OD1 no hydrogen 3.308 N/A ARG 20.A NH2 ASP 40.A OD2 no hydrogen 2.689 N/A TYR 21.A N PRO 18.A O no hydrogen 3.012 N/A TYR 21.A OH ASP 85.A OD2 no hydrogen 2.631 N/A GLN 22.A N PHE 39.A O no hydrogen 2.858 N/A GLN 22.A NE2 GLU 19.A O no hydrogen 2.777 N/A SER 25.A N ALA 37.A O no hydrogen 2.768 N/A VAL 27.A N VAL 35.A O no hydrogen 2.814 N/A GLY 30.A N GLY 33.A O no hydrogen 2.852 N/A TYR 32.A N LEU 167.A O no hydrogen 2.909 N/A GLY 33.A N GLY 30.A O no hydrogen 3.202 N/A SER 34.A N LYS 51.A O no hydrogen 3.106 N/A VAL 35.A N GLY 28.A O no hydrogen 2.627 N/A CYS 36.A N VAL 49.A O no hydrogen 2.931 N/A ALA 37.A N SER 25.A O no hydrogen 2.729 N/A ALA 38.A N VAL 47.A O no hydrogen 2.759 N/A PHE 39.A N GLN 22.A O no hydrogen 2.790 N/A ASP 40.A N LEU 45.A O no hydrogen 2.817 N/A THR 41.A N ARG 20.A O no hydrogen 2.843 N/A THR 41.A OG1 ARG 20.A O no hydrogen 2.776 N/A LYS 42.A N ASP 40.A OD1 no hydrogen 3.069 N/A THR 43.A N ASP 40.A O no hydrogen 3.131 N/A THR 43.A OG1 ASP 40.A OD2 no hydrogen 2.637 N/A GLY 44.A N ASP 40.A O no hydrogen 2.761 N/A LEU 45.A N THR 43.A OG1 no hydrogen 3.275 N/A VAL 47.A N ALA 38.A O no hydrogen 2.874 N/A ALA 48.A N THR 103.A O no hydrogen 2.879 N/A VAL 49.A N CYS 36.A O no hydrogen 2.857 N/A LYS 50.A N LEU 101.A O no hydrogen 2.778 N/A LYS 50.A NZ GLU 68.A OE1 no hydrogen 3.327 N/A LYS 50.A NZ GLU 68.A OE2 no hydrogen 2.709 N/A LYS 51.A N SER 34.A O no hydrogen 2.963 N/A LYS 51.A NZ ILE 14.A O no hydrogen 2.649 N/A LEU 52.A N VAL 99.A O no hydrogen 3.058 N/A SER 53.A N TYR 32.A O no hydrogen 3.104 N/A SER 53.A OG ALA 31.A O no hydrogen 3.161 N/A GLN 57.A N ARG 54.A O no hydrogen 3.436 N/A HIS 61.A N SER 58.A OG no hydrogen 3.015 N/A ALA 62.A N SER 58.A O no hydrogen 2.829 N/A LYS 63.A N ILE 59.A O no hydrogen 2.876 N/A LYS 63.A NZ GLU 321.A O no hydrogen 2.776 N/A LYS 63.A NZ ARG 323.A O no hydrogen 3.523 N/A ARG 64.A N ILE 60.A O no hydrogen 3.032 N/A THR 65.A N HIS 61.A O no hydrogen 2.875 N/A THR 65.A OG1 PRO 55.A O no hydrogen 2.758 N/A THR 65.A OG1 HIS 61.A O no hydrogen 2.963 N/A TYR 66.A N ALA 62.A O no hydrogen 3.033 N/A ARG 67.A N LYS 63.A O no hydrogen 2.747 N/A ARG 67.A NE GLU 321.A OE1 no hydrogen 3.442 N/A ARG 67.A NE GLU 321.A OE2 no hydrogen 2.662 N/A ARG 67.A NH2 GLU 321.A OE1 no hydrogen 2.733 N/A GLU 68.A N ARG 64.A O no hydrogen 2.916 N/A LEU 69.A N THR 65.A O no hydrogen 3.065 N/A ARG 70.A N TYR 66.A O no hydrogen 2.912 N/A ARG 70.A NH1 TYR 66.A OH no hydrogen 2.953 N/A ARG 70.A NH2 ASP 317.A O no hydrogen 2.763 N/A LEU 71.A N ARG 67.A O no hydrogen 2.956 N/A LEU 72.A N GLU 68.A O no hydrogen 2.921 N/A LYS 73.A N LEU 69.A O no hydrogen 2.916 N/A LYS 73.A NZ GLU 337.A O no hydrogen 2.750 N/A LYS 73.A NZ GLU 337.A OE1 no hydrogen 2.739 N/A HIS 74.A N ARG 70.A O no hydrogen 3.179 N/A HIS 74.A N LEU 71.A O no hydrogen 3.075 N/A HIS 74.A NE2 ASP 314.A O no hydrogen 2.773 N/A MET 75.A N LEU 71.A O no hydrogen 3.076 N/A LYS 76.A N TYR 137.A OH no hydrogen 2.820 N/A ASN 79.A N HIS 77.A ND1 no hydrogen 2.958 N/A ASN 79.A ND2 LEU 160.A O no hydrogen 3.024 N/A VAL 80.A N HIS 77.A O no hydrogen 3.198 N/A ILE 81.A N ILE 162.A O no hydrogen 2.953 N/A LEU 84.A N VAL 102.A O no hydrogen 2.873 N/A ASP 85.A N VAL 102.A O no hydrogen 3.316 N/A VAL 86.A N ASP 85.A OD1 no hydrogen 2.891 N/A PHE 87.A N TYR 100.A O no hydrogen 3.046 N/A THR 88.A OG1 ASP 98.A O no hydrogen 2.816 N/A ALA 90.A N THR 88.A OG1 no hydrogen 3.284 N/A ARG 91.A N GLU 95.A OE2 no hydrogen 2.876 N/A SER 92.A OG GLU 94.A OE1 no hydrogen 3.403 N/A GLU 95.A N SER 92.A O no hydrogen 3.283 N/A PHE 96.A N LEU 93.A O no hydrogen 3.078 N/A TYR 100.A N PHE 87.A O no hydrogen 3.029 N/A LEU 101.A N LYS 50.A O no hydrogen 2.847 N/A VAL 102.A N ASP 85.A O no hydrogen 2.829 N/A THR 103.A N ALA 48.A O no hydrogen 2.898 N/A THR 103.A OG1 HIS 104.A O no hydrogen 2.829 N/A LEU 105.A N ARG 46.A O no hydrogen 3.049 N/A ASP 109.A N ASN 112.A OD1.A no hydrogen 3.006 N/A LEU 110.A N PRO 150.A O no hydrogen 3.317 N/A LEU 110.A N LEU 153.A O no hydrogen 2.919 N/A ASN 112.A N ASP 109.A OD1 no hydrogen 3.024 N/A ILE 113.A N ASP 109.A O no hydrogen 3.246 N/A VAL 114.A N LEU 110.A O no hydrogen 2.896 N/A LYS 115.A N ASN 111.A O no hydrogen 2.823 N/A CYS 116.A N ASN 112.A O no hydrogen 3.047 N/A CYS 116.A SG ASN 112.A O no hydrogen 3.170 N/A CYS 116.A SG ASN 112.A OD1.B no hydrogen 3.684 N/A GLN 117.A N ILE 113.A O no hydrogen 2.823 N/A THR 120.A N HIS 123.A ND1 no hydrogen 3.271 N/A HIS 123.A N THR 120.A OG1 no hydrogen 3.118 N/A VAL 124.A N THR 120.A O no hydrogen 2.981 N/A GLN 125.A N ASP 121.A O no hydrogen 2.740 N/A GLN 125.A NE2 ASP 121.A OD2 no hydrogen 2.810 N/A PHE 126.A N ASP 122.A O no hydrogen 2.926 N/A LEU 127.A N HIS 123.A O no hydrogen 2.965 N/A ILE 128.A N VAL 124.A O no hydrogen 2.990 N/A TYR 129.A N GLN 125.A O no hydrogen 2.924 N/A TYR 129.A OH GLU 310.A OE2 no hydrogen 2.680 N/A GLN 130.A N PHE 126.A O no hydrogen 3.062 N/A GLN 130.A NE2 PHE 126.A O no hydrogen 3.252 N/A ILE 131.A N LEU 127.A O no hydrogen 3.094 N/A LEU 132.A N ILE 128.A O no hydrogen 2.950 N/A ARG 133.A N TYR 129.A O no hydrogen 2.901 N/A ARG 133.A NE ASP 309.A O no hydrogen 2.821 N/A ARG 133.A NH1 GLU 78.A OE1 no hydrogen 3.027 N/A ARG 133.A NH1 ASN 79.A OD1 no hydrogen 2.886 N/A ARG 133.A NH2 GLU 78.A OE1 no hydrogen 3.225 N/A ARG 133.A NH2 ASP 309.A O no hydrogen 2.951 N/A ARG 133.A NH2 ASP 309.A OD1 no hydrogen 2.966 N/A GLY 134.A N GLN 130.A O no hydrogen 2.997 N/A LEU 135.A N ILE 131.A O no hydrogen 2.751 N/A LYS 136.A N LEU 132.A O no hydrogen 2.718 N/A LYS 136.A NZ GLU 310.A O no hydrogen 2.762 N/A TYR 137.A N ARG 133.A O no hydrogen 3.315 N/A TYR 137.A OH HIS 74.A O no hydrogen 3.212 N/A ILE 138.A N GLY 134.A O no hydrogen 2.913 N/A HIS 139.A N LEU 135.A O no hydrogen 2.733 N/A HIS 139.A NE2 ASP 198.A OD2 no hydrogen 2.857 N/A SER 140.A N LYS 136.A O no hydrogen 3.005 N/A SER 140.A OG LYS 136.A O no hydrogen 3.533 N/A SER 140.A OG TYR 137.A O no hydrogen 2.543 N/A ALA 141.A N ILE 138.A O no hydrogen 3.085 N/A ASP 142.A N HIS 139.A O no hydrogen 2.772 N/A ILE 143.A N ILE 138.A O no hydrogen 3.154 N/A HIS 145.A N ASP 198.A OD2 no hydrogen 2.807 N/A HIS 145.A NE2 LEU 163.A O no hydrogen 2.802 N/A ARG 146.A N ASP 198.A OD1 no hydrogen 2.812 N/A ASP 147.A N HIS 145.A ND1 no hydrogen 3.082 N/A ASN 152.A N LYS 149.A O no hydrogen 2.938 N/A ASN 152.A ND2 ASP 147.A O no hydrogen 2.923 N/A LEU 153.A N PRO 150.A O no hydrogen 3.151 N/A ALA 154.A N LYS 161.A O no hydrogen 3.009 N/A VAL 155.A N ALA 108.A O no hydrogen 2.876 N/A ASN 156.A N GLU 159.A O no hydrogen 2.891 N/A ASN 156.A ND2 GLU 159.A OE1 no hydrogen 2.943 N/A ASP 158.A N ASN 156.A OD1 no hydrogen 2.955 N/A LEU 160.A N GLN 130.A OE1 no hydrogen 2.840 N/A LYS 161.A N ALA 154.A O no hydrogen 2.955 N/A ILE 162.A N ASN 79.A O no hydrogen 2.764 N/A LEU 163.A N ASN 152.A O no hydrogen 3.003 N/A PHE 165.A N ASN 152.A OD1 no hydrogen 2.830 N/A GLY 166.A N ASP 164.A OD1 no hydrogen 2.718 N/A MET 172.A N ASP 169.A O no hydrogen 3.081 N/A THR 173.A N ASP 170.A O no hydrogen 3.053 N/A THR 173.A OG1 ASP 169.A O no hydrogen 2.631 N/A THR 173.A OG1 ASP 170.A O no hydrogen 3.366 N/A THR 178.A OG1 GLU 171.A O no hydrogen 2.408 N/A ARG 179.A N VAL 176.A O no hydrogen 3.148 N/A ARG 179.A NE GLN 224.A OE1 no hydrogen 2.814 N/A ARG 179.A NH1 MET 172.A O no hydrogen 2.774 N/A ARG 179.A NH1 GLY 174.A O no hydrogen 2.654 N/A ARG 179.A NH2 GLY 174.A O no hydrogen 3.010 N/A ARG 179.A NH2 GLY 218.A O no hydrogen 2.892 N/A ARG 179.A NH2 GLN 224.A OE1 no hydrogen 3.070 N/A TRP 180.A NE1 GLY 218.A O no hydrogen 3.005 N/A TYR 181.A OH GLU 208.A OE1 no hydrogen 2.504 N/A TYR 181.A OH GLU 208.A OE2 no hydrogen 3.217 N/A ARG 182.A N ARG 179.A O no hydrogen 3.123 N/A ARG 182.A NH2 ARG 146.A O no hydrogen 2.654 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.858 N/A ILE 186.A N ALA 183.A O no hydrogen 3.036 N/A MET 187.A N ALA 183.A O no hydrogen 3.008 N/A LEU 188.A N PRO 184.A O no hydrogen 2.937 N/A ASN 189.A N ILE 186.A O no hydrogen 3.305 N/A TRP 190.A N GLU 185.A O no hydrogen 2.903 N/A GLN 195.A NE2 HIS 139.A O no hydrogen 3.469 N/A THR 196.A N ASN 194.A OD1 no hydrogen 3.435 N/A THR 196.A OG1 ASN 194.A OD1 no hydrogen 2.529 N/A VAL 197.A N ASN 194.A O no hydrogen 3.018 N/A ASP 198.A N GLN 195.A O no hydrogen 2.946 N/A ILE 199.A N THR 196.A O no hydrogen 3.036 N/A TRP 200.A N THR 196.A O no hydrogen 3.383 N/A SER 201.A N VAL 197.A O no hydrogen 3.369 N/A SER 201.A OG TYR 181.A O no hydrogen 2.712 N/A SER 201.A OG VAL 197.A O no hydrogen 3.474 N/A VAL 202.A N ASP 198.A O no hydrogen 3.063 N/A GLY 203.A N ILE 199.A O no hydrogen 3.000 N/A CYS 204.A N TRP 200.A O no hydrogen 3.035 N/A CYS 204.A SG TRP 180.A O no hydrogen 3.974 N/A CYS 204.A SG TRP 200.A O no hydrogen 3.626 N/A ILE 205.A N SER 201.A O no hydrogen 2.974 N/A MET 206.A N VAL 202.A O no hydrogen 2.799 N/A ALA 207.A N GLY 203.A O no hydrogen 2.991 N/A GLU 208.A N CYS 204.A O no hydrogen 3.117 N/A LEU 209.A N ILE 205.A O no hydrogen 2.852 N/A LEU 210.A N MET 206.A O no hydrogen 3.054 N/A THR 211.A N ALA 207.A O no hydrogen 2.963 N/A THR 211.A OG1 ALA 207.A O no hydrogen 3.327 N/A GLY 212.A N GLU 208.A O no hydrogen 2.781 N/A ARG 213.A N THR 211.A OG1 no hydrogen 2.944 N/A GLY 218.A N PHE 216.A O no hydrogen 2.790 N/A THR 219.A N ASP 223.A OD2 no hydrogen 2.888 N/A THR 219.A OG1 ASP 220.A OD2 no hydrogen 3.369 N/A ASP 223.A N ASP 220.A OD1 no hydrogen 2.849 N/A GLN 224.A N ASP 220.A O no hydrogen 2.907 N/A GLN 224.A NE2 ARG 179.A O no hydrogen 2.869 N/A LEU 225.A N HIS 221.A O no hydrogen 2.939 N/A LYS 226.A N ILE 222.A O no hydrogen 2.941 N/A LEU 227.A N ASP 223.A O no hydrogen 2.966 N/A ILE 228.A N GLN 224.A O no hydrogen 2.990 N/A LEU 229.A N LEU 225.A O no hydrogen 2.840 N/A ARG 230.A N LYS 226.A O no hydrogen 2.965 N/A LEU 231.A N ILE 228.A O no hydrogen 3.058 N/A VAL 232.A N ILE 228.A O no hydrogen 2.927 N/A GLY 233.A N LEU 229.A O no hydrogen 2.830 N/A THR 234.A N MET 258.A O no hydrogen 3.008 N/A THR 234.A OG1 MET 258.A O no hydrogen 3.265 N/A LEU 240.A N GLY 236.A O no hydrogen 2.935 N/A LYS 241.A N ALA 237.A O no hydrogen 2.997 N/A LYS 242.A N LEU 239.A O no hydrogen 2.875 N/A LYS 242.A NZ ASP 285.A OD1 no hydrogen 3.318 N/A LYS 242.A NZ ASP 285.A OD2 no hydrogen 2.660 N/A LYS 242.A NZ ASP 287.A OD2 no hydrogen 2.837 N/A ILE 243.A N LEU 240.A O no hydrogen 2.983 N/A SER 244.A OG TRP 190.A O no hydrogen 3.302 N/A SER 245.A N TRP 190.A O no hydrogen 3.183 N/A ALA 248.A N SER 245.A OG no hydrogen 3.216 N/A ARG 249.A N SER 245.A O no hydrogen 3.105 N/A ARG 249.A NE LEU 240.A O no hydrogen 3.157 N/A ARG 249.A NE ILE 243.A O no hydrogen 3.039 N/A ASN 250.A N GLU 246.A O no hydrogen 3.051 N/A TYR 251.A N SER 247.A O no hydrogen 3.060 N/A ILE 252.A N ALA 248.A O no hydrogen 2.941 N/A GLN 253.A N ARG 249.A O no hydrogen 3.154 N/A SER 254.A N TYR 251.A O no hydrogen 2.939 N/A SER 254.A OG TYR 251.A O no hydrogen 2.638 N/A LEU 255.A N ILE 252.A O no hydrogen 3.232 N/A MET 258.A N THR 234.A OG1 no hydrogen 2.926 N/A LYS 260.A NZ MET 261.A O no hydrogen 2.840 N/A LYS 260.A NZ GLU 279.A OE2 no hydrogen 2.896 N/A MET 261.A N LEU 231.A O no hydrogen 2.814 N/A ASN 265.A N ASN 262.A O no hydrogen 3.102 N/A ASN 265.A N ASN 262.A OD1 no hydrogen 3.290 N/A VAL 266.A N PHE 263.A O no hydrogen 3.045 N/A PHE 267.A N PHE 263.A O no hydrogen 2.792 N/A ALA 270.A N PHE 267.A O no hydrogen 3.064 N/A ASN 271.A ND2 ASP 121.A OD2 no hydrogen 2.832 N/A LEU 273.A N ASN 271.A OD1 no hydrogen 2.955 N/A VAL 275.A N ASN 271.A O no hydrogen 3.044 N/A ASP 276.A N PRO 272.A O no hydrogen 2.988 N/A LEU 277.A N LEU 273.A O no hydrogen 2.958 N/A LEU 278.A N ALA 274.A O no hydrogen 2.934 N/A GLU 279.A N VAL 275.A O no hydrogen 3.009 N/A LYS 280.A N ASP 276.A O no hydrogen 3.105 N/A LYS 280.A N LEU 277.A O no hydrogen 2.934 N/A LYS 280.A NZ ASP 276.A OD2 no hydrogen 2.815 N/A MET 281.A N LEU 277.A O no hydrogen 2.968 N/A MET 281.A N LEU 278.A O no hydrogen 3.177 N/A LEU 282.A N LEU 278.A O no hydrogen 2.835 N/A ASP 287.A N ASP 285.A OD1 no hydrogen 3.086 N/A LYS 288.A N ASP 285.A O no hydrogen 2.857 N/A LYS 288.A NZ GLU 238.A OE2 no hydrogen 2.586 N/A ARG 289.A N SER 286.A O no hydrogen 3.382 N/A ARG 289.A NE VAL 283.A O no hydrogen 2.705 N/A ARG 289.A NH1 GLU 185.A OE2 no hydrogen 2.709 N/A ARG 289.A NH1 THR 196.A O no hydrogen 3.137 N/A ARG 289.A NH2 GLU 185.A OE1 no hydrogen 2.777 N/A ARG 289.A NH2 GLU 185.A OE2 no hydrogen 3.418 N/A ARG 289.A NH2 VAL 283.A O no hydrogen 3.342 N/A ILE 290.A N LYS 280.A O no hydrogen 2.995 N/A THR 291.A N GLN 294.A OE1 no hydrogen 2.910 N/A GLN 294.A N THR 291.A OG1 no hydrogen 3.133 N/A ALA 295.A N THR 291.A O no hydrogen 2.861 N/A LEU 296.A N ALA 292.A O no hydrogen 3.112 N/A ALA 297.A N GLN 294.A O no hydrogen 3.015 N/A HIS 298.A N ALA 295.A O no hydrogen 2.902 N/A HIS 298.A NE2 ASP 276.A OD2 no hydrogen 2.723 N/A TYR 300.A N HIS 298.A ND1 no hydrogen 3.080 N/A TYR 300.A OH ASP 121.A OD1 no hydrogen 2.580 N/A PHE 301.A N HIS 298.A O no hydrogen 3.029 N/A ALA 302.A N ALA 299.A O no hydrogen 3.069 N/A TYR 304.A N PHE 301.A O no hydrogen 2.951 N/A TYR 304.A OH ASP 122.A OD1 no hydrogen 2.556 N/A HIS 305.A N PHE 301.A O no hydrogen 2.837 N/A HIS 305.A ND1 GLU 310.A OE2 no hydrogen 2.728 N/A ASP 306.A N GLU 310.A OE2 no hydrogen 3.149 N/A ASP 308.A N ASP 306.A OD1 no hydrogen 3.020 N/A ASP 309.A N ASP 306.A O no hydrogen 2.889 N/A ALA 313.A N SER 140.A OG no hydrogen 2.808 N/A GLN 318.A NE2 ASP 142.A O no hydrogen 2.793 N/A SER 319.A N ASP 317.A OD1 no hydrogen 2.893 N/A SER 319.A OG ASP 317.A OD1 no hydrogen 2.620 N/A GLU 321.A N GLN 318.A O no hydrogen 2.985 N/A SER 322.A N SER 319.A O no hydrogen 3.174 N/A SER 322.A OG SER 319.A O no hydrogen 3.215 N/A ARG 323.A N PHE 320.A O no hydrogen 2.996 N/A LEU 326.A N GLU 329.A OE1 no hydrogen 3.042 N/A TRP 330.A N LEU 326.A O no hydrogen 3.010 N/A LYS 331.A N ILE 327.A O no hydrogen 2.808 N/A LYS 331.A NZ ASN 97.A OD1 no hydrogen 2.966 N/A SER 332.A N ASP 328.A O no hydrogen 2.886 N/A LEU 333.A N GLU 329.A O no hydrogen 3.012 N/A THR 334.A N TRP 330.A O no hydrogen 2.937 N/A THR 334.A OG1 TRP 330.A O no hydrogen 2.882 N/A TYR 335.A N LYS 331.A O no hydrogen 2.891 N/A ASP 336.A N SER 332.A O no hydrogen 3.028 N/A GLU 337.A N LEU 333.A O no hydrogen 3.189 N/A VAL 338.A N THR 334.A O no hydrogen 2.985 N/A ILE 339.A N TYR 335.A O no hydrogen 3.056 N/A SER 340.A N ASP 336.A O no hydrogen 3.052 N/A SER 340.A OG ASP 336.A O no hydrogen 3.133 N/A SER 340.A OG GLU 337.A O no hydrogen 3.355 N/A PHE 341.A N VAL 338.A O no hydrogen 3.324 N/A