Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3my5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A N SER 2.A O no hydrogen 3.117 N/A PHE 6.A N MET 3.A O no hydrogen 3.281 N/A GLN 7.A N ARG 24.A O no hydrogen 2.861 N/A GLN 7.A NE2 LYS 8.A O no hydrogen 3.435 N/A VAL 9.A N LYS 22.A O no hydrogen 2.801 N/A GLU 10.A N LYS 22.A O no hydrogen 3.485 N/A LYS 11.A NZ GLY 13.A O no hydrogen 3.240 N/A ILE 12.A N VAL 20.A O no hydrogen 2.867 N/A GLY 15.A N GLY 18.A O no hydrogen 2.556 N/A VAL 20.A N GLY 13.A O no hydrogen 3.098 N/A TYR 21.A N LEU 34.A O no hydrogen 2.876 N/A LYS 22.A N GLU 10.A O no hydrogen 2.868 N/A ALA 23.A N VAL 32.A O no hydrogen 2.779 N/A ARG 24.A N GLN 7.A O no hydrogen 2.862 N/A ASN 25.A N GLU 30.A O no hydrogen 2.754 N/A LYS 26.A N ASN 5.A O no hydrogen 2.720 N/A LYS 26.A NZ GLU 4.A O no hydrogen 3.330 N/A LYS 26.A NZ GLU 4.A OE2 no hydrogen 3.344 N/A LEU 27.A N ASN 25.A OD1 no hydrogen 2.839 N/A THR 28.A N ASN 25.A OD1 no hydrogen 3.096 N/A GLY 29.A N ASN 25.A O no hydrogen 2.972 N/A GLU 30.A N THR 28.A OG1 no hydrogen 3.220 N/A VAL 32.A N ALA 23.A O no hydrogen 2.795 N/A ALA 33.A N PHE 79.A O no hydrogen 2.924 N/A LEU 34.A N TYR 21.A O no hydrogen 2.653 N/A LYS 35.A N LEU 77.A O no hydrogen 2.846 N/A LYS 35.A NZ GLU 50.A OE2 no hydrogen 2.765 N/A LYS 36.A N VAL 19.A O no hydrogen 3.017 N/A ILE 37.A N LEU 75.A O no hydrogen 2.678 N/A ARG 38.A N TYR 17.A O no hydrogen 3.230 N/A THR 46.A OG1.A GLY 146.A O no hydrogen 3.272 N/A ILE 48.A N PRO 44.A O no hydrogen 3.027 N/A ARG 49.A N SER 45.A O no hydrogen 2.937 N/A GLU 50.A N THR 46.A O no hydrogen 2.999 N/A ILE 51.A N ALA 47.A O no hydrogen 2.939 N/A SER 52.A N ILE 48.A O no hydrogen 3.083 N/A SER 52.A OG.A ILE 48.A O no hydrogen 2.919 N/A SER 52.A OG.A ARG 49.A O no hydrogen 3.546 N/A LEU 53.A N ARG 49.A O no hydrogen 2.895 N/A LEU 54.A N GLU 50.A O no hydrogen 2.970 N/A LYS 55.A N ILE 51.A O no hydrogen 3.076 N/A GLU 56.A N LEU 53.A O no hydrogen 3.238 N/A LEU 57.A N LEU 54.A O no hydrogen 3.271 N/A ASN 58.A N GLU 56.A O no hydrogen 3.263 N/A ASN 61.A N HIS 59.A ND1 no hydrogen 2.906 N/A ASN 61.A ND2 GLN 109.A OE1 no hydrogen 2.999 N/A ASN 61.A ND2 ILE 140.A O no hydrogen 3.013 N/A ILE 62.A N HIS 59.A O no hydrogen 3.035 N/A VAL 63.A N LEU 142.A O no hydrogen 2.872 N/A LYS 64.A N GLU 80.A OE2 no hydrogen 2.757 N/A LEU 66.A N VAL 78.A O no hydrogen 2.555 N/A ASP 67.A N VAL 78.A O no hydrogen 3.343 N/A VAL 68.A N ASP 67.A OD1 no hydrogen 2.899 N/A ILE 69.A N TYR 76.A O no hydrogen 2.796 N/A LEU 75.A N ILE 37.A O no hydrogen 3.135 N/A TYR 76.A N ILE 69.A O no hydrogen 2.768 N/A LEU 77.A N LYS 35.A O no hydrogen 2.851 N/A VAL 78.A N ASP 67.A O no hydrogen 2.888 N/A PHE 79.A N ALA 33.A O no hydrogen 2.852 N/A GLU 80.A N LYS 64.A O no hydrogen 3.014 N/A GLN 84.A N ILE 134.A O no hydrogen 3.356 N/A LEU 86.A N LEU 132.A O no hydrogen 2.808 N/A LYS 87.A NZ ASP 91.A OD2 no hydrogen 3.382 N/A LYS 88.A N ASP 85.A OD1 no hydrogen 2.809 N/A PHE 89.A N ASP 85.A O no hydrogen 3.158 N/A MET 90.A N LEU 86.A O no hydrogen 2.852 N/A ASP 91.A N LYS 87.A O no hydrogen 3.027 N/A ALA 92.A N LYS 88.A O no hydrogen 2.973 N/A SER 93.A N MET 90.A O no hydrogen 3.089 N/A SER 93.A OG PHE 89.A O no hydrogen 2.990 N/A ALA 94.A N ASP 91.A O no hydrogen 3.207 N/A THR 96.A N SER 93.A O no hydrogen 3.195 N/A GLY 97.A N SER 93.A O no hydrogen 2.564 N/A LEU 102.A N PRO 99.A O no hydrogen 2.987 N/A ILE 103.A N PRO 99.A O no hydrogen 3.096 N/A LYS 104.A N LEU 100.A O no hydrogen 2.935 N/A LYS 104.A NZ PHE 283.A O no hydrogen 2.869 N/A LYS 104.A NZ ASP 286.A OD1 no hydrogen 3.428 N/A SER 105.A N PRO 101.A O no hydrogen 3.046 N/A TYR 106.A N LEU 102.A O no hydrogen 2.827 N/A LEU 107.A N ILE 103.A O no hydrogen 2.946 N/A PHE 108.A N LYS 104.A O no hydrogen 3.035 N/A GLN 109.A N SER 105.A O no hydrogen 3.062 N/A GLN 109.A NE2 SER 105.A O no hydrogen 3.394 N/A GLN 109.A NE2 SER 105.A OG no hydrogen 3.054 N/A GLN 109.A NE2 GLY 138.A O no hydrogen 2.909 N/A LEU 110.A N TYR 106.A O no hydrogen 2.884 N/A LEU 111.A N LEU 107.A O no hydrogen 2.925 N/A GLN 112.A N PHE 108.A O no hydrogen 3.065 N/A GLN 112.A NE2 PHE 108.A O no hydrogen 3.502 N/A GLY 113.A N GLN 109.A O no hydrogen 2.963 N/A LEU 114.A N LEU 110.A O no hydrogen 2.914 N/A ALA 115.A N LEU 111.A O no hydrogen 2.878 N/A PHE 116.A N GLN 112.A O no hydrogen 3.042 N/A CYS 117.A N GLY 113.A O no hydrogen 3.022 N/A CYS 117.A SG GLY 113.A O no hydrogen 3.556 N/A HIS 118.A N LEU 114.A O no hydrogen 2.878 N/A HIS 118.A NE2 ASP 183.A OD2 no hydrogen 2.939 N/A SER 119.A N ALA 115.A O no hydrogen 2.907 N/A SER 119.A OG ALA 115.A O no hydrogen 3.133 N/A HIS 120.A N CYS 117.A O no hydrogen 2.920 N/A HIS 120.A ND1 PHE 116.A O no hydrogen 2.764 N/A ARG 121.A N HIS 118.A O no hydrogen 3.220 N/A ARG 121.A NH1 GLU 56.A OE1 no hydrogen 2.787 N/A ARG 121.A NH1 HIS 120.A O no hydrogen 2.800 N/A ARG 121.A NH2 GLU 56.A OE1 no hydrogen 3.033 N/A ARG 121.A NH2 GLU 56.A OE2 no hydrogen 3.430 N/A VAL 122.A N CYS 117.A O no hydrogen 2.900 N/A LEU 123.A N ARG 149.A O no hydrogen 2.883 N/A HIS 124.A N ASP 183.A OD2 no hydrogen 2.885 N/A HIS 124.A NE2 ALA 143.A O no hydrogen 2.895 N/A ARG 125.A N ASP 183.A OD1 no hydrogen 2.861 N/A ARG 125.A NE LEU 147.A O no hydrogen 2.801 N/A ARG 125.A NH1 TYR 178.A OH no hydrogen 2.927 N/A ARG 125.A NH2 LEU 147.A O no hydrogen 2.838 N/A ASP 126.A N HIS 124.A ND1 no hydrogen 3.009 N/A LYS 128.A NZ THR 163.A OG1 no hydrogen 3.040 N/A GLN 130.A N GLN 130.A OE1 no hydrogen 2.677 N/A ASN 131.A N LYS 128.A O no hydrogen 2.793 N/A ASN 131.A ND2 ASP 126.A O no hydrogen 2.849 N/A ASN 131.A ND2 ASP 126.A OD2 no hydrogen 3.255 N/A LEU 132.A N PRO 129.A O no hydrogen 3.167 N/A LEU 133.A N LYS 141.A O no hydrogen 2.987 N/A ILE 134.A N GLN 84.A O no hydrogen 2.740 N/A ASN 135.A N ALA 139.A O no hydrogen 3.199 N/A GLU 137.A N ASN 135.A OD1 no hydrogen 2.849 N/A ALA 139.A N ASN 135.A OD1 no hydrogen 3.008 N/A ILE 140.A N GLN 109.A OE1 no hydrogen 3.118 N/A LYS 141.A N LEU 133.A O no hydrogen 2.812 N/A LYS 141.A NZ GLU 80.A OE1 no hydrogen 2.859 N/A LYS 141.A NZ GLU 80.A OE2 no hydrogen 3.090 N/A LEU 142.A N ASN 61.A O no hydrogen 2.838 N/A ALA 143.A N ASN 131.A O no hydrogen 3.009 N/A ALA 148.A N PHE 145.A O no hydrogen 3.093 N/A ARG 149.A N LEU 123.A O no hydrogen 2.961 N/A PHE 151.A N ARG 121.A O no hydrogen 2.818 N/A GLY 152.A N TYR 158.A OH no hydrogen 3.058 N/A ARG 156.A N TYR 158.A OH no hydrogen 3.255 N/A THR 157.A OG1 LYS 176.A O no hydrogen 2.841 N/A VAL 161.A N HIS 159.A O no hydrogen 3.078 N/A THR 163.A N ASP 126.A OD1 no hydrogen 3.372 N/A THR 163.A OG1 ASP 126.A OD1 no hydrogen 2.863 N/A TRP 165.A NE1 GLY 203.A O no hydrogen 2.868 N/A TYR 166.A N THR 163.A O no hydrogen 2.862 N/A TYR 166.A OH GLU 193.A OE1 no hydrogen 2.616 N/A TYR 166.A OH GLU 193.A OE2 no hydrogen 3.399 N/A ARG 167.A N LEU 164.A O no hydrogen 3.104 N/A ARG 167.A NE VAL 161.A O no hydrogen 3.101 N/A ARG 167.A NE VAL 162.A O no hydrogen 3.029 N/A ARG 167.A NH2 VAL 162.A O no hydrogen 2.885 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.661 N/A ILE 171.A N ALA 168.A O no hydrogen 2.981 N/A LEU 172.A N ALA 168.A O no hydrogen 3.133 N/A LEU 173.A N PRO 169.A O no hydrogen 2.860 N/A GLY 174.A N ILE 171.A O no hydrogen 3.037 N/A CYS 175.A N GLU 170.A O no hydrogen 3.054 N/A CYS 175.A SG TYR 177.A O no hydrogen 2.916 N/A LYS 176.A NZ TYR 177.A OH no hydrogen 3.120 N/A VAL 182.A N SER 179.A O no hydrogen 3.047 N/A ASP 183.A N THR 180.A O no hydrogen 3.022 N/A TRP 185.A N ALA 181.A O no hydrogen 3.078 N/A SER 186.A N VAL 182.A O no hydrogen 3.304 N/A SER 186.A OG TYR 166.A O no hydrogen 2.855 N/A SER 186.A OG VAL 182.A O no hydrogen 3.162 N/A LEU 187.A N ASP 183.A O no hydrogen 2.964 N/A GLY 188.A N ILE 184.A O no hydrogen 2.883 N/A CYS 189.A N TRP 185.A O no hydrogen 3.077 N/A CYS 189.A SG TRP 185.A O no hydrogen 3.534 N/A ILE 190.A N SER 186.A O no hydrogen 2.974 N/A PHE 191.A N LEU 187.A O no hydrogen 2.731 N/A ALA 192.A N GLY 188.A O no hydrogen 3.011 N/A GLU 193.A N CYS 189.A O no hydrogen 2.970 N/A MET 194.A N ILE 190.A O no hydrogen 2.841 N/A VAL 195.A N PHE 191.A O no hydrogen 3.313 N/A THR 196.A N ALA 192.A O no hydrogen 3.044 N/A THR 196.A OG1 ALA 192.A O no hydrogen 3.226 N/A THR 196.A OG1 ARG 198.A O no hydrogen 2.995 N/A ARG 197.A N GLU 193.A O no hydrogen 2.621 N/A ARG 198.A N THR 196.A OG1 no hydrogen 3.170 N/A GLY 203.A N PHE 201.A O no hydrogen 3.014 N/A GLY 203.A N GLN 209.A OE1 no hydrogen 2.760 N/A ASP 204.A N ASP 208.A OD2 no hydrogen 2.730 N/A ASP 208.A N SER 205.A OG no hydrogen 3.213 N/A GLN 209.A N SER 205.A O no hydrogen 2.760 N/A GLN 209.A NE2 TRP 165.A O no hydrogen 3.295 N/A GLN 209.A NE2 PHE 201.A O no hydrogen 2.965 N/A LEU 210.A N GLU 206.A O no hydrogen 2.973 N/A PHE 211.A N ILE 207.A O no hydrogen 2.922 N/A ARG 212.A N ASP 208.A O no hydrogen 2.945 N/A ARG 212.A NE ASP 208.A OD2 no hydrogen 3.265 N/A ILE 213.A N GLN 209.A O no hydrogen 3.161 N/A PHE 214.A N LEU 210.A O no hydrogen 2.859 N/A ARG 215.A N PHE 211.A O no hydrogen 2.975 N/A THR 216.A N ILE 213.A O no hydrogen 3.071 N/A THR 216.A OG1 ARG 212.A O no hydrogen 3.179 N/A LEU 217.A N ILE 213.A O no hydrogen 2.870 N/A THR 219.A N TRP 241.A O no hydrogen 2.976 N/A THR 219.A OG1 PRO 239.A O no hydrogen 2.749 N/A VAL 224.A N ASP 221.A OD1 no hydrogen 2.993 N/A TRP 225.A N ASP 221.A O no hydrogen 2.902 N/A GLY 227.A N GLU 222.A OE1 no hydrogen 2.883 N/A VAL 228.A N TRP 225.A O no hydrogen 2.986 N/A THR 229.A N GLU 222.A OE2 no hydrogen 3.087 N/A THR 229.A OG1 GLU 222.A OE2 no hydrogen 2.568 N/A SER 230.A N GLY 227.A O no hydrogen 2.890 N/A MET 231.A N VAL 228.A O no hydrogen 3.236 N/A ASP 233.A N LEU 173.A O no hydrogen 3.128 N/A TYR 234.A N MET 231.A O no hydrogen 3.057 N/A PHE 238.A N LYS 235.A O no hydrogen 3.066 N/A TRP 241.A N THR 219.A OG1 no hydrogen 2.798 N/A ARG 243.A NH1 LEU 217.A O no hydrogen 3.159 N/A SER 247.A OG ASP 245.A OD2 no hydrogen 2.627 N/A LYS 248.A N ASP 245.A O no hydrogen 2.870 N/A LYS 248.A NZ SER 247.A OG no hydrogen 3.331 N/A VAL 249.A N PHE 246.A O no hydrogen 3.028 N/A LEU 253.A N VAL 250.A O no hydrogen 2.968 N/A GLY 257.A N ASP 254.A OD1 no hydrogen 2.933 N/A ARG 258.A N ASP 254.A O no hydrogen 2.923 N/A ARG 258.A NH1.A LEU 253.A O no hydrogen 2.991 N/A ARG 258.A NH1.C VAL 250.A O no hydrogen 2.747 N/A ARG 258.A NH2.C PRO 251.A O no hydrogen 2.610 N/A SER 259.A N GLU 255.A O no hydrogen 2.931 N/A SER 259.A OG GLN 263.A OE1 no hydrogen 3.178 N/A SER 259.A OG HIS 281.A NE2 no hydrogen 2.823 N/A LEU 260.A N ASP 256.A O no hydrogen 3.032 N/A LEU 261.A N GLY 257.A O no hydrogen 2.875 N/A SER 262.A N ARG 258.A O no hydrogen 2.902 N/A SER 262.A OG ARG 258.A O no hydrogen 3.343 N/A SER 262.A OG SER 259.A O no hydrogen 2.858 N/A GLN 263.A N SER 259.A O no hydrogen 3.121 N/A MET 264.A N LEU 260.A O no hydrogen 2.987 N/A LEU 265.A N LEU 261.A O no hydrogen 3.043 N/A TYR 267.A OH GLY 218.A O no hydrogen 2.552 N/A ASP 268.A N HIS 266.A ND1 no hydrogen 3.226 N/A ASN 270.A N ASP 268.A OD1 no hydrogen 2.933 N/A LYS 271.A N ASP 268.A O no hydrogen 2.834 N/A LYS 271.A NZ ASP 268.A OD2 no hydrogen 3.451 N/A ARG 272.A N ASP 268.A O no hydrogen 2.937 N/A ARG 272.A NE HIS 266.A O no hydrogen 2.866 N/A ARG 272.A NH1 GLU 170.A OE1 no hydrogen 3.463 N/A ARG 272.A NH1 GLU 170.A OE2 no hydrogen 2.793 N/A ARG 272.A NH1 ALA 181.A O no hydrogen 2.831 N/A ARG 272.A NH2 GLU 170.A OE1 no hydrogen 2.857 N/A ARG 272.A NH2 HIS 266.A O no hydrogen 3.256 N/A ARG 272.A NH2 TYR 267.A O no hydrogen 2.967 N/A ILE 273.A N GLN 263.A O no hydrogen 2.964 N/A ALA 277.A N SER 274.A OG no hydrogen 3.003 N/A ALA 278.A N SER 274.A O no hydrogen 2.925 N/A LEU 279.A N ALA 275.A O no hydrogen 3.224 N/A ALA 280.A N ALA 277.A O no hydrogen 3.201 N/A HIS 281.A N ALA 278.A O no hydrogen 2.884 N/A HIS 281.A NE2 SER 259.A OG no hydrogen 2.823 N/A PHE 283.A N HIS 281.A ND1 no hydrogen 2.927 N/A PHE 284.A N HIS 281.A O no hydrogen 2.812 N/A GLN 285.A N PRO 282.A O no hydrogen 3.035 N/A GLN 285.A NE2 PRO 282.A O no hydrogen 3.263 N/A VAL 287.A N PHE 284.A O no hydrogen 2.946 N/A LYS 289.A NZ GLN 109.A OE1 no hydrogen 2.862 N/A HIS 293.A N HIS 293.A ND1 no hydrogen 2.910 N/A