Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w87_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N TYR 300.A O no hydrogen 2.965 N/A SER 1.A OG TYR 300.A O no hydrogen 2.937 N/A LEU 6.A N.A PHE 13.A O no hydrogen 2.683 N/A LEU 6.A N.B PHE 13.A O no hydrogen 2.685 N/A LEU 8.A N HIS 11.A O no hydrogen 2.908 N/A HIS 11.A N LEU 8.A O no hydrogen 2.838 N/A PHE 13.A N LEU 6.A O.A no hydrogen 2.651 N/A PHE 13.A N LEU 6.A O.B no hydrogen 2.677 N/A ASN 15.A ND2 SER 38.A O no hydrogen 2.841 N/A PHE 17.A N ASN 15.A OD1 no hydrogen 2.851 N/A MET 18.A N VAL 270.A O no hydrogen 3.050 N/A ASN 19.A ND2 ALA 20.A O no hydrogen 3.285 N/A ASN 19.A ND2 VAL 23.A O no hydrogen 3.057 N/A ASN 19.A ND2 VAL 43.A O no hydrogen 2.887 N/A ALA 20.A N VAL 272.A O no hydrogen 2.901 N/A VAL 23.A N ALA 20.A O no hydrogen 3.088 N/A CYS 25.A SG VAL 23.A O no hydrogen 3.426 N/A SER 26.A N ASP 30.A OD2 no hydrogen 2.864 N/A THR 27.A N ASP 30.A OD2 no hydrogen 3.128 N/A ASP 30.A N THR 27.A OG1 no hydrogen 2.944 N/A LEU 31.A N THR 27.A O no hydrogen 2.998 N/A ARG 32.A N.A GLU 28.A O no hydrogen 2.859 N/A ARG 32.A N.B GLU 28.A O no hydrogen 2.841 N/A ARG 32.A NE.A GLU 28.A OE2 no hydrogen 3.046 N/A ARG 32.A NH2.A GLU 28.A OE2 no hydrogen 2.827 N/A CYS 33.A N GLU 29.A O no hydrogen 2.885 N/A MET 34.A N ASP 30.A O no hydrogen 2.886 N/A THR 35.A N LEU 31.A O no hydrogen 2.870 N/A THR 35.A OG1 LEU 31.A O no hydrogen 2.898 N/A THR 35.A OG1 TYR 84.A OH no hydrogen 3.202 N/A THR 35.A OG1 HIS 89.A NE2 no hydrogen 3.313 N/A ALA 36.A N ARG 32.A O.A no hydrogen 2.889 N/A ALA 36.A N ARG 32.A O.B no hydrogen 2.917 N/A SER 37.A N CYS 33.A O no hydrogen 3.046 N/A SER 37.A N MET 34.A O no hydrogen 3.268 N/A SER 37.A OG MET 34.A O no hydrogen 2.797 N/A SER 39.A N SER 37.A OG no hydrogen 3.046 N/A SER 39.A OG SER 37.A OG no hydrogen 3.157 N/A SER 39.A OG ALA 41.A O no hydrogen 2.771 N/A GLY 40.A N PHE 17.A O no hydrogen 2.780 N/A ALA 41.A N PHE 17.A O no hydrogen 3.244 N/A LEU 42.A N PRO 95.A O no hydrogen 3.250 N/A VAL 43.A N ASN 19.A OD1 no hydrogen 2.877 N/A SER 44.A N PHE 97.A O no hydrogen 2.957 N/A LYS 45.A N CYS 25.A O no hydrogen 3.008 N/A SER 46.A OG SER 99.A OG no hydrogen 2.564 N/A CYS 47.A N SER 99.A O no hydrogen 3.100 N/A CYS 47.A SG SER 99.A O no hydrogen 3.541 N/A THR 48.A N ASN 75.A OD1 no hydrogen 3.164 N/A THR 48.A OG1 ALA 50.A O no hydrogen 2.673 N/A SER 49.A N GLU 107.A OE2 no hydrogen 3.056 N/A ARG 52.A N ASN 75.A O no hydrogen 2.932 N/A ARG 52.A NE GLY 72.A O no hydrogen 3.183 N/A ARG 52.A NE LEU 73.A O no hydrogen 3.202 N/A ARG 52.A NH2 GLY 72.A O no hydrogen 2.918 N/A ASN 55.A N MET 71.A O no hydrogen 2.897 N/A ASN 55.A ND2 SER 70.A O.A no hydrogen 3.033 N/A ASN 55.A ND2 SER 70.A O.B no hydrogen 2.831 N/A ARG 59.A NH1 ASP 53.A O no hydrogen 2.919 N/A ARG 59.A NH1 ASN 55.A O no hydrogen 2.879 N/A TYR 60.A OH GLU 278.A OE2 no hydrogen 2.744 N/A MET 61.A N ILE 68.A O no hydrogen 3.025 N/A PHE 63.A N GLY 66.A O no hydrogen 2.794 N/A GLY 66.A N PHE 63.A O no hydrogen 3.044 N/A SER 67.A N GLY 223.A O no hydrogen 2.929 N/A SER 67.A OG THR 274.A OG1 no hydrogen 2.755 N/A ILE 68.A N MET 61.A O no hydrogen 2.957 N/A ASN 69.A N GLY 221.A O no hydrogen 2.972 N/A SER 70.A N.A ARG 59.A O no hydrogen 2.840 N/A SER 70.A N.B ARG 59.A O no hydrogen 2.879 N/A SER 70.A OG.B ASN 69.A O no hydrogen 3.096 N/A SER 70.A OG.B PHE 219.A O no hydrogen 2.713 N/A MET 71.A N ASN 69.A OD1 no hydrogen 3.296 N/A ASN 75.A N ARG 52.A O no hydrogen 2.995 N/A ASN 75.A ND2 THR 48.A OG1 no hydrogen 3.007 N/A ASN 75.A ND2 LEU 73.A O no hydrogen 2.947 N/A LEU 76.A N TYR 81.A OH no hydrogen 2.971 N/A GLY 77.A N ASN 75.A OD1 no hydrogen 2.805 N/A PHE 78.A N THR 48.A O no hydrogen 2.789 N/A PHE 80.A N GLY 77.A O no hydrogen 3.101 N/A TYR 81.A N GLY 77.A O no hydrogen 3.377 N/A TYR 81.A OH SER 26.A O no hydrogen 2.626 N/A LEU 82.A N PHE 78.A O no hydrogen 2.866 N/A LYS 83.A N ASP 79.A O no hydrogen 2.958 N/A TYR 84.A N PHE 80.A O no hydrogen 2.858 N/A ALA 85.A N TYR 81.A O no hydrogen 2.895 N/A SER 86.A N.A LEU 82.A O no hydrogen 2.788 N/A SER 86.A N.B LEU 82.A O no hydrogen 2.833 N/A SER 86.A OG.A LEU 82.A O no hydrogen 3.180 N/A SER 86.A OG.A LYS 83.A O no hydrogen 3.450 N/A SER 86.A OG.A ASP 87.A OD1 no hydrogen 3.014 N/A SER 86.A OG.B ASP 87.A OD1 no hydrogen 3.303 N/A ASP 87.A N LYS 83.A O no hydrogen 2.808 N/A LEU 88.A N TYR 84.A O no hydrogen 3.061 N/A HIS 89.A N TYR 84.A O no hydrogen 2.864 N/A TYR 91.A OH ALA 85.A O no hydrogen 2.653 N/A SER 92.A N ASP 90.A OD1 no hydrogen 3.052 N/A SER 92.A OG ASP 90.A OD1 no hydrogen 2.676 N/A SER 92.A OG ASP 90.A OD2 no hydrogen 3.366 N/A LYS 93.A N ASP 90.A O no hydrogen 2.982 N/A LYS 94.A NZ MET 34.A O no hydrogen 2.850 N/A LYS 94.A NZ THR 35.A O no hydrogen 3.134 N/A LYS 94.A NZ SER 37.A O no hydrogen 2.831 N/A LYS 94.A NZ SER 39.A O no hydrogen 2.913 N/A LYS 94.A NZ SER 39.A OG no hydrogen 2.911 N/A PHE 97.A N LEU 42.A O no hydrogen 2.881 N/A LEU 98.A N LEU 125.A O no hydrogen 2.767 N/A SER 99.A N SER 44.A OG no hydrogen 3.204 N/A SER 99.A OG SER 46.A OG no hydrogen 2.564 N/A ILE 100.A N.A GLU 127.A O no hydrogen 3.131 N/A ILE 100.A N.B GLU 127.A O no hydrogen 3.096 N/A SER 101.A N CYS 47.A O no hydrogen 2.891 N/A GLY 102.A N ASN 108.A OD1 no hydrogen 2.796 N/A LEU 103.A N GLU 107.A OE1 no hydrogen 2.484 N/A GLU 107.A N SER 104.A OG no hydrogen 3.044 N/A ASN 108.A N SER 104.A O no hydrogen 3.154 N/A ASN 108.A ND2 GLY 102.A O no hydrogen 2.981 N/A ASN 108.A ND2 SER 104.A O no hydrogen 2.865 N/A VAL 109.A N VAL 105.A O no hydrogen 2.828 N/A ALA 110.A N GLU 106.A O no hydrogen 2.913 N/A MET 111.A N GLU 107.A O no hydrogen 3.049 N/A VAL 112.A N ASN 108.A O no hydrogen 2.915 N/A ARG 113.A N.A VAL 109.A O no hydrogen 3.158 N/A ARG 113.A N.B VAL 109.A O no hydrogen 3.034 N/A ARG 114.A N MET 111.A O no hydrogen 3.106 N/A ARG 114.A NH1 ASP 79.A OD1 no hydrogen 3.011 N/A ARG 114.A NH2 ASP 79.A OD1 no hydrogen 3.177 N/A LEU 115.A N MET 111.A O no hydrogen 2.912 N/A ALA 116.A N VAL 112.A O no hydrogen 3.003 N/A ALA 119.A N LEU 115.A O no hydrogen 2.818 N/A GLN 120.A N ALA 116.A O no hydrogen 2.860 N/A GLU 121.A N PRO 117.A O no hydrogen 2.928 N/A LYS 122.A N VAL 118.A O no hydrogen 2.847 N/A LYS 122.A NZ SER 86.A O.A no hydrogen 3.028 N/A LYS 122.A NZ SER 86.A O.B no hydrogen 2.963 N/A GLY 123.A N ALA 119.A O no hydrogen 2.825 N/A LEU 125.A N LEU 96.A O no hydrogen 2.947 N/A GLU 127.A N LEU 98.A O no hydrogen 2.938 N/A LEU 128.A N GLY 164.A O no hydrogen 2.773 N/A ASN 129.A N ILE 100.A O.A no hydrogen 2.943 N/A ASN 129.A N ILE 100.A O.B no hydrogen 2.881 N/A ASN 129.A ND2 SER 46.A OG no hydrogen 3.126 N/A LEU 130.A N LYS 166.A O no hydrogen 3.111 N/A SER 131.A N ASN 129.A OD1 no hydrogen 3.040 N/A CYS 132.A N.A GLN 140.A OE1.B no hydrogen 2.870 N/A CYS 132.A N.B GLN 140.A OE1.B no hydrogen 2.848 N/A LYS 138.A N VAL 135.A O no hydrogen 2.829 N/A GLN 140.A NE2.B CYS 132.A O.A no hydrogen 2.664 N/A GLN 140.A NE2.B CYS 132.A O.B no hydrogen 2.756 N/A GLN 140.A NE2.B PRO 133.A O no hydrogen 3.416 N/A TYR 143.A N GLN 140.A O.A no hydrogen 2.872 N/A TYR 143.A N GLN 140.A O.B no hydrogen 2.864 N/A TYR 143.A OH PRO 169.A O no hydrogen 2.649 N/A ASP 144.A N VAL 141.A O no hydrogen 2.939 N/A ALA 147.A N ASP 144.A OD1 no hydrogen 3.311 N/A MET 148.A N ASP 144.A O no hydrogen 2.962 N/A ARG 149.A N PHE 145.A O no hydrogen 3.087 N/A ARG 149.A NE GLU 185.A OE1 no hydrogen 3.111 N/A ARG 149.A NE GLU 185.A OE2 no hydrogen 2.964 N/A ARG 149.A NH1 GLU 146.A OE1.A no hydrogen 3.141 N/A ARG 149.A NH2 GLU 185.A OE2 no hydrogen 2.796 N/A THR 150.A N GLU 146.A O.A no hydrogen 3.098 N/A THR 150.A N GLU 146.A O.B no hydrogen 3.314 N/A THR 150.A OG1 GLU 146.A O.A no hydrogen 3.284 N/A THR 150.A OG1 GLU 146.A O.B no hydrogen 3.544 N/A TYR 151.A N ALA 147.A O no hydrogen 3.081 N/A LEU 152.A N MET 148.A O no hydrogen 3.019 N/A GLN 153.A N ARG 149.A O no hydrogen 2.904 N/A GLN 154.A N.A THR 150.A O no hydrogen 2.867 N/A GLN 154.A N.B THR 150.A O no hydrogen 2.791 N/A VAL 155.A N TYR 151.A O no hydrogen 2.827 N/A SER 156.A N LEU 152.A O no hydrogen 3.022 N/A SER 156.A OG LEU 152.A O no hydrogen 2.975 N/A LEU 157.A N GLN 153.A O no hydrogen 3.093 N/A ALA 158.A N GLN 154.A O.A no hydrogen 2.796 N/A ALA 158.A N GLN 154.A O.B no hydrogen 3.242 N/A TYR 159.A N VAL 155.A O no hydrogen 2.773 N/A GLY 160.A N SER 156.A O no hydrogen 2.882 N/A PHE 163.A N LEU 188.A O no hydrogen 2.882 N/A GLY 164.A N LEU 126.A O no hydrogen 2.839 N/A VAL 165.A N.A PHE 191.A O no hydrogen 3.042 N/A VAL 165.A N.B PHE 191.A O no hydrogen 2.998 N/A LYS 166.A N LEU 128.A O no hydrogen 2.844 N/A MET 167.A N THR 193.A O no hydrogen 2.825 N/A TYR 170.A N ASN 234.A OD1 no hydrogen 2.903 N/A TYR 170.A OH ALA 142.A O no hydrogen 2.741 N/A ALA 174.A N ASP 172.A OD1 no hydrogen 2.976 N/A PHE 176.A N ASP 172.A O no hydrogen 3.074 N/A ASP 177.A N ILE 173.A O no hydrogen 2.917 N/A THR 178.A N ALA 174.A O no hydrogen 2.939 N/A THR 178.A OG1 ALA 174.A O no hydrogen 3.107 N/A ALA 179.A N HIS 175.A O no hydrogen 2.789 N/A ALA 180.A N PHE 176.A O no hydrogen 2.955 N/A ALA 181.A N ASP 177.A O no hydrogen 3.094 N/A VAL 182.A N THR 178.A O no hydrogen 2.974 N/A LEU 183.A N ALA 179.A O no hydrogen 3.043 N/A ASN 184.A N ALA 180.A O no hydrogen 2.873 N/A ASN 184.A ND2 ARG 241.A O no hydrogen 2.922 N/A GLU 185.A N VAL 182.A O no hydrogen 2.944 N/A PHE 186.A N LEU 183.A O no hydrogen 3.046 N/A VAL 189.A N PHE 186.A O no hydrogen 3.026 N/A LYS 190.A N PHE 163.A O no hydrogen 2.792 N/A VAL 192.A N LEU 246.A O no hydrogen 2.938 N/A THR 193.A N VAL 165.A O.A no hydrogen 2.937 N/A THR 193.A N VAL 165.A O.B no hydrogen 2.691 N/A THR 193.A OG1 GLU 127.A OE2 no hydrogen 2.837 N/A CYS 194.A N PHE 248.A O no hydrogen 2.898 N/A CYS 194.A SG ASN 234.A O no hydrogen 3.930 N/A VAL 195.A N CYS 250.A O no hydrogen 2.817 N/A ASN 196.A N MET 167.A O no hydrogen 2.822 N/A SER 197.A N ASN 196.A OD1 no hydrogen 2.772 N/A SER 197.A OG ASN 196.A OD1 no hydrogen 3.460 N/A VAL 198.A N LEU 222.A O no hydrogen 2.937 N/A GLY 201.A N GLY 220.A O no hydrogen 2.829 N/A ASP 205.A N SER 210.A O.A no hydrogen 2.829 N/A ASP 205.A N SER 210.A O.B no hydrogen 2.830 N/A SER 208.A N ASP 205.A OD2 no hydrogen 2.868 N/A SER 208.A OG ASP 205.A OD2 no hydrogen 2.764 N/A SER 210.A N.A ASP 205.A O no hydrogen 3.371 N/A SER 210.A N.B ASP 205.A O no hydrogen 3.369 N/A SER 210.A OG.A VAL 211.A O no hydrogen 2.829 N/A SER 210.A OG.B SER 208.A O no hydrogen 2.989 N/A LYS 214.A N PRO 58.A O no hydrogen 2.786 N/A LYS 216.A NZ ASN 200.A OD1 no hydrogen 2.796 N/A GLY 218.A N PRO 215.A O no hydrogen 2.936 N/A PHE 219.A N LYS 216.A O no hydrogen 3.006 N/A GLY 220.A N GLY 201.A O no hydrogen 2.963 N/A GLY 221.A N ASN 69.A O no hydrogen 2.865 N/A LEU 222.A N VAL 198.A O no hydrogen 2.852 N/A GLY 223.A N SER 67.A O no hydrogen 2.996 N/A LYS 225.A N.A TYR 254.A OH no hydrogen 3.315 N/A TYR 226.A N LEU 65.A O no hydrogen 3.019 N/A ILE 227.A N GLY 224.A O no hydrogen 2.949 N/A ALA 231.A N ILE 227.A O no hydrogen 2.853 N/A LEU 232.A N LEU 228.A O no hydrogen 2.877 N/A ALA 233.A N PRO 229.A O no hydrogen 3.045 N/A ASN 234.A N THR 230.A O no hydrogen 3.039 N/A ASN 234.A ND2 TYR 170.A O no hydrogen 3.203 N/A ASN 234.A ND2 THR 230.A O no hydrogen 2.883 N/A VAL 235.A N ALA 231.A O no hydrogen 2.861 N/A ASN 236.A N LEU 232.A O no hydrogen 2.924 N/A ALA 237.A N ALA 233.A O no hydrogen 2.827 N/A PHE 238.A N ASN 234.A O no hydrogen 2.989 N/A TYR 239.A N VAL 235.A O no hydrogen 2.836 N/A ARG 240.A N ASN 236.A O no hydrogen 2.925 N/A ARG 241.A N ALA 237.A O no hydrogen 3.105 N/A ARG 241.A NE ASP 177.A OD1 no hydrogen 2.821 N/A ARG 241.A NH1 ALA 237.A O no hydrogen 3.073 N/A ARG 241.A NH2 ASP 177.A OD1 no hydrogen 2.997 N/A CYS 242.A N PHE 238.A O no hydrogen 2.835 N/A CYS 242.A SG ASN 184.A OD1 no hydrogen 3.568 N/A LYS 245.A N CYS 242.A O no hydrogen 3.050 N/A LYS 245.A NZ LEU 183.A O no hydrogen 3.094 N/A LYS 245.A NZ PHE 186.A O no hydrogen 2.973 N/A LYS 245.A NZ VAL 189.A O no hydrogen 2.773 N/A LEU 246.A N LYS 190.A O no hydrogen 2.903 N/A PHE 248.A N VAL 192.A O no hydrogen 2.788 N/A GLY 249.A N MET 269.A O no hydrogen 2.872 N/A CYS 250.A N CYS 194.A O no hydrogen 2.768 N/A CYS 250.A SG VAL 195.A O no hydrogen 3.650 N/A CYS 250.A SG GLN 271.A OE1 no hydrogen 3.625 N/A TYR 254.A N ASP 258.A OD2 no hydrogen 2.856 N/A GLY 256.A N GLU 290.A OE1 no hydrogen 2.840 N/A ASP 258.A N SER 255.A OG no hydrogen 2.997 N/A ALA 259.A N SER 255.A O no hydrogen 3.063 N/A PHE 260.A N GLY 256.A O no hydrogen 2.793 N/A LEU 261.A N GLU 257.A O no hydrogen 2.987 N/A HIS 262.A N ASP 258.A O no hydrogen 3.059 N/A HIS 262.A NE2 GLY 251.A O no hydrogen 2.912 N/A ILE 263.A N ALA 259.A O no hydrogen 2.927 N/A LEU 264.A N PHE 260.A O no hydrogen 2.858 N/A ALA 265.A N LEU 261.A O no hydrogen 2.936 N/A GLY 266.A N ILE 263.A O no hydrogen 2.896 N/A ALA 267.A N HIS 262.A O no hydrogen 2.886 N/A SER 268.A N VAL 247.A O no hydrogen 2.749 N/A VAL 270.A N PRO 16.A O no hydrogen 2.765 N/A GLN 271.A N GLY 249.A O no hydrogen 2.783 N/A GLN 271.A NE2 GLU 127.A OE2 no hydrogen 3.244 N/A VAL 272.A N MET 18.A O no hydrogen 2.922 N/A THR 274.A OG1 SER 67.A OG no hydrogen 2.755 N/A GLN 277.A N GLY 273.A O no hydrogen 2.887 N/A GLU 278.A N THR 274.A O no hydrogen 2.899 N/A GLU 279.A N ALA 275.A O no hydrogen 2.850 N/A GLY 280.A N LEU 276.A O no hydrogen 2.814 N/A ILE 283.A N GLY 280.A O no hydrogen 3.022 N/A PHE 284.A N PRO 281.A O no hydrogen 3.131 N/A THR 285.A N GLY 282.A O no hydrogen 3.096 N/A THR 285.A OG1 GLY 282.A O no hydrogen 3.038 N/A ARG 286.A NE GLU 279.A OE2 no hydrogen 2.994 N/A ARG 286.A NH1 TYR 254.A O no hydrogen 3.029 N/A ARG 286.A NH1 GLU 290.A OE2 no hydrogen 3.042 N/A ARG 286.A NH2 TYR 254.A O no hydrogen 2.802 N/A ARG 286.A NH2 GLU 279.A OE1 no hydrogen 2.835 N/A LEU 287.A N ILE 283.A O no hydrogen 2.829 N/A GLU 288.A N PHE 284.A O no hydrogen 3.093 N/A ASP 289.A N THR 285.A O no hydrogen 2.969 N/A GLU 290.A N ARG 286.A O no hydrogen 2.910 N/A LEU 291.A N LEU 287.A O no hydrogen 2.865 N/A LEU 292.A N GLU 288.A O no hydrogen 2.925 N/A GLU 293.A N ASP 289.A O no hydrogen 2.992 N/A ILE 294.A N GLU 290.A O no hydrogen 3.097 N/A MET 295.A N LEU 291.A O no hydrogen 2.944 N/A ALA 296.A N LEU 292.A O no hydrogen 2.872 N/A ARG 297.A N GLU 293.A O no hydrogen 2.982 N/A ARG 297.A NH1 GLU 293.A OE1 no hydrogen 2.972 N/A LYS 298.A N ILE 294.A O no hydrogen 3.090 N/A GLY 299.A N ALA 296.A O no hydrogen 3.164 N/A TYR 300.A N MET 295.A O no hydrogen 2.927 N/A ARG 301.A N GLU 305.A OE1 no hydrogen 2.832 N/A THR 302.A N GLU 305.A OE1 no hydrogen 3.321 N/A GLU 305.A N THR 302.A OG1 no hydrogen 3.035 N/A PHE 306.A N LEU 303.A O no hydrogen 3.055 N/A ARG 307.A N LEU 303.A O no hydrogen 2.900 N/A ARG 307.A NE ALA 267.A O no hydrogen 3.020 N/A GLY 308.A N ILE 263.A O no hydrogen 2.891 N/A ARG 309.A N PHE 306.A O no hydrogen 2.994 N/A VAL 310.A N LEU 264.A O no hydrogen 3.110 N/A THR 312.A OG1 GLU 314.A OE2.B no hydrogen 2.892 N/A