Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wnp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N PHE 10.A O no hydrogen 2.769 N/A VAL 5.A N PHE 8.A O no hydrogen 2.897 N/A PHE 8.A N VAL 5.A O no hydrogen 2.872 N/A GLU 9.A N ARG 28.A O no hydrogen 2.775 N/A PHE 10.A N GLU 3.A O no hydrogen 2.916 N/A SER 11.A OG ASP 14.A OD2 no hydrogen 2.899 N/A ARG 12.A NE GLU 3.A OE2 no hydrogen 2.489 N/A ARG 12.A NH2 GLU 3.A OE1 no hydrogen 3.152 N/A LYS 13.A NZ ASP 14.A OD1 no hydrogen 2.427 N/A ASP 14.A N SER 11.A O no hydrogen 3.090 N/A ILE 16.A N VAL 24.A O no hydrogen 2.727 N/A GLY 17.A N VAL 24.A O no hydrogen 3.156 N/A GLY 19.A N ALA 22.A O no hydrogen 2.861 N/A VAL 23.A N.A CYS 41.A O no hydrogen 2.858 N/A VAL 23.A N.B CYS 41.A O no hydrogen 2.876 N/A VAL 24.A N GLY 17.A O no hydrogen 2.769 N/A PHE 25.A N VAL 39.A O no hydrogen 2.942 N/A LYS 26.A N ASP 14.A O no hydrogen 2.918 N/A LYS 26.A NZ GLU 36.A OE2 no hydrogen 2.672 N/A LYS 26.A NZ TYR 88.A OH no hydrogen 3.343 N/A GLY 27.A N VAL 37.A O no hydrogen 2.947 N/A ARG 28.A N GLU 9.A O no hydrogen 2.828 N/A ARG 28.A NE GLU 9.A OE2 no hydrogen 2.735 N/A ARG 28.A NH1 GLU 9.A OE2 no hydrogen 2.979 N/A HIS 29.A N LEU 35.A O no hydrogen 3.032 N/A ARG 30.A N LYS 7.A O no hydrogen 2.708 N/A ARG 30.A NH1 GLY 6.A O no hydrogen 2.821 N/A ALA 31.A N HIS 29.A ND1 no hydrogen 2.869 N/A ALA 32.A N HIS 29.A ND1 no hydrogen 3.127 N/A LEU 35.A N ALA 32.A O no hydrogen 2.842 N/A VAL 37.A N GLY 27.A O no hydrogen 2.985 N/A ALA 38.A N MET 86.A O no hydrogen 2.892 N/A VAL 39.A N PHE 25.A O no hydrogen 2.760 N/A LYS 40.A N LEU 84.A O no hydrogen 2.866 N/A LYS 40.A NZ GLU 57.A OE1 no hydrogen 2.499 N/A LYS 40.A NZ GLU 57.A OE2 no hydrogen 3.238 N/A CYS 41.A N VAL 23.A O.A no hydrogen 2.728 N/A CYS 41.A N VAL 23.A O.B no hydrogen 2.820 N/A CYS 41.A SG VAL 23.A O.B no hydrogen 3.841 N/A CYS 41.A SG VAL 39.A O no hydrogen 3.861 N/A ASN 43.A N SER 50.A OG no hydrogen 2.936 N/A ASN 43.A ND2 GLY 19.A O no hydrogen 2.582 N/A LYS 45.A N ASN 43.A OD1 no hydrogen 2.860 N/A ASN 46.A N ASN 43.A O no hydrogen 2.992 N/A ASN 46.A ND2 ALA 20.A O no hydrogen 3.072 N/A SER 50.A N ASN 46.A O no hydrogen 2.932 N/A SER 50.A OG PHE 21.A O no hydrogen 2.444 N/A GLN 51.A N LEU 47.A O no hydrogen 2.877 N/A GLN 51.A NE2 ALA 79.A O no hydrogen 2.727 N/A THR 52.A N ALA 48.A O no hydrogen 3.088 N/A THR 52.A OG1 ALA 48.A O no hydrogen 2.946 N/A LEU 53.A N LYS 49.A O no hydrogen 2.900 N/A LEU 54.A N SER 50.A O no hydrogen 2.995 N/A GLY 55.A N GLN 51.A O no hydrogen 3.069 N/A LYS 56.A N THR 52.A O no hydrogen 3.045 N/A GLU 57.A N LEU 53.A O no hydrogen 2.914 N/A ILE 58.A N LEU 54.A O no hydrogen 2.989 N/A LYS 59.A N GLY 55.A O no hydrogen 3.174 N/A ILE 60.A N LYS 56.A O no hydrogen 3.094 N/A LEU 61.A N GLU 57.A O no hydrogen 2.833 N/A LYS 62.A N ILE 58.A O no hydrogen 3.015 N/A GLU 63.A N ILE 60.A O no hydrogen 2.906 N/A LEU 64.A N LEU 61.A O no hydrogen 3.182 N/A ASN 68.A N HIS 66.A ND1 no hydrogen 2.884 N/A ASN 68.A ND2 GLN 115.A OE1 no hydrogen 3.014 N/A ASN 68.A ND2 VAL 155.A O no hydrogen 2.800 N/A ILE 69.A N HIS 66.A O no hydrogen 3.200 N/A VAL 70.A N ILE 157.A O no hydrogen 3.017 N/A ALA 71.A N GLU 87.A OE1 no hydrogen 2.946 N/A TYR 73.A N VAL 85.A O no hydrogen 2.805 N/A ASP 74.A N VAL 85.A O no hydrogen 3.377 N/A PHE 75.A N ASP 74.A OD1 no hydrogen 2.621 N/A GLN 76.A N TYR 83.A O no hydrogen 2.829 N/A MET 78.A N SER 81.A O no hydrogen 2.812 N/A TYR 83.A N GLN 76.A O no hydrogen 2.915 N/A LEU 84.A N LYS 40.A O no hydrogen 2.872 N/A VAL 85.A N ASP 74.A O no hydrogen 2.796 N/A MET 86.A N ALA 38.A O no hydrogen 2.819 N/A GLU 87.A N ALA 71.A O no hydrogen 2.861 N/A ASN 90.A ND2 ASN 142.A O no hydrogen 3.093 N/A GLY 91.A N LEU 140.A O no hydrogen 2.773 N/A LEU 94.A N ILE 138.A O no hydrogen 2.805 N/A ASP 96.A N ASP 93.A OD1 no hydrogen 2.841 N/A TYR 97.A N ASP 93.A O no hydrogen 3.096 N/A LEU 98.A N LEU 94.A O no hydrogen 2.851 N/A HIS 99.A N ALA 95.A O no hydrogen 3.028 N/A ALA 100.A N ASP 96.A O no hydrogen 3.032 N/A MET 101.A N TYR 97.A O no hydrogen 2.900 N/A ARG 102.A N LEU 98.A O no hydrogen 2.731 N/A LEU 104.A N CYS 207.A O no hydrogen 2.903 N/A SER 105.A OG THR 108.A OG1 no hydrogen 3.161 N/A THR 108.A N SER 105.A OG no hydrogen 3.260 N/A THR 108.A OG1 SER 105.A OG no hydrogen 3.161 N/A ILE 109.A N SER 105.A O no hydrogen 2.954 N/A ARG 110.A N GLU 106.A O no hydrogen 2.881 N/A ARG 110.A NE PHE 270.A O no hydrogen 2.796 N/A ARG 110.A NH1 ASP 107.A OD1 no hydrogen 2.901 N/A LEU 111.A N ASP 107.A O no hydrogen 3.053 N/A PHE 112.A N THR 108.A O no hydrogen 2.896 N/A LEU 113.A N ILE 109.A O no hydrogen 2.792 N/A GLN 114.A N ARG 110.A O no hydrogen 2.871 N/A GLN 114.A NE2 LEU 271.A O no hydrogen 2.745 N/A GLN 115.A NE2 LEU 111.A O no hydrogen 3.226 N/A GLN 115.A NE2 ILE 153.A O no hydrogen 3.195 N/A ILE 116.A N PHE 112.A O no hydrogen 2.917 N/A ALA 117.A N LEU 113.A O no hydrogen 2.794 N/A GLY 118.A N GLN 114.A O no hydrogen 3.074 N/A ALA 119.A N GLN 115.A O no hydrogen 3.205 N/A MET 120.A N ILE 116.A O no hydrogen 2.834 N/A ARG 121.A N ALA 117.A O no hydrogen 2.838 N/A LEU 122.A N GLY 118.A O no hydrogen 3.395 N/A LEU 123.A N ALA 119.A O no hydrogen 3.080 N/A HIS 124.A N MET 120.A O no hydrogen 2.909 N/A SER 125.A N ARG 121.A O no hydrogen 2.970 N/A SER 125.A OG ARG 121.A O no hydrogen 3.287 N/A SER 125.A OG LEU 122.A O no hydrogen 2.929 N/A LYS 126.A N LEU 122.A O no hydrogen 3.003 N/A GLY 127.A N HIS 124.A O no hydrogen 3.086 N/A ILE 128.A N LEU 123.A O no hydrogen 2.917 N/A ILE 129.A N ARG 164.A O no hydrogen 2.916 N/A HIS 130.A N ASP 196.A OD2 no hydrogen 2.884 N/A HIS 130.A NE2 ALA 158.A O no hydrogen 2.940 N/A ARG 131.A N ASP 196.A OD1 no hydrogen 2.952 N/A ARG 131.A NE PHE 162.A O no hydrogen 2.918 N/A ARG 131.A NH1 TYR 191.A OH no hydrogen 2.794 N/A ARG 131.A NH2 PHE 162.A O no hydrogen 3.158 N/A ASP 132.A N HIS 130.A ND1 no hydrogen 2.944 N/A LYS 134.A NZ SER 177.A OG no hydrogen 3.033 N/A GLN 136.A N GLN 136.A OE1 no hydrogen 2.680 N/A ASN 137.A N LYS 134.A O no hydrogen 2.921 N/A ASN 137.A ND2 ASP 132.A O no hydrogen 2.802 N/A ASN 137.A ND2 ASP 132.A OD2 no hydrogen 2.981 N/A ILE 138.A N PRO 135.A O no hydrogen 3.159 N/A LEU 139.A N LYS 156.A O no hydrogen 2.844 N/A LEU 140.A N GLY 92.A O no hydrogen 2.780 N/A SER 141.A N ARG 154.A O no hydrogen 2.811 N/A ASN 142.A N ASN 90.A OD1 no hydrogen 2.797 N/A ASN 142.A ND2 GLY 145.A O no hydrogen 2.846 N/A GLY 145.A N ASN 142.A O no hydrogen 2.942 N/A ARG 147.A N ALA 144.A O no hydrogen 3.134 N/A SER 152.A N ASN 149.A O no hydrogen 3.040 N/A SER 152.A OG ASN 149.A O no hydrogen 3.177 N/A ILE 153.A N PRO 150.A O no hydrogen 3.105 N/A ARG 154.A N SER 141.A O no hydrogen 2.918 N/A VAL 155.A N GLN 115.A OE1 no hydrogen 2.769 N/A LYS 156.A N LEU 139.A O no hydrogen 2.835 N/A LYS 156.A NZ GLU 67.A O no hydrogen 2.935 N/A LYS 156.A NZ GLU 87.A OE2 no hydrogen 2.606 N/A ILE 157.A N ASN 68.A O no hydrogen 2.852 N/A ALA 158.A N ASN 137.A O no hydrogen 2.790 N/A PHE 160.A N GLU 57.A OE2 no hydrogen 2.802 N/A ALA 163.A N PHE 160.A O no hydrogen 3.051 N/A ARG 164.A N ILE 129.A O no hydrogen 3.022 N/A ARG 164.A NE TYR 165.A O no hydrogen 2.891 N/A ARG 164.A NH1 TYR 165.A O no hydrogen 3.476 N/A LEU 166.A N GLY 127.A O no hydrogen 2.896 N/A GLN 167.A NE2 ASN 169.A OD1 no hydrogen 2.908 N/A MET 170.A N.A GLN 167.A O no hydrogen 2.963 N/A MET 170.A N.B GLN 167.A O no hydrogen 2.968 N/A ALA 172.A N TYR 191.A O no hydrogen 2.838 N/A SER 177.A OG ASP 132.A OD1 no hydrogen 3.453 N/A TYR 180.A N SER 177.A O no hydrogen 2.709 N/A TYR 180.A OH GLN 206.A OE1 no hydrogen 2.530 N/A MET 181.A N PRO 178.A O no hydrogen 3.317 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.821 N/A VAL 185.A N ALA 182.A O no hydrogen 2.900 N/A ILE 186.A N ALA 182.A O no hydrogen 3.089 N/A MET 187.A N PRO 183.A O no hydrogen 2.869 N/A SER 188.A N VAL 185.A O no hydrogen 2.995 N/A GLN 189.A N GLU 184.A O no hydrogen 2.841 N/A TYR 191.A N ALA 172.A O no hydrogen 2.911 N/A LYS 194.A N ASP 192.A OD1 no hydrogen 2.902 N/A LYS 194.A NZ HIS 256.A O no hydrogen 2.856 N/A LYS 194.A NZ ARG 259.A O no hydrogen 3.057 N/A ALA 195.A N ASP 192.A O no hydrogen 3.042 N/A ASP 196.A N GLY 193.A O no hydrogen 3.106 N/A TRP 198.A N LYS 194.A O no hydrogen 3.190 N/A SER 199.A N ALA 195.A O no hydrogen 3.178 N/A SER 199.A OG TYR 180.A O no hydrogen 2.590 N/A SER 199.A OG ALA 195.A O no hydrogen 3.322 N/A ILE 200.A N ASP 196.A O no hydrogen 2.921 N/A GLY 201.A N LEU 197.A O no hydrogen 2.992 N/A THR 202.A N TRP 198.A O no hydrogen 2.957 N/A THR 202.A OG1 SER 199.A O no hydrogen 2.609 N/A ILE 203.A N SER 199.A O no hydrogen 3.024 N/A VAL 204.A N ILE 200.A O no hydrogen 2.867 N/A TYR 205.A N GLY 201.A O no hydrogen 2.945 N/A TYR 205.A OH THR 235.A O no hydrogen 2.445 N/A GLN 206.A N THR 202.A O no hydrogen 2.940 N/A CYS 207.A N ILE 203.A O no hydrogen 2.948 N/A CYS 207.A SG ILE 203.A O no hydrogen 3.449 N/A LEU 208.A N VAL 204.A O no hydrogen 3.035 N/A THR 209.A N TYR 205.A O no hydrogen 2.906 N/A THR 209.A OG1 TYR 205.A O no hydrogen 3.030 N/A GLY 210.A N GLN 206.A O no hydrogen 2.664 N/A LYS 211.A N THR 209.A OG1 no hydrogen 3.056 N/A SER 217.A OG ASP 221.A OD2 no hydrogen 2.751 N/A SER 218.A OG GLN 220.A OE1 no hydrogen 3.207 N/A ASP 221.A N SER 218.A OG no hydrogen 3.153 N/A LEU 222.A N SER 218.A O no hydrogen 2.963 N/A ARG 223.A N PRO 219.A O no hydrogen 2.838 N/A LEU 224.A N GLN 220.A O no hydrogen 2.922 N/A PHE 225.A N ASP 221.A O no hydrogen 3.023 N/A TYR 226.A N LEU 222.A O no hydrogen 2.961 N/A GLU 227.A N ARG 223.A O no hydrogen 2.789 N/A LYS 228.A N LEU 224.A O no hydrogen 2.942 N/A ASN 229.A N PHE 225.A O no hydrogen 3.065 N/A ASN 229.A ND2 PHE 225.A O no hydrogen 2.779 N/A GLU 239.A N GLU 239.A OE1 no hydrogen 2.766 N/A THR 240.A N PRO 237.A O no hydrogen 3.174 N/A THR 240.A OG1 PRO 237.A O no hydrogen 2.836 N/A SER 241.A N GLU 106.A OE2 no hydrogen 2.769 N/A SER 241.A OG GLU 106.A OE1 no hydrogen 2.601 N/A ARG 245.A N SER 241.A O no hydrogen 2.998 N/A ARG 245.A NH1 THR 240.A O no hydrogen 3.156 N/A ARG 245.A NH2 PRO 237.A O no hydrogen 2.887 N/A ARG 245.A NH2 ARG 238.A O no hydrogen 3.179 N/A GLN 246.A N ALA 242.A O no hydrogen 2.860 N/A LEU 247.A N PRO 243.A O no hydrogen 3.085 N/A LEU 248.A N LEU 244.A O no hydrogen 2.950 N/A LEU 249.A N ARG 245.A O no hydrogen 3.036 N/A ALA 250.A N GLN 246.A O no hydrogen 2.985 N/A LEU 251.A N LEU 247.A O no hydrogen 2.966 N/A LEU 252.A N LEU 248.A O no hydrogen 2.828 N/A GLN 253.A NE2 LEU 249.A O no hydrogen 2.848 N/A ARG 254.A NE TYR 226.A O no hydrogen 2.890 N/A ARG 254.A NH1 ASN 255.A OD1 no hydrogen 3.149 N/A ARG 254.A NH2 TYR 226.A O no hydrogen 2.734 N/A ASN 255.A ND2 ASP 258.A OD2 no hydrogen 3.520 N/A ASP 258.A N ASN 255.A O no hydrogen 2.893 N/A ARG 259.A N ASN 255.A O no hydrogen 3.113 N/A ARG 259.A N HIS 256.A O no hydrogen 3.283 N/A ARG 259.A NE GLN 253.A O no hydrogen 2.943 N/A ARG 259.A NH1 GLU 184.A OE1 no hydrogen 3.528 N/A ARG 259.A NH1 GLU 184.A OE2 no hydrogen 2.661 N/A ARG 259.A NH1 LYS 194.A O no hydrogen 3.024 N/A ARG 259.A NH2 GLU 184.A OE1 no hydrogen 2.871 N/A ARG 259.A NH2 GLN 253.A O no hydrogen 2.925 N/A MET 260.A N ALA 250.A O no hydrogen 3.012 N/A ASP 261.A N GLU 264.A OE1 no hydrogen 3.013 N/A GLU 264.A N ASP 261.A OD1 no hydrogen 3.123 N/A PHE 265.A N ASP 261.A O no hydrogen 2.909 N/A PHE 266.A N PHE 262.A O no hydrogen 2.822 N/A HIS 267.A N ASP 263.A O no hydrogen 3.157 N/A HIS 267.A ND1 ASP 263.A O no hydrogen 2.967 N/A HIS 268.A N PHE 265.A O no hydrogen 3.234 N/A HIS 268.A NE2 GLN 246.A OE1 no hydrogen 2.938 N/A PHE 270.A N HIS 268.A ND1 no hydrogen 3.030 N/A LEU 271.A N HIS 268.A O no hydrogen 2.953 N/A ASP 272.A N PRO 269.A O no hydrogen 2.771 N/A ALA 273.A N PRO 269.A O no hydrogen 3.055 N/A