Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wp4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 54.A OE1 no hydrogen 3.035 N/A VAL 3.A N PRO 24.A O no hydrogen 3.149 N/A ALA 4.A N VAL 57.A O no hydrogen 2.970 N/A PHE 5.A N LEU 26.A O no hydrogen 2.876 N/A ILE 6.A N PHE 59.A O no hydrogen 2.767 N/A GLY 7.A N TRP 28.A O no hydrogen 3.314 N/A LEU 8.A N ASN 29.A OD1 no hydrogen 2.915 N/A TYR 13.A N GLY 9.A O no hydrogen 2.884 N/A TYR 13.A OH GLU 41.A OE1 no hydrogen 2.576 N/A MET 15.A N MET 11.A O no hydrogen 3.038 N/A ALA 16.A N GLY 12.A O no hydrogen 2.881 N/A GLY 17.A N TYR 13.A O no hydrogen 3.224 N/A HIS 18.A N PRO 14.A O no hydrogen 3.280 N/A HIS 18.A N MET 15.A O no hydrogen 3.210 N/A HIS 18.A NE2 ALA 122.A O no hydrogen 2.804 N/A HIS 18.A NE2 GLU 123.A O no hydrogen 2.995 N/A LEU 19.A N MET 15.A O no hydrogen 3.402 N/A ALA 20.A N ALA 16.A O no hydrogen 2.882 N/A ARG 21.A N HIS 18.A O no hydrogen 3.386 N/A ARG 21.A NH2 ALA 146.A O no hydrogen 3.280 N/A ARG 22.A N LEU 19.A O no hydrogen 2.938 N/A PHE 23.A N LEU 19.A O no hydrogen 2.778 N/A THR 25.A OG1 PHE 23.A O no hydrogen 2.835 N/A LEU 26.A N VAL 3.A O no hydrogen 2.981 N/A VAL 27.A N GLU 45.A O no hydrogen 2.899 N/A TRP 28.A N PHE 5.A O no hydrogen 3.166 N/A ASN 29.A ND2 THR 31.A O no hydrogen 3.033 N/A LYS 34.A N THR 31.A O no hydrogen 2.974 N/A LEU 36.A N PHE 32.A O no hydrogen 3.045 N/A ARG 37.A N GLU 33.A O no hydrogen 2.864 N/A HIS 38.A N LYS 34.A O no hydrogen 2.822 N/A HIS 38.A ND1 SER 44.A OG no hydrogen 2.811 N/A HIS 38.A NE2 TYR 13.A O no hydrogen 2.924 N/A GLN 39.A N ALA 35.A O no hydrogen 2.881 N/A GLU 40.A N LEU 36.A O no hydrogen 3.100 N/A GLU 41.A N ARG 37.A O no hydrogen 3.057 N/A PHE 42.A N HIS 38.A O no hydrogen 2.855 N/A GLY 43.A N GLN 39.A O no hydrogen 2.833 N/A SER 44.A OG HIS 38.A ND1 no hydrogen 2.811 N/A GLU 45.A N THR 25.A O no hydrogen 2.724 N/A ALA 46.A N GLN 39.A OE1 no hydrogen 2.788 N/A VAL 47.A N VAL 27.A O no hydrogen 3.027 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.736 N/A ARG 51.A N PRO 48.A O no hydrogen 3.030 N/A ARG 51.A NE GLU 54.A OE2 no hydrogen 2.648 N/A ARG 51.A NH1 GLU 45.A OE2 no hydrogen 2.745 N/A ARG 51.A NH2 GLU 54.A OE1 no hydrogen 2.960 N/A ARG 51.A NH2 GLU 54.A OE2 no hydrogen 3.302 N/A VAL 52.A N LEU 49.A O no hydrogen 2.911 N/A ALA 53.A N GLU 50.A O no hydrogen 3.394 N/A GLU 54.A N ARG 51.A O no hydrogen 2.884 N/A ALA 55.A N VAL 52.A O no hydrogen 3.083 N/A ARG 56.A N LYS 2.A O no hydrogen 2.820 N/A ARG 56.A NE GLU 1.A OE1 no hydrogen 3.030 N/A ARG 56.A NH1 GLY 82.A O no hydrogen 3.354 N/A ILE 58.A N TYR 84.A O no hydrogen 2.661 N/A PHE 59.A N ALA 4.A O no hydrogen 2.714 N/A THR 60.A N VAL 86.A O no hydrogen 3.133 N/A THR 60.A OG1 ASP 87.A OD1 no hydrogen 2.727 N/A CYS 61.A N ILE 6.A O no hydrogen 3.193 N/A CYS 61.A SG ALA 88.A O no hydrogen 3.909 N/A LEU 62.A N THR 89.A OG1 no hydrogen 2.875 N/A THR 64.A N GLU 67.A OE1 no hydrogen 2.786 N/A THR 64.A OG1 GLU 67.A OE1 no hydrogen 2.638 N/A ARG 66.A N THR 64.A OG1 no hydrogen 3.287 N/A VAL 68.A N THR 64.A O no hydrogen 3.303 N/A TYR 69.A N THR 65.A O no hydrogen 2.791 N/A GLU 70.A N ARG 66.A O no hydrogen 3.079 N/A VAL 71.A N GLU 67.A O no hydrogen 3.170 N/A ALA 72.A N VAL 68.A O no hydrogen 2.991 N/A GLU 73.A N TYR 69.A O no hydrogen 2.915 N/A ALA 74.A N GLU 70.A O no hydrogen 3.054 N/A LEU 75.A N VAL 71.A O no hydrogen 2.957 N/A TYR 76.A N ALA 72.A O no hydrogen 2.804 N/A TYR 76.A OH GLU 105.A OE1 no hydrogen 2.579 N/A TYR 78.A N LEU 75.A O no hydrogen 2.675 N/A LEU 79.A N LEU 75.A O no hydrogen 3.036 N/A ARG 80.A NE ALA 53.A O no hydrogen 2.813 N/A ARG 80.A NH2 ALA 53.A O no hydrogen 3.247 N/A GLY 82.A N GLY 107.A O no hydrogen 2.993 N/A THR 83.A N ARG 80.A O no hydrogen 3.366 N/A THR 83.A OG1 ALA 55.A O no hydrogen 3.447 N/A THR 83.A OG1 ARG 80.A O no hydrogen 3.007 N/A TYR 84.A N ARG 56.A O no hydrogen 2.822 N/A TRP 85.A N THR 109.A O no hydrogen 2.896 N/A TRP 85.A NE1 THR 60.A OG1 no hydrogen 3.005 N/A VAL 86.A N ILE 58.A O no hydrogen 2.729 N/A ASP 87.A N LEU 111.A O no hydrogen 2.991 N/A ALA 88.A N THR 60.A O no hydrogen 2.704 N/A THR 89.A N ASP 87.A OD1 no hydrogen 3.208 N/A THR 89.A OG1 LEU 62.A O no hydrogen 3.424 N/A THR 89.A OG1 ASP 87.A OD1 no hydrogen 2.808 N/A GLY 91.A N HIS 161.A ND1 no hydrogen 3.000 N/A GLU 92.A N THR 65.A OG1 no hydrogen 2.882 N/A SER 96.A N GLU 92.A O no hydrogen 2.986 N/A SER 96.A OG GLU 92.A O no hydrogen 2.767 N/A SER 96.A OG TYR 110.A OH no hydrogen 3.380 N/A ARG 97.A N PRO 93.A O no hydrogen 2.990 N/A ARG 97.A NE GLU 94.A OE1 no hydrogen 3.139 N/A ARG 97.A NH2 GLU 94.A OE1 no hydrogen 2.613 N/A ARG 98.A N GLU 94.A O no hydrogen 3.033 N/A LEU 99.A N ALA 95.A O no hydrogen 2.924 N/A ALA 100.A N SER 96.A O no hydrogen 2.935 N/A GLU 101.A N ARG 97.A O no hydrogen 3.246 N/A ARG 102.A N ARG 98.A O no hydrogen 3.030 N/A ARG 102.A NE GLU 73.A OE2 no hydrogen 2.919 N/A ARG 102.A NH1 GLU 105.A OE1 no hydrogen 2.951 N/A ARG 102.A NH2 GLU 73.A OE1 no hydrogen 3.027 N/A LEU 103.A N LEU 99.A O no hydrogen 2.884 N/A ARG 104.A N ALA 100.A O no hydrogen 3.008 N/A GLU 105.A N ARG 102.A O no hydrogen 3.224 N/A LYS 106.A N LEU 103.A O no hydrogen 2.968 N/A GLY 107.A N ARG 104.A O no hydrogen 2.996 N/A VAL 108.A N LEU 103.A O no hydrogen 3.083 N/A THR 109.A N THR 83.A O no hydrogen 2.935 N/A TYR 110.A OH ASP 87.A OD2 no hydrogen 2.583 N/A TYR 110.A OH SER 96.A OG no hydrogen 3.380 N/A TYR 110.A OH HIS 161.A NE2 no hydrogen 3.001 N/A LEU 111.A N TRP 85.A O no hydrogen 2.906 N/A ASP 112.A N ASP 112.A OD2 no hydrogen 2.484 N/A ASP 112.A N GLY 132.A O no hydrogen 3.147 N/A ALA 113.A N ASP 87.A O no hydrogen 2.672 N/A SER 116.A N THR 128.A O no hydrogen 3.057 N/A SER 120.A OG GLY 117.A O no hydrogen 3.479 N/A GLY 121.A N GLY 117.A O no hydrogen 2.962 N/A ALA 122.A N GLY 118.A O no hydrogen 2.939 N/A GLU 123.A N THR 119.A O no hydrogen 2.907 N/A ALA 124.A N SER 120.A O no hydrogen 2.973 N/A GLY 125.A N GLY 121.A O no hydrogen 2.746 N/A THR 126.A N GLY 121.A O no hydrogen 3.020 N/A LEU 127.A N TYR 147.A O no hydrogen 3.145 N/A THR 128.A N SER 116.A O no hydrogen 2.986 N/A VAL 129.A N LYS 150.A O no hydrogen 2.746 N/A MET 130.A N PRO 114.A O no hydrogen 3.222 N/A LEU 131.A N VAL 152.A O no hydrogen 2.794 N/A GLY 132.A N ASP 112.A O no hydrogen 2.953 N/A GLY 133.A N GLY 155.A O no hydrogen 2.808 N/A VAL 138.A N PRO 134.A O no hydrogen 3.027 N/A GLU 139.A N GLU 135.A O no hydrogen 3.134 N/A ARG 140.A N GLU 136.A O no hydrogen 3.318 N/A ARG 140.A NH1 GLU 1.A OE2 no hydrogen 2.797 N/A ARG 140.A NH2 GLU 1.A OE1 no hydrogen 3.183 N/A ARG 140.A NH2 GLU 1.A OE2 no hydrogen 3.073 N/A VAL 141.A N ALA 137.A O no hydrogen 2.981 N/A ARG 142.A N VAL 138.A O no hydrogen 2.995 N/A ARG 142.A NH1 VAL 151.A O no hydrogen 3.476 N/A PHE 144.A N VAL 141.A O no hydrogen 2.754 N/A LEU 145.A N ARG 142.A O no hydrogen 3.180 N/A ALA 146.A N PHE 144.A O no hydrogen 2.829 N/A ALA 148.A N LEU 145.A O no hydrogen 3.155 N/A LYS 149.A N LEU 127.A O no hydrogen 2.818 N/A VAL 152.A N VAL 129.A O no hydrogen 2.794 N/A HIS 153.A NE2 GLY 133.A O no hydrogen 2.759 N/A VAL 154.A N LEU 131.A O no hydrogen 2.921 N/A GLY 158.A N ASP 112.A OD1 no hydrogen 2.843 N/A GLY 158.A N ASP 112.A OD2 no hydrogen 2.886 N/A ALA 159.A N PRO 156.A O no hydrogen 2.939 N/A HIS 161.A N ASP 112.A OD1 no hydrogen 3.110 N/A HIS 161.A NE2 TYR 110.A OH no hydrogen 3.001 N/A ALA 162.A N GLY 158.A O no hydrogen 3.070 N/A VAL 163.A N ALA 159.A O no hydrogen 3.043 N/A LYS 164.A N GLY 160.A O no hydrogen 2.961 N/A LYS 164.A NZ VAL 115.A O no hydrogen 2.658 N/A LYS 164.A NZ ASN 168.A OD1 no hydrogen 2.901 N/A ALA 165.A N HIS 161.A O no hydrogen 2.982 N/A ILE 166.A N ALA 162.A O no hydrogen 3.034 N/A ASN 167.A N VAL 163.A O no hydrogen 2.785 N/A ASN 167.A ND2 ASN 168.A OD1 no hydrogen 3.011 N/A ASN 168.A N LYS 164.A O no hydrogen 2.924 N/A ALA 169.A N ALA 165.A O no hydrogen 2.986 N/A LEU 170.A N ILE 166.A O no hydrogen 3.035 N/A LEU 171.A N ASN 167.A O no hydrogen 3.015 N/A ALA 172.A N ASN 168.A O no hydrogen 2.995 N/A VAL 173.A N ALA 169.A O no hydrogen 3.065 N/A ASN 174.A N LEU 170.A O no hydrogen 2.914 N/A LEU 175.A N LEU 171.A O no hydrogen 2.886 N/A TRP 176.A N ALA 172.A O no hydrogen 2.916 N/A TRP 176.A NE1 GLU 180.A OE2 no hydrogen 2.679 N/A ALA 177.A N VAL 173.A O no hydrogen 2.867 N/A ALA 178.A N ASN 174.A O no hydrogen 3.041 N/A GLY 179.A N LEU 175.A O no hydrogen 3.095 N/A GLU 180.A N TRP 176.A O no hydrogen 2.969 N/A GLY 181.A N ALA 177.A O no hydrogen 3.060 N/A LEU 182.A N ALA 178.A O no hydrogen 2.896 N/A LEU 183.A N GLY 179.A O no hydrogen 3.039 N/A ALA 184.A N GLU 180.A O no hydrogen 3.312 N/A LEU 185.A N GLY 181.A O no hydrogen 3.109 N/A VAL 186.A N LEU 182.A O no hydrogen 2.785 N/A LYS 187.A N LEU 183.A O no hydrogen 2.949 N/A GLN 188.A N ALA 184.A O no hydrogen 3.309 N/A GLN 188.A N LEU 185.A O no hydrogen 3.044 N/A GLY 189.A N VAL 186.A O no hydrogen 2.996 N/A VAL 190.A N LEU 185.A O no hydrogen 3.027 N/A ALA 192.A N ARG 288.A O no hydrogen 2.824 N/A LYS 194.A N SER 191.A OG no hydrogen 3.087 N/A ALA 195.A N SER 191.A O no hydrogen 3.005 N/A LEU 196.A N ALA 192.A O no hydrogen 2.901 N/A GLU 197.A N GLU 193.A O no hydrogen 2.981 N/A VAL 198.A N LYS 194.A O no hydrogen 3.180 N/A ILE 199.A N ALA 195.A O no hydrogen 2.856 N/A ASN 200.A N LEU 196.A O no hydrogen 2.812 N/A ASN 200.A ND2 THR 209.A O no hydrogen 3.036 N/A ALA 201.A N VAL 198.A O no hydrogen 2.901 N/A SER 202.A N ILE 199.A O no hydrogen 2.935 N/A SER 202.A OG VAL 198.A O no hydrogen 2.757 N/A ARG 205.A N SER 202.A O no hydrogen 3.298 N/A ARG 205.A NH1 SER 202.A O no hydrogen 2.725 N/A SER 206.A N THR 209.A OG1 no hydrogen 3.012 N/A THR 209.A N SER 206.A OG no hydrogen 3.427 N/A THR 209.A OG1 ASN 200.A OD1 no hydrogen 2.854 N/A THR 209.A OG1 SER 206.A O no hydrogen 3.091 N/A GLU 210.A N SER 206.A O no hydrogen 2.930 N/A ASN 211.A N ASN 207.A O no hydrogen 2.783 N/A ASN 211.A ND2 ASN 207.A OD1 no hydrogen 2.869 N/A LEU 212.A N ALA 208.A O no hydrogen 3.187 N/A ILE 213.A N ALA 208.A O no hydrogen 3.012 N/A GLN 215.A NE2 GLU 210.A O no hydrogen 3.054 N/A ARG 216.A N LEU 212.A O no hydrogen 2.927 N/A ARG 216.A NH1 THR 225.A OG1 no hydrogen 2.797 N/A ARG 216.A NH1 ASP 271.A OD2 no hydrogen 2.964 N/A ARG 216.A NH2 THR 225.A OG1 no hydrogen 2.973 N/A VAL 217.A N ILE 213.A O no hydrogen 2.865 N/A LEU 218.A N ILE 213.A O no hydrogen 3.184 N/A THR 219.A OG1 GLN 215.A O no hydrogen 2.612 N/A ARG 220.A N VAL 217.A O no hydrogen 2.994 N/A ARG 220.A NH1 VAL 217.A O no hydrogen 3.281 N/A ARG 220.A NH1 GLU 280.A OE1 no hydrogen 3.528 N/A ARG 220.A NH1 GLU 280.A OE2 no hydrogen 2.633 N/A ARG 220.A NH2 GLU 280.A OE1 no hydrogen 2.956 N/A ARG 220.A NH2 GLU 280.A OE2 no hydrogen 3.532 N/A ALA 221.A N THR 219.A OG1 no hydrogen 3.097 N/A PHE 222.A N ARG 216.A O no hydrogen 2.969 N/A LYS 224.A NZ ASP 269.A O no hydrogen 2.752 N/A THR 225.A N ASP 271.A OD1 no hydrogen 2.958 N/A PHE 226.A N ASP 271.A OD1 no hydrogen 3.023 N/A LEU 228.A N ALA 270.A O no hydrogen 2.795 N/A GLY 229.A N PRO 268.A O no hydrogen 2.934 N/A LEU 230.A N ALA 227.A O no hydrogen 3.006 N/A LEU 231.A N ALA 227.A O no hydrogen 3.169 N/A VAL 232.A N LEU 228.A O no hydrogen 2.967 N/A LYS 233.A N GLY 229.A O no hydrogen 3.041 N/A LYS 233.A NZ PRO 63.A O no hydrogen 3.284 N/A LYS 233.A NZ SER 90.A O no hydrogen 3.123 N/A LYS 233.A NZ ASP 234.A OD1 no hydrogen 2.879 N/A ASP 234.A N LEU 230.A O no hydrogen 2.853 N/A LEU 235.A N LEU 231.A O no hydrogen 2.864 N/A GLY 236.A N VAL 232.A O no hydrogen 2.937 N/A ILE 237.A N LYS 233.A O no hydrogen 3.103 N/A ALA 238.A N ASP 234.A O no hydrogen 2.920 N/A MET 239.A N LEU 235.A O no hydrogen 2.929 N/A GLY 240.A N GLY 236.A O no hydrogen 3.173 N/A VAL 241.A N ILE 237.A O no hydrogen 3.037 N/A LEU 242.A N ALA 238.A O no hydrogen 2.908 N/A ASP 243.A N MET 239.A O no hydrogen 2.950 N/A GLY 244.A N VAL 241.A O no hydrogen 3.064 N/A LYS 246.A N LEU 242.A O no hydrogen 2.808 N/A SER 249.A OG ALA 247.A O no hydrogen 2.932 N/A ARG 253.A N SER 249.A O no hydrogen 3.071 N/A ARG 253.A NH1 MET 239.A O no hydrogen 3.337 N/A ARG 253.A NH1 ASP 243.A OD2 no hydrogen 3.086 N/A ARG 253.A NH2 ASP 243.A OD2 no hydrogen 2.721 N/A LEU 254.A N PRO 250.A O no hydrogen 3.040 N/A ALA 255.A N LEU 251.A O no hydrogen 3.029 N/A ARG 256.A N LEU 252.A O no hydrogen 3.401 N/A ARG 256.A NE GLU 257.A OE2 no hydrogen 2.632 N/A ARG 256.A NH1 GLU 260.A OE1 no hydrogen 3.002 N/A ARG 256.A NH2 GLU 257.A OE1 no hydrogen 3.189 N/A ARG 256.A NH2 GLU 257.A OE2 no hydrogen 3.202 N/A VAL 258.A N LEU 254.A O no hydrogen 3.065 N/A TYR 259.A N ALA 255.A O no hydrogen 3.156 N/A TYR 259.A OH ALA 172.A O no hydrogen 2.737 N/A GLU 260.A N ARG 256.A O no hydrogen 3.063 N/A MET 261.A N GLU 257.A O no hydrogen 3.170 N/A ALA 262.A N VAL 258.A O no hydrogen 3.136 N/A LYS 263.A N TYR 259.A O no hydrogen 2.895 N/A ARG 264.A N GLU 260.A O no hydrogen 2.914 N/A ARG 264.A NE GLU 260.A OE2 no hydrogen 2.687 N/A ARG 264.A NH2 GLU 260.A OE2 no hydrogen 3.125 N/A GLU 265.A N MET 261.A O no hydrogen 3.019 N/A LEU 266.A N ALA 262.A O no hydrogen 2.713 N/A GLY 267.A N LYS 263.A O no hydrogen 2.717 N/A ALA 270.A N GLY 267.A O no hydrogen 3.360 N/A ASP 271.A N GLU 274.A OE1 no hydrogen 2.792 N/A HIS 272.A N PHE 226.A O no hydrogen 2.712 N/A HIS 272.A ND1 ASP 271.A OD1 no hydrogen 3.316 N/A VAL 273.A N ASP 271.A OD2 no hydrogen 3.113 N/A GLU 274.A N ASP 271.A O no hydrogen 2.950 N/A ALA 275.A N HIS 272.A O no hydrogen 3.170 N/A LEU 276.A N VAL 273.A O no hydrogen 3.156 N/A ARG 277.A N GLU 274.A O no hydrogen 2.866 N/A ARG 277.A NH1 GLU 274.A OE2 no hydrogen 3.073 N/A LEU 278.A N ALA 275.A O no hydrogen 3.059 N/A GLU 280.A N LEU 276.A O no hydrogen 3.093 N/A ARG 281.A N ARG 277.A O no hydrogen 2.808 N/A TRP 282.A N LEU 278.A O no hydrogen 3.005 N/A GLY 283.A N LEU 279.A O no hydrogen 2.830 N/A VAL 285.A N GLU 280.A O no hydrogen 3.253 N/A ILE 287.A N GLU 280.A OE2 no hydrogen 2.756 N/A ARG 288.A NH1 GLU 286.A OE2 no hydrogen 2.715 N/A