Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4p8s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A SG PRO 4.A O no hydrogen 4.027 N/A CYS 7.A N PRO 4.A O no hydrogen 3.059 N/A CYS 7.A SG MET 5.A O no hydrogen 3.697 N/A THR 8.A N SER 17.A O no hydrogen 2.910 N/A CYS 9.A SG SER 2.A O no hydrogen 3.958 N/A TYR 10.A N THR 15.A O no hydrogen 2.962 N/A THR 15.A N TYR 10.A O no hydrogen 2.934 N/A THR 15.A OG1 PRO 13.A O no hydrogen 2.810 N/A VAL 16.A N ARG 36.A O no hydrogen 2.827 N/A SER 17.A N THR 8.A O no hydrogen 2.816 N/A CYS 18.A N PHE 38.A O no hydrogen 2.740 N/A ALA 20.A N GLN 40.A O no hydrogen 3.256 N/A THR 34.A N PRO 31.A O no hydrogen 3.026 N/A THR 34.A OG1 PRO 31.A O no hydrogen 2.691 N/A GLN 35.A N PRO 14.A O no hydrogen 2.769 N/A ARG 36.A N PRO 14.A O no hydrogen 3.252 N/A LEU 37.A N THR 58.A O no hydrogen 2.884 N/A PHE 38.A N VAL 16.A O no hydrogen 3.031 N/A LEU 39.A N TRP 60.A O no hydrogen 2.811 N/A ASN 41.A N PHE 62.A O no hydrogen 3.016 N/A LEU 43.A N PHE 23.A O no hydrogen 2.716 N/A LEU 47.A N THR 68.A O no hydrogen 2.998 N/A THR 51.A OG1 ARG 48.A O no hydrogen 3.040 N/A ASN 55.A ND2 PRO 32.A O no hydrogen 2.868 N/A LEU 57.A N GLN 35.A O no hydrogen 2.763 N/A THR 58.A N GLN 35.A O no hydrogen 3.059 N/A LEU 59.A N GLU 82.A O no hydrogen 2.920 N/A TRP 60.A N LEU 37.A O no hydrogen 3.037 N/A TRP 60.A NE1 GLU 82.A OE1 no hydrogen 2.800 N/A LEU 61.A N ASP 84.A O no hydrogen 2.792 N/A SER 63.A N GLY 86.A O no hydrogen 2.940 N/A SER 63.A OG ASP 87.A OD2 no hydrogen 2.784 N/A ASN 65.A N ILE 44.A O no hydrogen 2.954 N/A SER 67.A N ARG 45.A O no hydrogen 2.895 N/A SER 67.A OG ARG 45.A O no hydrogen 3.545 N/A THR 68.A N ARG 45.A O no hydrogen 3.450 N/A TYR 70.A N LEU 47.A O no hydrogen 2.910 N/A THR 73.A N TYR 70.A O no hydrogen 3.296 N/A THR 73.A OG1 TYR 70.A O no hydrogen 2.758 N/A ARG 75.A N GLY 72.A O no hydrogen 3.165 N/A LEU 77.A N PHE 74.A O no hydrogen 3.000 N/A GLN 78.A NE2 GLU 103.A OE2 no hydrogen 2.932 N/A LEU 80.A N LEU 77.A O no hydrogen 3.004 N/A GLU 81.A N LEU 57.A O no hydrogen 2.740 N/A GLU 82.A N LEU 57.A O no hydrogen 2.981 N/A LEU 83.A N SER 107.A O no hydrogen 3.005 N/A ASP 84.A N LEU 59.A O no hydrogen 3.034 N/A LEU 85.A N HIS 109.A O no hydrogen 2.815 N/A GLY 86.A N ASP 84.A OD1 no hydrogen 2.985 N/A ASP 87.A N TYR 111.A O no hydrogen 2.735 N/A ARG 89.A NE ASP 87.A OD1 no hydrogen 3.480 N/A LEU 91.A N ASN 88.A O no hydrogen 2.985 N/A ARG 92.A N CYS 113.A O no hydrogen 3.143 N/A ARG 92.A NE GLN 114.A OE1 no hydrogen 2.677 N/A SER 93.A N LEU 91.A O no hydrogen 2.801 N/A ASP 97.A N GLU 95.A OE2 no hydrogen 2.800 N/A THR 98.A N GLU 95.A O no hydrogen 3.110 N/A THR 98.A OG1 GLU 95.A O no hydrogen 2.652 N/A GLN 100.A N ASP 97.A O no hydrogen 3.059 N/A LEU 102.A N PHE 99.A O no hydrogen 2.991 N/A GLU 103.A N GLY 101.A O no hydrogen 2.958 N/A LEU 105.A N LEU 102.A O no hydrogen 3.235 N/A GLN 106.A N GLU 81.A O no hydrogen 2.705 N/A SER 107.A N GLU 81.A O no hydrogen 3.123 N/A LEU 108.A N TYR 131.A O no hydrogen 3.021 N/A HIS 109.A N LEU 83.A O no hydrogen 2.943 N/A LEU 110.A N TYR 133.A O no hydrogen 2.766 N/A TYR 111.A OH ASP 84.A OD1 no hydrogen 3.310 N/A TYR 111.A OH ASP 84.A OD2 no hydrogen 3.206 N/A ARG 112.A N GLN 135.A O no hydrogen 3.124 N/A ARG 112.A NE GLU 136.A OE1 no hydrogen 3.257 N/A CYS 113.A SG LEU 85.A O no hydrogen 3.256 N/A CYS 113.A SG ASN 88.A O no hydrogen 3.814 N/A CYS 113.A SG LEU 110.A O no hydrogen 3.855 N/A CYS 113.A SG TYR 111.A O no hydrogen 3.655 N/A ILE 122.A N PRO 119.A O no hydrogen 3.131 N/A ARG 124.A N ASN 121.A O no hydrogen 3.200 N/A ARG 124.A NH1 PRO 96.A O no hydrogen 3.153 N/A ARG 124.A NH1 ASP 97.A OD1 no hydrogen 3.267 N/A ARG 124.A NH1 ASN 121.A O no hydrogen 3.030 N/A ARG 124.A NH2 ASP 97.A OD1 no hydrogen 2.683 N/A GLY 125.A N ASP 149.A OD2 no hydrogen 2.790 N/A LEU 126.A N PHE 123.A O no hydrogen 3.421 N/A VAL 127.A N GLY 125.A O no hydrogen 2.845 N/A SER 128.A OG GLU 103.A O no hydrogen 2.708 N/A LEU 129.A N LEU 126.A O no hydrogen 3.113 N/A GLN 130.A N GLN 106.A O no hydrogen 2.822 N/A TYR 131.A N GLN 106.A O no hydrogen 3.033 N/A LEU 132.A N HIS 155.A O no hydrogen 2.958 N/A TYR 133.A N LEU 108.A O no hydrogen 3.011 N/A LEU 134.A N PHE 157.A O no hydrogen 2.834 N/A GLN 135.A N GLN 135.A OE1 no hydrogen 2.801 N/A GLU 136.A N HIS 159.A O no hydrogen 2.766 N/A ASN 137.A N ASN 161.A OD1 no hydrogen 3.103 N/A SER 138.A N LEU 115.A O no hydrogen 2.917 N/A LEU 139.A N ASN 161.A OD1 no hydrogen 3.036 N/A LEU 140.A N SER 116.A O no hydrogen 3.047 N/A GLN 143.A N GLN 143.A OE1 no hydrogen 2.776 N/A GLN 143.A NE2 LEU 118.A O no hydrogen 2.811 N/A ASP 145.A N HIS 169.A O no hydrogen 3.021 N/A LEU 146.A N GLN 143.A O no hydrogen 3.227 N/A ALA 148.A N ASP 145.A O no hydrogen 3.207 N/A LEU 150.A N PHE 147.A O no hydrogen 2.961 N/A ALA 151.A N ASP 149.A O no hydrogen 2.958 N/A LEU 153.A N LEU 150.A O no hydrogen 3.131 N/A SER 154.A N GLN 130.A O no hydrogen 2.730 N/A HIS 155.A N GLN 130.A O no hydrogen 3.109 N/A LEU 156.A N ARG 179.A O no hydrogen 3.020 N/A PHE 157.A N LEU 132.A O no hydrogen 2.997 N/A LEU 158.A N LEU 181.A O no hydrogen 2.772 N/A GLY 160.A N HIS 183.A O no hydrogen 2.888 N/A ASN 161.A ND2 LEU 134.A O no hydrogen 3.011 N/A ASN 161.A ND2 LEU 158.A O no hydrogen 2.973 N/A ARG 162.A N LEU 139.A O no hydrogen 2.864 N/A LEU 163.A N ASN 185.A OD1 no hydrogen 3.076 N/A LEU 166.A N GLY 189.A O no hydrogen 2.967 N/A THR 167.A OG1 ASP 144.A OD1 no hydrogen 2.654 N/A HIS 169.A N ASP 144.A OD1 no hydrogen 2.857 N/A VAL 170.A N THR 167.A O no hydrogen 3.266 N/A ARG 172.A N HIS 169.A O no hydrogen 3.166 N/A ARG 172.A NE ASP 145.A OD1 no hydrogen 2.769 N/A ARG 172.A NH2 ASP 145.A OD1 no hydrogen 3.337 N/A ARG 172.A NH2 ASP 145.A OD2 no hydrogen 2.847 N/A LEU 174.A N PHE 171.A O no hydrogen 3.340 N/A SER 176.A OG ALA 151.A O no hydrogen 2.705 N/A LEU 177.A N LEU 174.A O no hydrogen 3.073 N/A ASP 178.A N SER 154.A O no hydrogen 2.783 N/A ARG 179.A N SER 154.A O no hydrogen 3.018 N/A ARG 179.A NE ASP 178.A OD2 no hydrogen 3.309 N/A LEU 180.A N ILE 203.A O no hydrogen 3.015 N/A LEU 181.A N LEU 156.A O no hydrogen 3.124 N/A LEU 182.A N TYR 205.A O no hydrogen 2.880 N/A GLY 184.A N PHE 207.A O no hydrogen 3.174 N/A ASN 185.A ND2 LEU 158.A O no hydrogen 3.056 N/A ASN 185.A ND2 LEU 182.A O no hydrogen 2.967 N/A ARG 186.A N LEU 163.A O no hydrogen 2.838 N/A ARG 186.A NE ARG 162.A O no hydrogen 2.971 N/A ARG 186.A NH2 ARG 162.A O no hydrogen 3.547 N/A GLN 188.A N ARG 164.A O no hydrogen 2.736 N/A GLY 189.A N ARG 164.A O no hydrogen 3.334 N/A HIS 191.A N LEU 166.A O no hydrogen 2.858 N/A ALA 193.A N HIS 191.A ND1 no hydrogen 2.946 N/A ALA 194.A N HIS 191.A O no hydrogen 2.939 N/A HIS 196.A N ALA 193.A O no hydrogen 3.105 N/A LEU 198.A N PHE 195.A O no hydrogen 3.000 N/A LEU 201.A N LEU 198.A O no hydrogen 3.289 N/A THR 202.A N ASP 178.A O no hydrogen 2.850 N/A THR 202.A OG1 ASP 178.A O no hydrogen 3.355 N/A THR 202.A OG1 ASP 178.A OD1 no hydrogen 2.756 N/A ILE 203.A N ASP 178.A O no hydrogen 3.131 N/A LEU 204.A N PHE 227.A O no hydrogen 3.087 N/A TYR 205.A N LEU 180.A O no hydrogen 3.076 N/A LEU 206.A N ARG 229.A O no hydrogen 2.740 N/A ASN 208.A N ASN 231.A O no hydrogen 2.930 N/A ASN 209.A N ALA 232.A O no hydrogen 3.242 N/A SER 210.A N LEU 187.A O no hydrogen 2.800 N/A ALA 218.A N PRO 215.A O no hydrogen 3.176 N/A ALA 220.A N GLY 216.A O no hydrogen 3.244 N/A ASP 221.A N GLU 217.A O no hydrogen 3.144 N/A ASP 221.A N ALA 218.A O no hydrogen 3.136 N/A LEU 222.A N LEU 219.A O no hydrogen 3.008 N/A LEU 225.A N LEU 222.A O no hydrogen 3.180 N/A GLU 226.A N THR 202.A O no hydrogen 2.785 N/A PHE 227.A N THR 202.A O no hydrogen 2.999 N/A LEU 228.A N SER 254.A O no hydrogen 2.970 N/A ARG 229.A N LEU 204.A O no hydrogen 2.960 N/A ARG 229.A NE ASN 231.A OD1 no hydrogen 3.553 N/A LEU 230.A N SER 256.A OG no hydrogen 2.896 N/A TRP 235.A N ASN 233.A O no hydrogen 2.876 N/A TRP 235.A NE1 LEU 230.A O no hydrogen 2.786 N/A ALA 236.A N ALA 212.A O no hydrogen 3.007 N/A CYS 237.A N THR 262.A O no hydrogen 2.641 N/A ARG 240.A N ASP 238.A OD1 no hydrogen 3.003 N/A ARG 240.A NH1 ASP 238.A OD2 no hydrogen 2.288 N/A ALA 241.A N ASP 238.A O no hydrogen 2.927 N/A ARG 242.A N CYS 239.A O no hydrogen 3.131 N/A TRP 245.A N ALA 241.A O no hydrogen 2.908 N/A TRP 245.A NE1 LEU 274.A O no hydrogen 2.714 N/A ALA 246.A N ARG 242.A O no hydrogen 2.802 N/A TRP 247.A N PRO 243.A O no hydrogen 3.019 N/A PHE 248.A N LEU 244.A O no hydrogen 2.972 N/A GLN 249.A N TRP 245.A O no hydrogen 3.133 N/A GLN 249.A N ALA 246.A O no hydrogen 3.148 N/A GLN 249.A NE2 TRP 245.A O no hydrogen 3.041 N/A ARG 250.A N TRP 247.A O no hydrogen 3.181 N/A SER 254.A N GLU 226.A O no hydrogen 2.798 N/A SER 255.A OG LEU 228.A O no hydrogen 3.336 N/A SER 255.A OG SER 256.A O no hydrogen 3.279 N/A SER 256.A N LEU 228.A O no hydrogen 3.165 N/A SER 256.A OG ASN 231.A OD1 no hydrogen 3.545 N/A SER 256.A OG ASP 257.A O no hydrogen 2.881 N/A VAL 258.A N ASP 270.A OD2 no hydrogen 2.858 N/A THR 259.A OG1 ASP 257.A OD2 no hydrogen 2.732 N/A CYS 260.A N ARG 269.A O no hydrogen 2.837 N/A CYS 260.A SG ARG 269.A O no hydrogen 3.252 N/A ALA 261.A N TRP 235.A O no hydrogen 2.608 N/A THR 262.A N TRP 235.A O no hydrogen 3.309 N/A ARG 266.A N PRO 263.A O no hydrogen 2.895 N/A ARG 266.A NH1 CYS 237.A O no hydrogen 2.752 N/A GLN 267.A N PRO 264.A O no hydrogen 3.359 N/A GLY 268.A N CYS 260.A O no hydrogen 2.936 N/A ARG 269.A N ARG 266.A O no hydrogen 3.038 N/A ARG 269.A NE THR 273.A OG1 no hydrogen 3.330 N/A ARG 269.A NH2 THR 273.A OG1 no hydrogen 2.897 N/A LEU 271.A N VAL 258.A O no hydrogen 2.738 N/A ARG 272.A N ASP 270.A OD1 no hydrogen 2.803 N/A ARG 272.A NE ASP 270.A OD1 no hydrogen 2.949 N/A ARG 272.A NH2 SER 256.A O no hydrogen 3.003 N/A ARG 272.A NH2 ASP 270.A OD1 no hydrogen 3.461 N/A ARG 272.A NH2 ASP 270.A OD2 no hydrogen 3.236 N/A THR 273.A N ASP 270.A O no hydrogen 2.730 N/A THR 273.A OG1 ASP 270.A O no hydrogen 2.741 N/A LEU 274.A N LEU 271.A O no hydrogen 3.253 N/A ARG 275.A N ASP 278.A OD1 no hydrogen 2.749 N/A ASP 278.A N ARG 275.A O no hydrogen 2.822 N/A PHE 279.A N ASP 276.A O no hydrogen 2.933 N/A GLN 280.A N THR 277.A O no hydrogen 3.397 N/A CYS 282.A N PHE 279.A O no hydrogen 3.126 N/A CYS 282.A SG PHE 279.A O no hydrogen 3.394 N/A