Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wf9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 GLU 5.A OE1 no hydrogen 3.441 N/A CYS 6.A N ARG 3.A O no hydrogen 2.855 N/A PHE 7.A N PRO 4.A O no hydrogen 2.979 N/A GLU 8.A N ARG 25.A O no hydrogen 2.954 N/A LEU 10.A N GLN 23.A O no hydrogen 2.720 N/A LEU 13.A N VAL 21.A O no hydrogen 2.612 N/A GLY 14.A N VAL 21.A O no hydrogen 3.232 N/A GLY 16.A N GLY 19.A O no hydrogen 2.990 N/A TYR 18.A OH ASP 52.A OD2 no hydrogen 3.266 N/A TYR 18.A OH HIS 167.A NE2 no hydrogen 3.012 N/A LYS 20.A N VAL 40.A O no hydrogen 3.051 N/A VAL 21.A N GLY 14.A O no hydrogen 2.745 N/A PHE 22.A N MET 38.A O no hydrogen 2.937 N/A GLN 23.A N ARG 11.A O no hydrogen 2.802 N/A VAL 24.A N PHE 36.A O no hydrogen 2.803 N/A ARG 25.A N GLU 8.A O no hydrogen 3.142 N/A ARG 25.A NE GLU 8.A OE1 no hydrogen 2.713 N/A ARG 25.A NH2 GLU 8.A OE1 no hydrogen 3.032 N/A ARG 25.A NH2 GLU 8.A OE2 no hydrogen 3.048 N/A LYS 26.A N LYS 34.A O no hydrogen 3.058 N/A LYS 26.A NZ THR 28.A O no hydrogen 2.601 N/A LYS 26.A NZ ALA 30.A O no hydrogen 2.832 N/A VAL 27.A N CYS 6.A O no hydrogen 2.939 N/A THR 32.A OG1 GLY 29.A O no hydrogen 2.611 N/A GLY 33.A N LYS 26.A O no hydrogen 2.715 N/A LYS 34.A N ASN 31.A O no hydrogen 2.737 N/A PHE 36.A N VAL 24.A O no hydrogen 2.715 N/A ALA 37.A N LEU 88.A O no hydrogen 2.985 N/A MET 38.A N PHE 22.A O no hydrogen 2.724 N/A LYS 39.A N LEU 86.A O no hydrogen 2.819 N/A LYS 39.A NZ GLU 59.A OE2 no hydrogen 2.718 N/A VAL 40.A N LYS 20.A O no hydrogen 2.749 N/A LEU 41.A N LEU 84.A O no hydrogen 2.833 N/A LYS 42.A N TYR 18.A O no hydrogen 2.876 N/A LYS 43.A N GLY 82.A O no hydrogen 3.021 N/A LYS 43.A NZ THR 80.A O no hydrogen 2.548 N/A LYS 43.A NZ GLY 81.A O no hydrogen 3.482 N/A MET 45.A N LYS 42.A O no hydrogen 2.805 N/A ILE 46.A N LYS 43.A O no hydrogen 2.775 N/A VAL 47.A N LYS 43.A O no hydrogen 2.591 N/A ASN 49.A N ILE 46.A O no hydrogen 2.970 N/A ASP 52.A N ASN 49.A OD1 no hydrogen 2.902 N/A THR 53.A N ASN 49.A O no hydrogen 2.895 N/A THR 53.A OG1 ILE 46.A O no hydrogen 3.119 N/A THR 53.A OG1 ASN 49.A O no hydrogen 3.193 N/A ALA 54.A N ALA 50.A O no hydrogen 3.146 N/A HIS 55.A N LYS 51.A O no hydrogen 2.829 N/A THR 56.A N ASP 52.A O no hydrogen 2.862 N/A THR 56.A OG1 ASP 52.A O no hydrogen 2.889 N/A LYS 57.A N THR 53.A O no hydrogen 3.070 N/A ALA 58.A N ALA 54.A O no hydrogen 2.874 N/A GLU 59.A N HIS 55.A O no hydrogen 3.014 N/A ARG 60.A N THR 56.A O no hydrogen 3.334 N/A ASN 61.A N LYS 57.A O no hydrogen 2.927 N/A ILE 62.A N ALA 58.A O no hydrogen 2.850 N/A LEU 63.A N GLU 59.A O no hydrogen 2.881 N/A GLU 64.A N ARG 60.A O no hydrogen 2.779 N/A GLU 65.A N ASN 61.A O no hydrogen 3.004 N/A GLU 65.A N ILE 62.A O no hydrogen 2.898 N/A VAL 66.A N ILE 62.A O no hydrogen 2.873 N/A LYS 67.A NZ GLU 65.A O no hydrogen 3.457 N/A PHE 70.A N HIS 68.A ND1 no hydrogen 2.966 N/A ILE 71.A N HIS 68.A O no hydrogen 3.321 N/A VAL 72.A N LEU 150.A O no hydrogen 3.099 N/A ASP 73.A N GLU 89.A OE2 no hydrogen 2.655 N/A ILE 75.A N ILE 87.A O no hydrogen 2.777 N/A TYR 76.A N ILE 87.A O no hydrogen 3.385 N/A PHE 78.A N TYR 85.A O no hydrogen 3.142 N/A THR 80.A N LYS 83.A O no hydrogen 2.851 N/A THR 80.A OG1 LYS 83.A O no hydrogen 3.539 N/A LYS 83.A N THR 80.A OG1 no hydrogen 3.120 N/A LEU 84.A N LEU 41.A O no hydrogen 2.878 N/A TYR 85.A N PHE 78.A O no hydrogen 2.773 N/A LEU 86.A N LYS 39.A O no hydrogen 2.982 N/A ILE 87.A N TYR 76.A O no hydrogen 2.877 N/A LEU 88.A N ALA 37.A O no hydrogen 2.746 N/A GLU 89.A N ASP 73.A O no hydrogen 3.023 N/A GLY 93.A N LEU 142.A O no hydrogen 2.805 N/A LEU 96.A N ILE 140.A O no hydrogen 2.644 N/A MET 98.A N GLU 95.A O no hydrogen 3.030 N/A GLN 99.A N LEU 96.A O no hydrogen 2.933 N/A LEU 100.A N LEU 96.A O no hydrogen 3.027 N/A GLU 101.A N PHE 97.A O no hydrogen 3.148 N/A ARG 102.A NH2 GLN 99.A OE1 no hydrogen 2.169 N/A GLU 103.A N GLN 99.A O no hydrogen 3.060 N/A GLY 104.A N LEU 100.A O no hydrogen 2.887 N/A PHE 106.A N MET 201.A O no hydrogen 2.794 N/A ALA 111.A N MET 107.A O no hydrogen 2.973 N/A CYS 112.A N GLU 108.A O no hydrogen 2.752 N/A CYS 112.A SG PHE 266.A O no hydrogen 3.463 N/A PHE 113.A N ASP 109.A O no hydrogen 3.123 N/A TYR 114.A N THR 110.A O no hydrogen 3.373 N/A LEU 115.A N ALA 111.A O no hydrogen 2.877 N/A ALA 116.A N CYS 112.A O no hydrogen 2.927 N/A GLU 117.A N PHE 113.A O no hydrogen 3.074 N/A ILE 118.A N TYR 114.A O no hydrogen 2.927 N/A SER 119.A N LEU 115.A O no hydrogen 2.904 N/A SER 119.A OG ALA 116.A O no hydrogen 2.636 N/A MET 120.A N ALA 116.A O no hydrogen 3.276 N/A ALA 121.A N GLU 117.A O no hydrogen 3.195 N/A LEU 122.A N ILE 118.A O no hydrogen 2.858 N/A GLY 123.A N SER 119.A O no hydrogen 2.891 N/A HIS 124.A N MET 120.A O no hydrogen 3.007 N/A LEU 125.A N ALA 121.A O no hydrogen 2.988 N/A HIS 126.A N LEU 122.A O no hydrogen 2.843 N/A HIS 126.A ND1 ASP 257.A OD1 no hydrogen 3.030 N/A HIS 126.A NE2 ASP 190.A OD2 no hydrogen 2.473 N/A GLN 127.A N GLY 123.A O no hydrogen 3.137 N/A LYS 128.A N LEU 125.A O no hydrogen 2.988 N/A LYS 128.A NZ GLU 65.A OE1 no hydrogen 3.009 N/A GLY 129.A N HIS 126.A O no hydrogen 2.736 N/A ILE 130.A N LEU 125.A O no hydrogen 2.883 N/A TYR 132.A N ASP 190.A OD2 no hydrogen 2.769 N/A TYR 132.A OH THR 151.A O no hydrogen 2.489 N/A ARG 133.A N ASP 190.A OD1 no hydrogen 2.630 N/A ASN 139.A N LYS 136.A O no hydrogen 2.855 N/A ASN 139.A ND2 ASP 134.A O no hydrogen 2.521 N/A ASN 139.A ND2 ASP 152.A OD2 no hydrogen 3.294 N/A ILE 140.A N PRO 137.A O no hydrogen 3.115 N/A MET 141.A N LYS 149.A O no hydrogen 3.074 N/A LEU 142.A N GLY 94.A O no hydrogen 2.824 N/A ASN 143.A N HIS 147.A O no hydrogen 3.015 N/A ASN 143.A ND2 GLN 145.A OE1 no hydrogen 2.472 N/A GLY 146.A N ASN 143.A O no hydrogen 2.883 N/A GLY 146.A N ASN 143.A OD1 no hydrogen 2.851 N/A HIS 147.A N ASN 143.A OD1 no hydrogen 2.772 N/A HIS 147.A ND1 GLU 117.A OE2 no hydrogen 2.582 N/A VAL 148.A N GLU 117.A OE1 no hydrogen 2.830 N/A LYS 149.A N MET 141.A O no hydrogen 2.744 N/A LYS 149.A NZ PRO 69.A O no hydrogen 2.891 N/A LYS 149.A NZ GLU 89.A OE1 no hydrogen 3.178 N/A LYS 149.A NZ GLU 89.A OE2 no hydrogen 3.175 N/A LEU 150.A N PHE 70.A O no hydrogen 2.938 N/A THR 151.A N ASN 139.A O no hydrogen 3.275 N/A THR 151.A OG1 ASN 139.A O no hydrogen 2.901 N/A CYS 156.A SG HIS 161.A ND1 no hydrogen 3.528 N/A CYS 169.A N HIS 167.A O no hydrogen 3.480 N/A CYS 169.A SG HIS 161.A ND1 no hydrogen 3.627 N/A CYS 169.A SG HIS 167.A ND1 no hydrogen 3.601 N/A THR 171.A OG1 GLU 173.A OE1 no hydrogen 2.939 N/A GLU 173.A N THR 171.A OG1 no hydrogen 3.148 N/A TYR 174.A OH ASP 200.A OD2 no hydrogen 2.579 N/A MET 175.A N ILE 172.A O no hydrogen 3.321 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.807 N/A ILE 179.A N ALA 176.A O no hydrogen 3.055 N/A LEU 180.A N ALA 176.A O no hydrogen 3.501 N/A MET 181.A N PRO 177.A O no hydrogen 2.783 N/A ARG 182.A N ILE 179.A O no hydrogen 3.007 N/A SER 183.A N GLU 178.A O no hydrogen 3.098 N/A ARG 187.A NH1 GLY 252.A O no hydrogen 2.877 N/A ARG 187.A NH1 GLY 254.A O no hydrogen 3.097 N/A ARG 187.A NH1 ASP 257.A OD1 no hydrogen 2.897 N/A ARG 187.A NH2 ALA 253.A O no hydrogen 3.437 N/A ARG 187.A NH2 GLY 254.A O no hydrogen 2.787 N/A ALA 188.A N ASN 186.A OD1 no hydrogen 2.906 N/A VAL 189.A N ASN 186.A O no hydrogen 3.252 N/A ASP 190.A N ARG 187.A O no hydrogen 3.121 N/A TRP 191.A NE1 ASP 257.A OD1 no hydrogen 3.017 N/A TRP 192.A N ALA 188.A O no hydrogen 3.114 N/A SER 193.A N VAL 189.A O no hydrogen 2.909 N/A SER 193.A OG TYR 174.A O no hydrogen 2.575 N/A SER 193.A OG VAL 189.A O no hydrogen 3.088 N/A LEU 194.A N ASP 190.A O no hydrogen 2.852 N/A GLY 195.A N TRP 191.A O no hydrogen 3.170 N/A ALA 196.A N TRP 192.A O no hydrogen 3.075 N/A LEU 197.A N SER 193.A O no hydrogen 2.983 N/A MET 198.A N LEU 194.A O no hydrogen 2.858 N/A TYR 199.A N GLY 195.A O no hydrogen 2.817 N/A TYR 199.A OH ASN 226.A O no hydrogen 2.884 N/A ASP 200.A N ALA 196.A O no hydrogen 2.966 N/A MET 201.A N LEU 197.A O no hydrogen 2.922 N/A LEU 202.A N MET 198.A O no hydrogen 3.057 N/A THR 203.A N TYR 199.A O no hydrogen 2.857 N/A THR 203.A OG1 TYR 199.A O no hydrogen 2.785 N/A GLY 204.A N ASP 200.A O no hydrogen 2.898 N/A ALA 205.A N THR 203.A OG1 no hydrogen 3.360 N/A GLY 210.A N THR 216.A OG1 no hydrogen 3.066 N/A ARG 213.A NH1 PHE 168.A O no hydrogen 3.289 N/A ARG 213.A NH1 GLY 170.A O no hydrogen 2.893 N/A ARG 213.A NH2 PHE 168.A O no hydrogen 2.721 N/A LYS 214.A NZ ASP 218.A OD1 no hydrogen 3.554 N/A LYS 214.A NZ ASP 218.A OD2 no hydrogen 3.156 N/A LYS 215.A N ASN 212.A OD1 no hydrogen 3.083 N/A LYS 215.A NZ GLU 211.A OE1 no hydrogen 3.564 N/A THR 216.A N ASN 212.A O no hydrogen 3.066 N/A THR 216.A OG1 ASN 212.A O no hydrogen 2.748 N/A ILE 217.A N ARG 213.A O no hydrogen 2.882 N/A ASP 218.A N LYS 214.A O no hydrogen 2.958 N/A LYS 219.A N LYS 215.A O no hydrogen 3.037 N/A LYS 219.A NZ THR 209.A O no hydrogen 2.951 N/A ILE 220.A N THR 216.A O no hydrogen 2.902 N/A LEU 221.A N ILE 217.A O no hydrogen 2.963 N/A LYS 222.A N ASP 218.A O no hydrogen 2.999 N/A CYS 223.A N LYS 219.A O no hydrogen 2.825 N/A CYS 223.A SG LEU 243.A O no hydrogen 3.903 N/A LEU 231.A N PRO 228.A O no hydrogen 3.243 N/A THR 232.A OG1 GLU 108.A OE1 no hydrogen 2.966 N/A THR 232.A OG1 GLU 108.A OE2 no hydrogen 2.709 N/A GLU 234.A N GLU 234.A OE1 no hydrogen 2.782 N/A ALA 235.A N THR 232.A OG1 no hydrogen 3.027 N/A ARG 236.A N THR 232.A O no hydrogen 2.929 N/A ARG 236.A NH1 LEU 227.A O no hydrogen 3.141 N/A ASP 237.A N GLN 233.A O no hydrogen 3.065 N/A LEU 238.A N GLU 234.A O no hydrogen 3.028 N/A LEU 239.A N ALA 235.A O no hydrogen 2.731 N/A LYS 240.A N ARG 236.A O no hydrogen 2.978 N/A LYS 241.A N ASP 237.A O no hydrogen 3.346 N/A LYS 241.A NZ ASP 237.A OD2 no hydrogen 2.966 N/A LEU 242.A N LEU 238.A O no hydrogen 2.948 N/A LEU 242.A N LEU 239.A O no hydrogen 3.247 N/A LEU 243.A N LEU 239.A O no hydrogen 2.880 N/A SER 249.A N ASN 246.A O no hydrogen 2.719 N/A SER 249.A OG ASN 246.A OD1 no hydrogen 2.514 N/A ARG 250.A N ALA 247.A O no hydrogen 3.119 N/A ARG 250.A NE LYS 244.A O no hydrogen 2.583 N/A ARG 250.A NH1 GLU 178.A OE1 no hydrogen 3.533 N/A ARG 250.A NH1 GLU 178.A OE2 no hydrogen 2.664 N/A ARG 250.A NH1 ALA 188.A O no hydrogen 3.111 N/A ARG 250.A NH2 GLU 178.A OE1 no hydrogen 2.716 N/A ARG 250.A NH2 GLU 178.A OE2 no hydrogen 3.415 N/A ARG 250.A NH2 LYS 244.A O no hydrogen 3.035 N/A LEU 251.A N LYS 241.A O no hydrogen 2.992 N/A GLY 252.A N GLU 260.A OE1 no hydrogen 3.354 N/A ALA 253.A N ARG 250.A O no hydrogen 3.010 N/A GLY 256.A N GLU 260.A OE2 no hydrogen 3.188 N/A ASP 257.A N GLY 254.A O no hydrogen 3.209 N/A GLY 259.A N GLY 256.A O no hydrogen 3.122 N/A GLU 260.A N ASP 257.A O no hydrogen 3.009 N/A GLN 262.A N ALA 258.A O no hydrogen 2.803 N/A GLN 262.A NE2 SER 119.A OG no hydrogen 3.195 N/A ALA 263.A N GLY 259.A O no hydrogen 3.097 N/A HIS 264.A N VAL 261.A O no hydrogen 3.001 N/A HIS 264.A NE2 ASP 237.A OD2 no hydrogen 2.685 N/A PHE 266.A N HIS 264.A ND1 no hydrogen 2.927 N/A PHE 267.A N HIS 264.A O no hydrogen 2.852 N/A ARG 268.A N PRO 265.A O no hydrogen 2.891 N/A ARG 268.A NH1 PRO 265.A O no hydrogen 2.928 N/A ILE 270.A N PHE 267.A O no hydrogen 2.958 N/A GLU 274.A N ASN 271.A OD1 no hydrogen 3.222 N/A LEU 275.A N ASN 271.A O no hydrogen 2.867 N/A LEU 276.A N TRP 272.A O no hydrogen 2.900 N/A ALA 277.A N GLU 273.A O no hydrogen 3.167 N/A ARG 278.A N LEU 275.A O no hydrogen 2.952 N/A LYS 279.A N GLU 274.A O no hydrogen 2.788 N/A