Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f82_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N LEU 1.A O no hydrogen 2.285 N/A GLU 7.A N ASN 5.A OD1 no hydrogen 3.191 N/A LEU 8.A N ASN 5.A O no hydrogen 2.703 N/A VAL 9.A N ASN 5.A O no hydrogen 3.026 N/A GLN 10.A N PRO 6.A O no hydrogen 2.980 N/A ALA 11.A N GLU 7.A O no hydrogen 3.227 N/A VAL 12.A N LEU 8.A O no hydrogen 2.903 N/A GLN 13.A N GLN 10.A O no hydrogen 3.147 N/A VAL 16.A N GLN 13.A O no hydrogen 3.217 N/A ILE 17.A N ILE 82.A O no hydrogen 3.165 N/A SER 21.A N GLY 18.A O no hydrogen 2.633 N/A SER 21.A OG GLY 18.A O no hydrogen 3.110 N/A ILE 23.A N THR 42.A O no hydrogen 2.996 N/A HIS 25.A N HIS 40.A O no hydrogen 3.067 N/A HIS 25.A NE2 THR 42.A OG1 no hydrogen 2.797 N/A GLU 28.A N HIS 25.A O no hydrogen 2.925 N/A ILE 30.A N VAL 38.A O no hydrogen 2.767 N/A GLY 31.A N VAL 38.A O no hydrogen 3.162 N/A GLY 33.A N GLY 36.A O no hydrogen 3.322 N/A CYS 37.A N SER 52.A O no hydrogen 2.834 N/A CYS 37.A SG VAL 38.A O no hydrogen 3.796 N/A TYR 39.A N VAL 50.A O no hydrogen 2.984 N/A HIS 40.A N GLU 28.A O no hydrogen 3.011 N/A GLY 41.A N CYS 48.A O no hydrogen 3.073 N/A THR 42.A N ILE 23.A O no hydrogen 2.902 N/A THR 42.A OG1 HIS 25.A NE2 no hydrogen 2.797 N/A LEU 43.A N ILE 46.A O no hydrogen 2.868 N/A LEU 44.A N SER 21.A O no hydrogen 3.252 N/A ILE 46.A N LEU 43.A O no hydrogen 2.544 N/A CYS 48.A N GLY 41.A O no hydrogen 2.827 N/A ALA 49.A N LEU 94.A O no hydrogen 2.804 N/A VAL 50.A N TYR 39.A O no hydrogen 2.806 N/A LYS 51.A N VAL 92.A O no hydrogen 2.797 N/A LYS 51.A NZ PHE 160.A O no hydrogen 2.932 N/A SER 52.A N CYS 37.A O no hydrogen 2.784 N/A SER 52.A OG SER 89.A OG no hydrogen 3.264 N/A LEU 53.A N SER 89.A OG no hydrogen 3.058 N/A PHE 61.A N GLU 57.A O no hydrogen 3.070 N/A LEU 62.A N VAL 58.A O no hydrogen 3.023 N/A THR 63.A N SER 59.A O no hydrogen 2.872 N/A THR 63.A OG1 SER 59.A O no hydrogen 2.954 N/A GLU 64.A N GLN 60.A O no hydrogen 2.794 N/A GLY 65.A N PHE 61.A O no hydrogen 3.164 N/A ILE 66.A N LEU 62.A O no hydrogen 3.067 N/A ILE 67.A N THR 63.A O no hydrogen 3.437 N/A MET 68.A N GLY 65.A O no hydrogen 3.066 N/A LYS 69.A N ILE 66.A O no hydrogen 2.967 N/A ASP 70.A N ILE 67.A O no hydrogen 3.299 N/A PHE 71.A N MET 68.A O no hydrogen 2.992 N/A ASN 75.A N HIS 73.A ND1 no hydrogen 2.841 N/A ASN 75.A ND2 GLN 124.A OE1 no hydrogen 3.100 N/A ASN 75.A ND2 VAL 155.A O no hydrogen 3.049 N/A VAL 76.A N HIS 73.A O no hydrogen 3.129 N/A LEU 77.A N VAL 157.A O no hydrogen 2.879 N/A LEU 80.A N VAL 93.A O no hydrogen 2.784 N/A GLY 81.A N VAL 93.A O no hydrogen 3.409 N/A ILE 82.A N VAL 15.A O no hydrogen 3.042 N/A CYS 83.A N LEU 91.A O no hydrogen 2.770 N/A CYS 83.A SG ILE 17.A O no hydrogen 3.176 N/A SER 89.A OG SER 52.A OG no hydrogen 3.264 N/A SER 89.A OG LEU 53.A O no hydrogen 3.463 N/A SER 89.A OG PRO 90.A O no hydrogen 2.751 N/A LEU 91.A N CYS 83.A O no hydrogen 2.801 N/A VAL 92.A N LYS 51.A O no hydrogen 2.849 N/A VAL 93.A N GLY 81.A O no hydrogen 2.754 N/A LEU 94.A N ALA 49.A O no hydrogen 2.803 N/A HIS 99.A N LEU 149.A O no hydrogen 2.775 N/A GLY 100.A N MET 97.A O no hydrogen 3.087 N/A LEU 102.A N CYS 147.A O no hydrogen 2.662 N/A ARG 103.A N ALA 144.A O no hydrogen 3.211 N/A ASN 104.A N ASP 101.A OD1 no hydrogen 2.859 N/A PHE 105.A N ASP 101.A O no hydrogen 3.289 N/A ILE 106.A N LEU 102.A O no hydrogen 3.000 N/A ARG 107.A N ARG 103.A O no hydrogen 3.036 N/A ARG 107.A NH1 GLY 198.A O no hydrogen 2.687 N/A ASN 108.A N ASN 104.A O no hydrogen 3.203 N/A ASN 108.A N PHE 105.A O no hydrogen 3.377 N/A GLU 109.A N GLU 109.A OE1 no hydrogen 3.048 N/A THR 110.A N ASN 108.A OD1 no hydrogen 2.459 N/A THR 110.A OG1 ASN 108.A OD1 no hydrogen 2.494 N/A HIS 111.A N ASN 108.A O no hydrogen 3.101 N/A HIS 111.A ND1 PHE 105.A O no hydrogen 2.630 N/A THR 114.A N ASP 117.A OD2 no hydrogen 3.075 N/A VAL 115.A N HIS 266.A O no hydrogen 2.765 N/A LYS 116.A NZ PHE 259.A O no hydrogen 2.969 N/A LYS 116.A NZ PHE 262.A O no hydrogen 2.800 N/A ASP 117.A N THR 114.A OG1 no hydrogen 3.264 N/A LEU 118.A N THR 114.A O no hydrogen 3.218 N/A ILE 119.A N VAL 115.A O no hydrogen 2.893 N/A GLY 120.A N LYS 116.A O no hydrogen 2.858 N/A PHE 121.A N ASP 117.A O no hydrogen 2.964 N/A GLY 122.A N LEU 118.A O no hydrogen 3.200 N/A LEU 123.A N ILE 119.A O no hydrogen 2.825 N/A GLN 124.A N GLY 120.A O no hydrogen 2.984 N/A GLN 124.A NE2 PHE 153.A O no hydrogen 3.310 N/A VAL 125.A N PHE 121.A O no hydrogen 3.047 N/A ALA 126.A N GLY 122.A O no hydrogen 2.935 N/A LYS 127.A N LEU 123.A O no hydrogen 3.030 N/A GLY 128.A N GLN 124.A O no hydrogen 3.135 N/A MET 129.A N VAL 125.A O no hydrogen 2.796 N/A LYS 130.A N ALA 126.A O no hydrogen 2.840 N/A PHE 131.A N LYS 127.A O no hydrogen 3.119 N/A LEU 132.A N GLY 128.A O no hydrogen 2.982 N/A ALA 133.A N MET 129.A O no hydrogen 2.738 N/A SER 134.A N LYS 130.A O no hydrogen 3.198 N/A SER 134.A N PHE 131.A O no hydrogen 3.031 N/A SER 134.A OG PHE 131.A O no hydrogen 2.578 N/A LYS 135.A N LEU 132.A O no hydrogen 3.221 N/A LYS 136.A N ALA 133.A O no hydrogen 3.061 N/A LYS 136.A NZ ALA 133.A O no hydrogen 3.359 N/A PHE 137.A N LEU 132.A O no hydrogen 2.881 N/A HIS 139.A N ASP 183.A OD2 no hydrogen 2.907 N/A HIS 139.A NE2 ALA 158.A O no hydrogen 2.728 N/A ARG 140.A N ASP 183.A OD1 no hydrogen 3.188 N/A ASP 141.A N HIS 139.A ND1 no hydrogen 3.175 N/A ALA 144.A N GLU 193.A OE1 no hydrogen 3.083 N/A ARG 145.A NH2 ASP 141.A OD1 no hydrogen 3.012 N/A ASN 146.A N ALA 143.A O no hydrogen 3.013 N/A ASN 146.A ND2 ASP 141.A O no hydrogen 2.817 N/A ASN 146.A ND2 ASP 141.A OD2 no hydrogen 3.095 N/A CYS 147.A N ALA 144.A O no hydrogen 3.303 N/A CYS 147.A SG ALA 143.A O no hydrogen 3.597 N/A MET 148.A N LYS 156.A O no hydrogen 2.736 N/A LEU 149.A N GLY 100.A O no hydrogen 2.797 N/A ASP 150.A N THR 154.A O no hydrogen 3.158 N/A GLU 151.A N GLU 151.A OE1 no hydrogen 2.378 N/A LYS 152.A N ASP 150.A OD1 no hydrogen 2.912 N/A PHE 153.A N ASP 150.A O no hydrogen 2.938 N/A THR 154.A N ASP 150.A OD1 no hydrogen 3.007 N/A VAL 155.A N GLN 124.A OE1 no hydrogen 2.689 N/A LYS 156.A N MET 148.A O no hydrogen 2.899 N/A LYS 156.A NZ PRO 74.A O no hydrogen 2.697 N/A VAL 157.A N ASN 75.A O no hydrogen 2.857 N/A ALA 158.A N ASN 146.A O no hydrogen 2.831 N/A PHE 160.A N ASN 146.A OD1 no hydrogen 2.816 N/A LYS 166.A NZ VAL 205.A O no hydrogen 3.502 N/A LYS 166.A NZ THR 207.A OG1 no hydrogen 3.420 N/A TRP 167.A N PRO 164.A O no hydrogen 2.984 N/A TRP 167.A NE1 GLU 193.A OE1 no hydrogen 2.800 N/A MET 168.A N VAL 165.A O no hydrogen 3.103 N/A GLU 171.A N GLU 171.A OE1 no hydrogen 2.791 N/A SER 172.A OG LYS 177.A O no hydrogen 3.044 N/A LEU 173.A N ALA 169.A O no hydrogen 3.058 N/A GLN 174.A N LEU 170.A O no hydrogen 3.039 N/A THR 175.A N GLU 171.A O no hydrogen 2.806 N/A GLN 176.A N SER 172.A O no hydrogen 2.665 N/A THR 179.A N SER 182.A OG no hydrogen 3.099 N/A LYS 181.A NZ ARG 245.A O no hydrogen 3.082 N/A SER 182.A N THR 179.A O no hydrogen 3.328 N/A SER 182.A N THR 179.A OG1 no hydrogen 3.328 N/A SER 182.A OG SER 172.A OG no hydrogen 3.393 N/A SER 182.A OG THR 179.A O no hydrogen 3.205 N/A ASP 183.A N THR 180.A O no hydrogen 3.121 N/A VAL 184.A N THR 180.A O no hydrogen 3.144 N/A SER 186.A N SER 182.A O no hydrogen 3.182 N/A SER 186.A OG TRP 167.A O no hydrogen 2.519 N/A SER 186.A OG SER 182.A O no hydrogen 3.337 N/A PHE 187.A N ASP 183.A O no hydrogen 2.817 N/A GLY 188.A N VAL 184.A O no hydrogen 3.070 N/A VAL 189.A N TRP 185.A O no hydrogen 3.328 N/A LEU 190.A N SER 186.A O no hydrogen 2.930 N/A LEU 191.A N PHE 187.A O no hydrogen 2.907 N/A TRP 192.A N GLY 188.A O no hydrogen 3.076 N/A TRP 192.A NE1 LEU 221.A O no hydrogen 2.796 N/A GLU 193.A N VAL 189.A O no hydrogen 2.923 N/A LEU 194.A N LEU 190.A O no hydrogen 3.001 N/A MET 195.A N LEU 191.A O no hydrogen 2.985 N/A THR 196.A N TRP 192.A O no hydrogen 2.990 N/A THR 196.A OG1 TRP 192.A O no hydrogen 2.924 N/A THR 196.A OG1 GLU 193.A O no hydrogen 3.221 N/A ARG 197.A N LEU 194.A O no hydrogen 2.914 N/A ARG 197.A NE ILE 106.A O no hydrogen 2.925 N/A ARG 197.A NH1 VAL 268.A O no hydrogen 2.945 N/A ARG 197.A NH2 ILE 106.A O no hydrogen 3.237 N/A ARG 197.A NH2 HIS 111.A O no hydrogen 3.093 N/A GLY 198.A N GLU 193.A O no hydrogen 2.675 N/A ALA 199.A N THR 196.A OG1 no hydrogen 3.265 N/A VAL 205.A N TYR 202.A O no hydrogen 3.114 N/A ASP 209.A N ASN 206.A O no hydrogen 3.258 N/A TYR 213.A N ASP 209.A O no hydrogen 3.307 N/A LEU 214.A N ILE 210.A O no hydrogen 2.679 N/A LEU 215.A N THR 211.A O no hydrogen 2.921 N/A GLN 216.A N TYR 213.A O no hydrogen 3.219 N/A GLY 217.A N LEU 214.A O no hydrogen 3.039 N/A ARG 218.A N LEU 214.A O no hydrogen 3.299 N/A ARG 218.A NE GLN 216.A OE1 no hydrogen 2.912 N/A ARG 218.A NH2 GLN 216.A OE1 no hydrogen 3.481 N/A ARG 219.A NE TRP 238.A O no hydrogen 3.390 N/A ARG 219.A NH1 ARG 218.A O no hydrogen 2.904 N/A ARG 219.A NH2 TRP 238.A O no hydrogen 2.762 N/A GLN 222.A NE2 CYS 226.A O no hydrogen 2.854 N/A GLN 222.A NE2 ASP 228.A OD1 no hydrogen 3.179 N/A CYS 226.A N PRO 223.A O no hydrogen 3.252 N/A CYS 226.A SG PRO 227.A O no hydrogen 3.294 N/A LEU 230.A N PRO 227.A O no hydrogen 2.979 N/A TYR 231.A N PRO 227.A O no hydrogen 2.990 N/A TYR 231.A OH LEU 220.A O no hydrogen 2.658 N/A GLU 232.A N ASP 228.A O no hydrogen 2.840 N/A VAL 233.A N PRO 229.A O no hydrogen 3.185 N/A MET 234.A N LEU 230.A O no hydrogen 2.931 N/A LEU 235.A N TYR 231.A O no hydrogen 2.943 N/A LYS 236.A N GLU 232.A O no hydrogen 3.285 N/A CYS 237.A N VAL 233.A O no hydrogen 3.047 N/A CYS 237.A SG VAL 233.A O no hydrogen 3.414 N/A TRP 238.A N MET 234.A O no hydrogen 3.153 N/A TRP 238.A N LEU 235.A O no hydrogen 3.228 N/A HIS 239.A N LYS 236.A O no hydrogen 3.117 N/A LYS 241.A N HIS 239.A ND1 no hydrogen 2.972 N/A GLU 243.A N GLU 243.A OE1 no hydrogen 2.825 N/A MET 244.A N LYS 241.A O no hydrogen 2.818 N/A ARG 245.A N ALA 242.A O no hydrogen 3.360 N/A ARG 245.A NE HIS 239.A O no hydrogen 2.837 N/A ARG 245.A NH1 GLU 171.A OE2 no hydrogen 2.803 N/A ARG 245.A NH1 LYS 181.A O no hydrogen 2.871 N/A ARG 245.A NH2 GLU 171.A OE1 no hydrogen 2.905 N/A ARG 245.A NH2 GLU 171.A OE2 no hydrogen 3.539 N/A ARG 245.A NH2 HIS 239.A O no hydrogen 2.954 N/A GLU 250.A N SER 247.A OG no hydrogen 3.322 N/A LEU 251.A N SER 247.A O no hydrogen 2.875 N/A VAL 252.A N PHE 248.A O no hydrogen 2.862 N/A SER 253.A N SER 249.A O no hydrogen 3.040 N/A ARG 254.A N GLU 250.A O no hydrogen 2.780 N/A ARG 254.A NE GLU 250.A OE2 no hydrogen 3.037 N/A ILE 255.A N LEU 251.A O no hydrogen 2.763 N/A SER 256.A N VAL 252.A O no hydrogen 3.016 N/A SER 256.A OG VAL 252.A O no hydrogen 3.142 N/A SER 256.A OG SER 253.A O no hydrogen 2.964 N/A ALA 257.A N SER 253.A O no hydrogen 3.322 N/A ALA 257.A N ARG 254.A O no hydrogen 3.155 N/A ILE 258.A N ARG 254.A O no hydrogen 3.173 N/A PHE 259.A N ILE 255.A O no hydrogen 2.886 N/A SER 260.A N SER 256.A O no hydrogen 3.192 N/A SER 260.A OG ALA 257.A O no hydrogen 2.754 N/A THR 261.A N ILE 258.A O no hydrogen 3.148 N/A THR 261.A OG1 ILE 258.A O no hydrogen 2.522 N/A PHE 262.A N PHE 259.A O no hydrogen 3.155 N/A VAL 268.A N PRO 113.A O no hydrogen 3.083 N/A THR 273.A N ASN 271.A OD1 no hydrogen 2.772 N/A THR 273.A OG1 ASN 271.A OD1 no hydrogen 3.085 N/A TYR 274.A N ASN 271.A O no hydrogen 3.120 N/A VAL 275.A N ASN 271.A O no hydrogen 3.134 N/A VAL 277.A N TYR 274.A O no hydrogen 3.173 N/A