Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2x81_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASP 6.A OD2 no hydrogen 3.140 N/A ASP 6.A N ALA 3.A O no hydrogen 3.143 N/A PHE 7.A N LEU 4.A O no hydrogen 3.389 N/A GLU 8.A N ARG 22.A O no hydrogen 2.964 N/A GLY 10.A N LEU 20.A O no hydrogen 2.581 N/A LEU 13.A N VAL 18.A O no hydrogen 2.659 N/A GLY 14.A N VAL 18.A O no hydrogen 3.205 N/A ASN 17.A ND2 TYR 19.A OH no hydrogen 3.315 N/A TYR 19.A N LEU 32.A O no hydrogen 3.015 N/A LEU 20.A N ARG 11.A O no hydrogen 2.908 N/A ALA 21.A N LEU 30.A O no hydrogen 2.771 N/A ARG 22.A N GLU 8.A O no hydrogen 3.155 N/A ARG 22.A NE GLU 8.A OE2 no hydrogen 3.127 N/A ARG 22.A NH2 GLU 8.A OE2 no hydrogen 2.713 N/A GLU 23.A N PHE 28.A O no hydrogen 2.984 N/A LYS 24.A N ASP 6.A O no hydrogen 2.769 N/A LYS 24.A NZ GLU 5.A O no hydrogen 2.640 N/A SER 26.A N GLU 23.A OE1 no hydrogen 2.924 N/A SER 26.A OG GLU 23.A OE1 no hydrogen 2.951 N/A LYS 27.A N GLU 23.A O no hydrogen 2.789 N/A LEU 30.A N ALA 21.A O no hydrogen 2.907 N/A ALA 31.A N LEU 81.A O no hydrogen 3.180 N/A LEU 32.A N TYR 19.A O no hydrogen 2.793 N/A LYS 33.A N LEU 79.A O no hydrogen 2.849 N/A VAL 34.A N ASN 17.A O no hydrogen 2.801 N/A LEU 35.A N VAL 77.A O no hydrogen 3.087 N/A LYS 37.A N THR 75.A O no hydrogen 2.689 N/A LEU 40.A N PHE 36.A O no hydrogen 3.410 N/A GLU 41.A N LYS 37.A O no hydrogen 3.150 N/A LYS 42.A N ALA 38.A O no hydrogen 2.945 N/A ALA 43.A N GLN 39.A O no hydrogen 2.956 N/A GLY 44.A N LEU 40.A O no hydrogen 2.885 N/A LEU 49.A N VAL 45.A O no hydrogen 3.005 N/A ARG 50.A N GLU 46.A O no hydrogen 2.807 N/A ARG 51.A N HIS 47.A O no hydrogen 2.931 N/A GLU 52.A N GLN 48.A O no hydrogen 2.980 N/A VAL 53.A N LEU 49.A O no hydrogen 2.947 N/A GLU 54.A N ARG 50.A O no hydrogen 3.321 N/A ILE 55.A N ARG 51.A O no hydrogen 2.960 N/A GLN 56.A N GLU 52.A O no hydrogen 2.838 N/A SER 57.A N VAL 53.A O no hydrogen 3.165 N/A SER 57.A OG VAL 53.A O no hydrogen 2.720 N/A HIS 58.A N ILE 55.A O no hydrogen 3.167 N/A ARG 60.A N TYR 117.A OH no hydrogen 2.931 N/A ARG 60.A NH1 SER 57.A O no hydrogen 3.221 N/A ARG 60.A NH2 SER 57.A O no hydrogen 2.623 N/A ARG 60.A NH2 LEU 59.A O no hydrogen 2.910 N/A ASN 63.A N HIS 61.A ND1 no hydrogen 3.020 N/A ASN 63.A ND2 GLU 110.A OE1 no hydrogen 3.257 N/A ASN 63.A ND2 LEU 141.A O no hydrogen 2.905 N/A ILE 64.A N HIS 61.A O no hydrogen 3.174 N/A LEU 65.A N ILE 143.A O no hydrogen 2.923 N/A ARG 66.A N GLU 82.A OE2 no hydrogen 2.845 N/A TYR 68.A N ILE 80.A O no hydrogen 2.807 N/A GLY 69.A N ILE 80.A O no hydrogen 3.444 N/A PHE 71.A N TYR 78.A O no hydrogen 2.996 N/A ASP 73.A N ARG 76.A O no hydrogen 2.825 N/A VAL 77.A N LEU 35.A O no hydrogen 2.628 N/A TYR 78.A N PHE 71.A O no hydrogen 2.610 N/A LEU 79.A N LYS 33.A O no hydrogen 2.827 N/A ILE 80.A N GLY 69.A O no hydrogen 2.768 N/A LEU 81.A N ALA 31.A O no hydrogen 2.806 N/A GLU 82.A N ARG 66.A O no hydrogen 2.755 N/A LEU 86.A N LEU 135.A O no hydrogen 3.109 N/A GLY 87.A N ALA 84.A O no hydrogen 3.225 N/A VAL 89.A N LEU 133.A O no hydrogen 2.764 N/A ARG 91.A N THR 88.A OG1 no hydrogen 2.961 N/A GLU 92.A N THR 88.A O no hydrogen 3.266 N/A LEU 93.A N VAL 89.A O no hydrogen 2.841 N/A GLN 94.A N TYR 90.A O no hydrogen 3.285 N/A LYS 95.A N ARG 91.A O no hydrogen 3.010 N/A LEU 96.A N LEU 93.A O no hydrogen 3.359 N/A LYS 98.A N LEU 96.A O no hydrogen 2.705 N/A PHE 99.A N PHE 176.A O no hydrogen 2.703 N/A ARG 103.A N ASP 100.A OD1 no hydrogen 2.795 N/A ARG 103.A NH1 GLU 92.A OE1 no hydrogen 3.154 N/A THR 104.A N ASP 100.A O no hydrogen 2.999 N/A THR 104.A OG1 ASP 100.A O no hydrogen 2.922 N/A ALA 105.A N GLU 101.A O no hydrogen 2.873 N/A THR 106.A N GLN 102.A O no hydrogen 3.336 N/A THR 106.A OG1 GLN 102.A O no hydrogen 2.918 N/A THR 106.A OG1 SER 242.A OG no hydrogen 3.106 N/A TYR 107.A N ARG 103.A O no hydrogen 3.221 N/A ILE 108.A N THR 104.A O no hydrogen 2.906 N/A THR 109.A N ALA 105.A O no hydrogen 2.808 N/A THR 109.A OG1 ALA 105.A O no hydrogen 2.587 N/A THR 109.A OG1 SER 241.A OG no hydrogen 2.895 N/A GLU 110.A N THR 106.A O no hydrogen 2.819 N/A LEU 111.A N TYR 107.A O no hydrogen 2.776 N/A ALA 112.A N ILE 108.A O no hydrogen 2.779 N/A ASN 113.A N THR 109.A O no hydrogen 2.957 N/A ALA 114.A N GLU 110.A O no hydrogen 3.067 N/A LEU 115.A N LEU 111.A O no hydrogen 2.767 N/A SER 116.A N ALA 112.A O no hydrogen 2.865 N/A TYR 117.A N ASN 113.A O no hydrogen 3.011 N/A CYS 118.A N ALA 114.A O no hydrogen 3.191 N/A CYS 118.A SG ALA 114.A O no hydrogen 3.183 N/A HIS 119.A N LEU 115.A O no hydrogen 2.696 N/A HIS 119.A NE2 ASP 165.A OD2 no hydrogen 2.841 N/A SER 120.A N SER 116.A O no hydrogen 3.095 N/A SER 120.A OG SER 116.A O no hydrogen 3.162 N/A SER 120.A OG TYR 117.A O no hydrogen 2.733 N/A LYS 121.A N TYR 117.A O no hydrogen 3.208 N/A LYS 121.A N CYS 118.A O no hydrogen 3.120 N/A ARG 122.A N HIS 119.A O no hydrogen 3.345 N/A VAL 123.A N CYS 118.A O no hydrogen 2.802 N/A HIS 125.A N ASP 165.A OD2 no hydrogen 3.140 N/A ARG 126.A N ASP 165.A OD1 no hydrogen 2.832 N/A ASP 127.A N HIS 125.A ND1 no hydrogen 3.100 N/A ASN 132.A N LYS 129.A O no hydrogen 2.721 N/A ASN 132.A ND2 ASP 127.A O no hydrogen 3.084 N/A LEU 133.A N PRO 130.A O no hydrogen 2.869 N/A LEU 134.A N LYS 142.A O no hydrogen 2.799 N/A LEU 135.A N GLY 87.A O no hydrogen 2.765 N/A GLY 136.A N GLU 140.A O no hydrogen 2.846 N/A GLY 139.A N GLY 136.A O no hydrogen 2.914 N/A GLU 140.A N GLU 140.A OE1 no hydrogen 2.624 N/A LEU 141.A N GLU 110.A OE1 no hydrogen 3.167 N/A LYS 142.A N LEU 134.A O no hydrogen 2.713 N/A LYS 142.A NZ PRO 62.A O no hydrogen 2.790 N/A LYS 142.A NZ GLU 82.A OE1 no hydrogen 3.262 N/A ILE 143.A N ASN 63.A O no hydrogen 2.827 N/A ALA 144.A N ASN 132.A O no hydrogen 3.059 N/A THR 146.A OG1 ASP 148.A OD1 no hydrogen 3.448 N/A TYR 149.A OH GLU 175.A OE1 no hydrogen 3.146 N/A TYR 149.A OH GLU 175.A OE2 no hydrogen 2.556 N/A LEU 150.A N LEU 147.A O no hydrogen 2.826 N/A GLU 153.A N GLU 153.A OE1 no hydrogen 3.068 N/A MET 154.A N PRO 151.A O no hydrogen 3.208 N/A ILE 155.A N PRO 151.A O no hydrogen 3.196 N/A GLU 156.A N PRO 152.A O no hydrogen 3.018 N/A GLY 157.A N MET 154.A O no hydrogen 2.960 N/A GLU 162.A N GLU 162.A OE1 no hydrogen 2.805 N/A LYS 163.A N ASP 161.A OD2 no hydrogen 3.285 N/A LYS 163.A NZ ARG 225.A O no hydrogen 2.775 N/A LYS 163.A NZ PRO 226.A O no hydrogen 3.043 N/A ASP 165.A N GLU 162.A O no hydrogen 3.320 N/A LEU 166.A N LYS 163.A O no hydrogen 3.096 N/A TRP 167.A N LYS 163.A O no hydrogen 3.283 N/A SER 168.A N VAL 164.A O no hydrogen 3.303 N/A SER 168.A OG TYR 149.A O no hydrogen 3.039 N/A SER 168.A OG VAL 164.A O no hydrogen 3.375 N/A LEU 169.A N ASP 165.A O no hydrogen 3.122 N/A GLY 170.A N LEU 166.A O no hydrogen 3.144 N/A VAL 171.A N TRP 167.A O no hydrogen 2.994 N/A LEU 172.A N SER 168.A O no hydrogen 2.835 N/A CYS 173.A N LEU 169.A O no hydrogen 2.968 N/A TYR 174.A N GLY 170.A O no hydrogen 3.007 N/A TYR 174.A OH THR 201.A O no hydrogen 2.507 N/A GLU 175.A N VAL 171.A O no hydrogen 3.036 N/A PHE 176.A N LEU 172.A O no hydrogen 2.968 N/A LEU 177.A N CYS 173.A O no hydrogen 3.285 N/A VAL 178.A N TYR 174.A O no hydrogen 2.845 N/A GLY 179.A N GLU 175.A O no hydrogen 2.665 N/A GLU 184.A N PRO 181.A O no hydrogen 3.208 N/A GLN 189.A N GLN 189.A OE1 no hydrogen 2.685 N/A GLU 190.A N THR 187.A OG1 no hydrogen 2.953 N/A THR 191.A N THR 187.A O no hydrogen 3.132 N/A THR 191.A OG1 THR 187.A O no hydrogen 2.695 N/A TYR 192.A N TYR 188.A O no hydrogen 2.986 N/A TYR 192.A OH ILE 155.A O no hydrogen 3.165 N/A LYS 193.A N GLN 189.A O no hydrogen 3.212 N/A ARG 194.A N GLU 190.A O no hydrogen 2.876 N/A ARG 194.A NE GLU 199.A O no hydrogen 3.231 N/A ARG 194.A NH1 GLU 199.A O no hydrogen 2.884 N/A ARG 194.A NH2 GLU 184.A O no hydrogen 2.911 N/A ILE 195.A N THR 191.A O no hydrogen 2.897 N/A SER 196.A N TYR 192.A O no hydrogen 3.058 N/A SER 196.A OG TYR 192.A O no hydrogen 3.105 N/A SER 196.A OG LYS 193.A O no hydrogen 3.071 N/A ARG 197.A N LYS 193.A O no hydrogen 2.976 N/A VAL 198.A N ILE 195.A O no hydrogen 2.848 N/A GLU 199.A N ARG 194.A O no hydrogen 2.870 N/A VAL 206.A N PRO 203.A O no hydrogen 3.229 N/A THR 207.A OG1 GLU 101.A OE1 no hydrogen 2.537 N/A ARG 211.A N THR 207.A O no hydrogen 2.858 N/A ARG 211.A NE VAL 206.A O no hydrogen 2.706 N/A ARG 211.A NH2 VAL 206.A O no hydrogen 3.417 N/A ASP 212.A N GLU 208.A O no hydrogen 2.871 N/A LEU 213.A N GLY 209.A O no hydrogen 3.459 N/A ILE 214.A N ALA 210.A O no hydrogen 2.966 N/A SER 215.A N ARG 211.A O no hydrogen 2.885 N/A SER 215.A OG ARG 211.A O no hydrogen 2.673 N/A ARG 216.A N ASP 212.A O no hydrogen 2.920 N/A ARG 216.A NE ASP 212.A OD1 no hydrogen 3.179 N/A ARG 216.A NE ASP 212.A OD2 no hydrogen 3.000 N/A ARG 216.A NH2 ASP 212.A OD1 no hydrogen 3.389 N/A LEU 217.A N LEU 213.A O no hydrogen 3.005 N/A LEU 218.A N ILE 214.A O no hydrogen 2.782 N/A GLN 224.A N ASN 221.A O no hydrogen 3.090 N/A ARG 225.A N PRO 222.A O no hydrogen 3.135 N/A ARG 225.A NE LYS 219.A O no hydrogen 2.908 N/A ARG 225.A NH1 GLU 153.A OE1 no hydrogen 2.723 N/A ARG 225.A NH1 GLU 153.A OE2 no hydrogen 3.491 N/A ARG 225.A NH1 LYS 219.A O no hydrogen 3.144 N/A ARG 225.A NH2 GLU 153.A OE2 no hydrogen 2.849 N/A ARG 225.A NH2 LYS 163.A O no hydrogen 2.878 N/A VAL 231.A N MET 227.A O no hydrogen 3.317 N/A LEU 232.A N LEU 228.A O no hydrogen 3.071 N/A GLU 233.A N GLU 230.A O no hydrogen 3.301 N/A HIS 234.A N VAL 231.A O no hydrogen 3.205 N/A HIS 234.A NE2 ASP 212.A OD2 no hydrogen 2.693 N/A TRP 236.A N HIS 234.A ND1 no hydrogen 3.132 N/A TRP 236.A NE1 GLU 101.A OE1 no hydrogen 2.720 N/A THR 238.A N HIS 234.A O no hydrogen 2.774 N/A THR 238.A OG1 GLU 233.A O no hydrogen 3.506 N/A THR 238.A OG1 HIS 234.A O no hydrogen 2.838 N/A ALA 239.A N PRO 235.A O no hydrogen 2.907 N/A ASN 240.A N ILE 237.A O no hydrogen 3.332 N/A ASN 240.A ND2 TRP 236.A O no hydrogen 2.763 N/A SER 241.A N ILE 237.A O no hydrogen 2.928 N/A SER 241.A OG THR 109.A OG1 no hydrogen 2.895 N/A SER 242.A N SER 241.A OG no hydrogen 2.655 N/A SER 242.A OG THR 106.A OG1 no hydrogen 3.106 N/A