Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pp9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N VAL 69.A O no hydrogen 2.866 N/A ASP 4.A N GLU 7.A OE1 no hydrogen 3.226 N/A GLU 7.A N ASP 4.A O no hydrogen 3.066 N/A LEU 8.A N PRO 5.A O no hydrogen 3.288 N/A THR 9.A N TYR 26.A O no hydrogen 3.047 N/A VAL 11.A N LEU 24.A O no hydrogen 2.877 N/A GLN 12.A N LEU 24.A O no hydrogen 3.167 N/A ILE 14.A N VAL 22.A O no hydrogen 2.894 N/A GLY 15.A N VAL 22.A O no hydrogen 3.214 N/A GLY 17.A N GLY 20.A O no hydrogen 2.913 N/A LEU 21.A N THR 37.A O no hydrogen 3.058 N/A VAL 22.A N GLY 15.A O no hydrogen 2.761 N/A HIS 23.A N ILE 35.A O no hydrogen 2.839 N/A LEU 24.A N GLN 12.A O no hydrogen 2.771 N/A GLY 25.A N VAL 33.A O no hydrogen 3.000 N/A TYR 26.A N THR 9.A O no hydrogen 3.144 N/A TRP 27.A N ASP 31.A O no hydrogen 2.934 N/A TRP 27.A NE1 GLU 7.A OE1 no hydrogen 3.043 N/A LEU 28.A N GLU 7.A O no hydrogen 2.829 N/A LYS 30.A N TRP 27.A O no hydrogen 3.116 N/A LYS 30.A NZ ASP 31.A OD2 no hydrogen 3.122 N/A ASP 31.A N TRP 27.A O no hydrogen 3.291 N/A LYS 32.A NZ GLU 84.A OE2 no hydrogen 2.995 N/A VAL 33.A N GLY 25.A O no hydrogen 2.798 N/A ALA 34.A N PHE 80.A O no hydrogen 3.114 N/A ILE 35.A N HIS 23.A O no hydrogen 2.829 N/A LYS 36.A N LEU 78.A O no hydrogen 2.771 N/A THR 37.A N LEU 21.A O no hydrogen 2.818 N/A THR 37.A OG1 LEU 21.A O no hydrogen 3.022 N/A ILE 38.A N ILE 76.A O no hydrogen 2.867 N/A ARG 39.A N PHE 19.A O no hydrogen 2.962 N/A ARG 39.A NH1 GLN 18.A O no hydrogen 2.838 N/A PHE 48.A N SER 44.A O no hydrogen 3.113 N/A ILE 49.A N GLU 45.A O no hydrogen 3.084 N/A GLU 50.A N GLU 46.A O no hydrogen 2.983 N/A GLU 51.A N ASP 47.A O no hydrogen 3.041 N/A GLU 53.A N ILE 49.A O no hydrogen 2.880 N/A VAL 54.A N GLU 50.A O no hydrogen 3.065 N/A MET 55.A N GLU 51.A O no hydrogen 3.301 N/A MET 56.A N ALA 52.A O no hydrogen 3.008 N/A LYS 57.A N VAL 54.A O no hydrogen 3.156 N/A LEU 58.A N MET 55.A O no hydrogen 3.327 N/A LYS 62.A N HIS 60.A ND1 no hydrogen 3.116 N/A LEU 63.A N HIS 60.A O no hydrogen 3.106 N/A VAL 64.A N VAL 143.A O no hydrogen 2.952 N/A GLN 65.A N GLU 81.A OE2 no hydrogen 2.802 N/A TYR 67.A N VAL 79.A O no hydrogen 2.737 N/A GLY 68.A N VAL 79.A O no hydrogen 3.372 N/A VAL 69.A N SER 1.A O no hydrogen 2.999 N/A CYS 70.A N CYS 77.A O no hydrogen 3.137 N/A CYS 70.A SG ILE 3.A O no hydrogen 3.540 N/A CYS 77.A N CYS 70.A O no hydrogen 3.103 N/A LEU 78.A N LYS 36.A O no hydrogen 2.961 N/A VAL 79.A N GLY 68.A O no hydrogen 3.056 N/A PHE 80.A N ALA 34.A O no hydrogen 2.830 N/A GLU 81.A N GLN 65.A O no hydrogen 2.970 N/A HIS 85.A N VAL 135.A O no hydrogen 3.109 N/A GLY 86.A N MET 83.A O no hydrogen 3.018 N/A CYS 87.A SG ASP 90.A OD2 no hydrogen 3.915 N/A CYS 87.A SG ARG 131.A O no hydrogen 3.767 N/A LEU 88.A N CYS 133.A O no hydrogen 2.772 N/A SER 89.A N ALA 130.A O no hydrogen 3.228 N/A TYR 91.A N CYS 87.A O no hydrogen 2.862 N/A LEU 92.A N LEU 88.A O no hydrogen 2.814 N/A ARG 93.A N SER 89.A O no hydrogen 3.182 N/A ARG 93.A NE GLY 182.A O no hydrogen 2.862 N/A ARG 93.A NH2 GLY 182.A O no hydrogen 2.992 N/A THR 94.A N ASP 90.A O no hydrogen 3.227 N/A THR 94.A OG1 ASP 90.A O no hydrogen 2.990 N/A ARG 96.A NE GLU 181.A O no hydrogen 2.977 N/A ARG 96.A NH2 GLU 181.A O no hydrogen 2.798 N/A GLY 97.A N GLU 181.A OE2 no hydrogen 2.915 N/A LEU 98.A N GLN 95.A O no hydrogen 3.163 N/A GLU 102.A N GLU 102.A OE2 no hydrogen 3.006 N/A THR 103.A N ALA 100.A O no hydrogen 3.028 N/A LEU 104.A N ALA 100.A O no hydrogen 3.195 N/A LEU 105.A N ALA 101.A O no hydrogen 3.119 N/A GLY 106.A N GLU 102.A O no hydrogen 3.254 N/A MET 107.A N THR 103.A O no hydrogen 3.074 N/A MET 107.A N LEU 104.A O no hydrogen 3.197 N/A CYS 108.A N LEU 104.A O no hydrogen 3.272 N/A CYS 108.A SG LEU 104.A O no hydrogen 3.451 N/A LEU 109.A N LEU 105.A O no hydrogen 2.945 N/A ASP 110.A N GLY 106.A O no hydrogen 3.063 N/A VAL 111.A N MET 107.A O no hydrogen 3.080 N/A CYS 112.A N CYS 108.A O no hydrogen 2.813 N/A CYS 112.A SG PHE 232.A O no hydrogen 3.592 N/A GLU 113.A N LEU 109.A O no hydrogen 2.898 N/A GLY 114.A N ASP 110.A O no hydrogen 3.229 N/A MET 115.A N VAL 111.A O no hydrogen 2.789 N/A ALA 116.A N CYS 112.A O no hydrogen 2.811 N/A TYR 117.A N GLU 113.A O no hydrogen 3.318 N/A LEU 118.A N GLY 114.A O no hydrogen 3.138 N/A GLU 119.A N MET 115.A O no hydrogen 2.864 N/A GLU 120.A N ALA 116.A O no hydrogen 3.130 N/A ALA 121.A N TYR 117.A O no hydrogen 3.013 N/A CYS 122.A N GLU 119.A O no hydrogen 3.125 N/A VAL 123.A N LEU 118.A O no hydrogen 2.789 N/A HIS 125.A N ASP 167.A OD2 no hydrogen 2.907 N/A HIS 125.A NE2 SER 144.A O no hydrogen 2.809 N/A ARG 126.A N ASP 167.A OD1 no hydrogen 2.970 N/A ASP 127.A N HIS 125.A ND1 no hydrogen 3.153 N/A ALA 130.A N GLU 177.A OE2 no hydrogen 2.895 N/A ARG 131.A NH1 ASP 127.A OD1 no hydrogen 3.380 N/A ARG 131.A NH1 ASP 127.A OD2 no hydrogen 3.209 N/A ASN 132.A N ALA 129.A O no hydrogen 3.106 N/A ASN 132.A ND2 ASP 127.A OD2 no hydrogen 3.308 N/A CYS 133.A N ALA 130.A O no hydrogen 3.238 N/A CYS 133.A SG ALA 129.A O no hydrogen 3.671 N/A LEU 134.A N LYS 142.A O no hydrogen 2.829 N/A VAL 135.A N GLY 86.A O no hydrogen 2.737 N/A GLY 136.A N VAL 140.A O no hydrogen 3.039 N/A ILE 141.A N ASP 110.A OD2 no hydrogen 3.208 N/A LYS 142.A N LEU 134.A O no hydrogen 2.843 N/A LYS 142.A NZ GLU 81.A OE1 no hydrogen 3.089 N/A LYS 142.A NZ GLU 81.A OE2 no hydrogen 2.821 N/A VAL 143.A N LYS 62.A O no hydrogen 2.819 N/A SER 144.A N ASN 132.A O no hydrogen 3.042 N/A SER 144.A OG ASN 132.A O no hydrogen 2.781 N/A SER 144.A OG ASP 145.A OD1 no hydrogen 3.454 N/A LYS 150.A NZ PRO 185.A O no hydrogen 3.027 N/A LYS 150.A NZ TYR 186.A O no hydrogen 2.865 N/A TRP 151.A N PRO 148.A O no hydrogen 3.186 N/A TRP 151.A NE1 GLU 177.A OE2 no hydrogen 2.820 N/A ALA 152.A N VAL 149.A O no hydrogen 3.030 N/A SER 153.A OG GLU 155.A OE1 no hydrogen 2.725 N/A SER 153.A OG SER 166.A OG no hydrogen 3.106 N/A VAL 156.A N SER 153.A O no hydrogen 2.830 N/A PHE 157.A N SER 153.A O no hydrogen 3.029 N/A SER 158.A N PRO 154.A O no hydrogen 3.310 N/A SER 158.A OG PRO 154.A O no hydrogen 2.913 N/A PHE 159.A N GLU 155.A O no hydrogen 3.066 N/A ARG 161.A N GLU 155.A O no hydrogen 3.056 N/A LYS 165.A NZ PRO 226.A O no hydrogen 3.209 N/A LYS 165.A NZ ARG 229.A O no hydrogen 2.950 N/A SER 166.A N SER 163.A O no hydrogen 3.014 N/A SER 166.A N SER 163.A OG no hydrogen 3.189 N/A SER 166.A OG SER 153.A OG no hydrogen 3.106 N/A SER 166.A OG GLU 155.A OE1 no hydrogen 3.404 N/A SER 166.A OG ARG 161.A O no hydrogen 3.232 N/A ASP 167.A N SER 163.A O no hydrogen 3.310 N/A VAL 168.A N SER 164.A O no hydrogen 3.070 N/A TRP 169.A N LYS 165.A O no hydrogen 3.317 N/A SER 170.A N SER 166.A O no hydrogen 3.319 N/A SER 170.A OG TRP 151.A O no hydrogen 2.875 N/A SER 170.A OG SER 166.A O no hydrogen 3.323 N/A PHE 171.A N ASP 167.A O no hydrogen 2.772 N/A GLY 172.A N VAL 168.A O no hydrogen 2.964 N/A VAL 173.A N TRP 169.A O no hydrogen 3.122 N/A LEU 174.A N SER 170.A O no hydrogen 2.785 N/A MET 175.A N PHE 171.A O no hydrogen 2.748 N/A TRP 176.A N GLY 172.A O no hydrogen 3.161 N/A TRP 176.A NE1 TYR 205.A O no hydrogen 2.900 N/A GLU 177.A N VAL 173.A O no hydrogen 2.905 N/A VAL 178.A N LEU 174.A O no hydrogen 2.921 N/A PHE 179.A N MET 175.A O no hydrogen 2.886 N/A SER 180.A OG TRP 176.A O no hydrogen 3.115 N/A GLU 181.A N VAL 178.A O no hydrogen 3.199 N/A GLY 182.A N GLU 177.A O no hydrogen 2.955 N/A ARG 189.A N TYR 186.A O no hydrogen 3.116 N/A SER 190.A N GLU 193.A OE1 no hydrogen 2.814 N/A GLU 193.A N SER 190.A OG no hydrogen 3.240 N/A VAL 194.A N SER 190.A O no hydrogen 2.914 N/A VAL 195.A N ASN 191.A O no hydrogen 3.323 N/A GLU 196.A N SER 192.A O no hydrogen 3.220 N/A ASP 197.A N GLU 193.A O no hydrogen 3.035 N/A ILE 198.A N VAL 194.A O no hydrogen 3.161 N/A SER 199.A N VAL 195.A O no hydrogen 2.931 N/A SER 199.A OG VAL 195.A O no hydrogen 2.726 N/A THR 200.A N GLU 196.A O no hydrogen 3.037 N/A THR 200.A OG1 GLU 196.A O no hydrogen 2.875 N/A THR 200.A OG1 ASP 197.A O no hydrogen 2.862 N/A GLY 201.A N ILE 198.A O no hydrogen 2.948 N/A PHE 202.A N ASP 197.A O no hydrogen 2.833 N/A ARG 203.A NE TRP 222.A O no hydrogen 2.858 N/A ARG 203.A NH1 ILE 198.A O no hydrogen 2.928 N/A ARG 203.A NH1 PHE 202.A O no hydrogen 3.015 N/A ARG 203.A NH2 TRP 222.A O no hydrogen 2.826 N/A LYS 206.A NZ PRO 207.A O no hydrogen 3.425 N/A LYS 206.A NZ ARG 208.A O no hydrogen 3.462 N/A LYS 206.A NZ ALA 210.A O no hydrogen 2.957 N/A ALA 210.A N PRO 207.A O no hydrogen 2.922 N/A VAL 214.A N SER 211.A OG no hydrogen 3.173 N/A TYR 215.A N SER 211.A O no hydrogen 3.307 N/A TYR 215.A OH LEU 204.A O no hydrogen 2.704 N/A GLN 216.A N THR 212.A O no hydrogen 2.926 N/A ILE 217.A N HIS 213.A O no hydrogen 3.373 N/A MET 218.A N VAL 214.A O no hydrogen 3.096 N/A ASN 219.A N TYR 215.A O no hydrogen 2.902 N/A ASN 219.A ND2 TYR 215.A O no hydrogen 2.798 N/A HIS 220.A N GLN 216.A O no hydrogen 3.146 N/A HIS 220.A N ILE 217.A O no hydrogen 3.032 N/A CYS 221.A N ILE 217.A O no hydrogen 3.050 N/A CYS 221.A SG ILE 217.A O no hydrogen 3.440 N/A GLU 227.A N GLU 227.A OE1 no hydrogen 2.901 N/A ASP 228.A N ARG 225.A O no hydrogen 3.439 N/A ARG 229.A N PRO 226.A O no hydrogen 3.169 N/A ARG 229.A NE LYS 223.A O no hydrogen 2.732 N/A ARG 229.A NH1 GLU 155.A OE1 no hydrogen 3.037 N/A ARG 229.A NH1 LYS 165.A O no hydrogen 2.897 N/A ARG 229.A NH2 GLU 155.A OE2 no hydrogen 2.724 N/A ARG 229.A NH2 LYS 223.A O no hydrogen 3.092 N/A PHE 232.A N GLU 119.A OE1 no hydrogen 2.971 N/A SER 233.A N GLU 119.A OE2 no hydrogen 3.234 N/A LEU 235.A N ALA 231.A O no hydrogen 2.859 N/A LEU 236.A N PHE 232.A O no hydrogen 2.943 N/A ARG 237.A NH1 SER 233.A O no hydrogen 2.956 N/A GLN 238.A N ARG 234.A O no hydrogen 3.144 N/A GLN 238.A NE2 HIS 220.A ND1 no hydrogen 3.290 N/A LEU 239.A N LEU 235.A O no hydrogen 3.105 N/A ALA 240.A N LEU 236.A O no hydrogen 3.262 N/A GLU 241.A N ARG 237.A O no hydrogen 3.205 N/A ILE 242.A N LEU 239.A O no hydrogen 3.315 N/A ALA 243.A N LEU 239.A O no hydrogen 3.092 N/A GLU 244.A N ALA 240.A O no hydrogen 3.346 N/A SER 245.A OG GLU 241.A O no hydrogen 2.711 N/A