Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6kke_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N GLU 8.A OE1 no hydrogen 3.109 N/A THR 5.A OG1 GLU 7.A OE1 no hydrogen 3.233 N/A GLU 8.A N THR 5.A OG1 no hydrogen 3.252 N/A TRP 9.A N THR 5.A O no hydrogen 2.890 N/A GLU 10.A N ASP 6.A O no hydrogen 3.213 N/A LEU 11.A N GLU 7.A O no hydrogen 3.122 N/A ILE 12.A N GLU 8.A O no hydrogen 2.724 N/A LYS 13.A N TRP 9.A O no hydrogen 2.942 N/A THR 14.A N GLU 10.A O no hydrogen 3.094 N/A THR 14.A OG1 GLU 10.A O no hydrogen 3.189 N/A VAL 15.A N LEU 11.A O no hydrogen 3.144 N/A THR 16.A N ILE 12.A O no hydrogen 2.985 N/A THR 16.A OG1 ILE 12.A O no hydrogen 2.878 N/A THR 16.A OG1 THR 151.A OG1 no hydrogen 2.771 N/A GLU 17.A N LYS 13.A O no hydrogen 2.946 N/A ALA 18.A N THR 14.A O no hydrogen 2.984 N/A HIS 19.A N VAL 15.A O no hydrogen 2.872 N/A VAL 20.A N THR 16.A O no hydrogen 2.886 N/A ALA 21.A N GLU 17.A O no hydrogen 3.153 N/A THR 22.A N HIS 19.A O no hydrogen 3.081 N/A THR 22.A OG1 ALA 18.A O no hydrogen 2.659 N/A THR 22.A OG1 HIS 19.A O no hydrogen 3.234 N/A GLY 26.A N ASN 23.A O no hydrogen 2.940 N/A SER 27.A OG HIS 28.A ND1 no hydrogen 3.090 N/A HIS 28.A N GLN 25.A O no hydrogen 2.746 N/A HIS 28.A ND1 SER 27.A OG no hydrogen 3.090 N/A TRP 29.A N GLY 26.A O no hydrogen 3.487 N/A GLN 31.A N HIS 28.A O no hydrogen 2.865 N/A LYS 32.A N HIS 28.A O no hydrogen 3.179 N/A ARG 33.A NH1 ASP 105.A OD2 no hydrogen 3.186 N/A ARG 33.A NH2 ASP 105.A OD2 no hydrogen 3.450 N/A LYS 34.A N GLU 116.A O no hydrogen 2.835 N/A LEU 36.A N ALA 118.A O no hydrogen 3.064 N/A ILE 40.A N PRO 37.A O no hydrogen 3.124 N/A GLY 41.A N ASP 48.A OD2 no hydrogen 2.716 N/A ASP 48.A N ASN 126.A O no hydrogen 3.235 N/A GLU 50.A N ASP 48.A OD1 no hydrogen 3.331 N/A PHE 52.A N ASP 48.A O no hydrogen 3.140 N/A SER 53.A N LEU 49.A O no hydrogen 3.236 N/A SER 53.A OG LEU 49.A O no hydrogen 3.264 N/A HIS 54.A N GLU 50.A O no hydrogen 3.378 N/A PHE 55.A N ALA 51.A O no hydrogen 3.156 N/A THR 56.A N PHE 52.A O no hydrogen 2.793 N/A THR 56.A OG1 PHE 52.A O no hydrogen 2.897 N/A LYS 57.A N SER 53.A O no hydrogen 2.980 N/A ILE 58.A N PHE 55.A O no hydrogen 3.284 N/A ILE 63.A N ILE 59.A O no hydrogen 3.023 N/A THR 64.A N THR 60.A O no hydrogen 3.016 N/A THR 64.A OG1 THR 60.A O no hydrogen 3.085 N/A ARG 65.A N PRO 61.A O no hydrogen 3.021 N/A ARG 65.A NH1 ASN 114.A OD1 no hydrogen 2.833 N/A ARG 65.A NH2 ASN 114.A OD1 no hydrogen 3.197 N/A VAL 66.A N ALA 62.A O no hydrogen 3.331 N/A VAL 67.A N ILE 63.A O no hydrogen 2.932 N/A ASP 68.A N THR 64.A O no hydrogen 2.885 N/A PHE 69.A N ARG 65.A O no hydrogen 2.860 N/A ALA 70.A N VAL 66.A O no hydrogen 3.021 N/A LYS 71.A N VAL 67.A O no hydrogen 3.060 N/A LYS 72.A N PHE 69.A O no hydrogen 3.057 N/A LEU 73.A N ALA 70.A O no hydrogen 2.973 N/A PHE 76.A N LEU 73.A O no hydrogen 2.991 N/A CYS 77.A N LEU 73.A O no hydrogen 3.248 N/A CYS 77.A SG LYS 71.A O no hydrogen 3.169 N/A CYS 77.A SG LEU 73.A O no hydrogen 3.510 N/A GLU 78.A N PRO 74.A O no hydrogen 3.086 N/A LEU 79.A N PHE 76.A O no hydrogen 3.266 N/A GLN 84.A N PRO 80.A O no hydrogen 3.171 N/A GLN 84.A NE2 PHE 76.A O no hydrogen 2.716 N/A ILE 85.A N CYS 81.A O no hydrogen 3.293 N/A ILE 86.A N GLU 82.A O no hydrogen 3.235 N/A LEU 87.A N ASP 83.A O no hydrogen 2.813 N/A LEU 88.A N GLN 84.A O no hydrogen 2.861 N/A LYS 89.A N ILE 85.A O no hydrogen 3.011 N/A GLY 90.A N ILE 86.A O no hydrogen 3.189 N/A CYS 91.A N LEU 87.A O no hydrogen 3.240 N/A CYS 91.A SG LEU 87.A O no hydrogen 3.126 N/A CYS 91.A SG LEU 88.A O no hydrogen 4.007 N/A CYS 92.A N LEU 88.A O no hydrogen 3.092 N/A CYS 92.A SG LEU 88.A O no hydrogen 3.183 N/A ILE 95.A N CYS 91.A O no hydrogen 2.793 N/A ILE 95.A N CYS 92.A O no hydrogen 3.160 N/A MET 96.A N CYS 92.A O no hydrogen 2.966 N/A SER 97.A N MET 93.A O no hydrogen 2.973 N/A SER 97.A OG MET 93.A O no hydrogen 2.529 N/A LEU 98.A N GLU 94.A O no hydrogen 3.115 N/A ARG 99.A N ILE 95.A O no hydrogen 2.799 N/A ARG 99.A NE GLN 157.A OE1 no hydrogen 2.817 N/A ARG 99.A NH1 THR 22.A O no hydrogen 3.275 N/A ARG 99.A NH2 HIS 19.A ND1 no hydrogen 3.115 N/A ARG 99.A NH2 THR 22.A OG1 no hydrogen 3.055 N/A ALA 100.A N MET 96.A O no hydrogen 2.878 N/A ALA 101.A N SER 97.A O no hydrogen 2.821 N/A VAL 102.A N LEU 98.A O no hydrogen 2.984 N/A ARG 103.A N ALA 100.A O no hydrogen 2.973 N/A ARG 103.A NH1 ALA 24.A O no hydrogen 2.935 N/A ARG 103.A NH2 ALA 24.A O no hydrogen 3.011 N/A TYR 104.A N ALA 101.A O no hydrogen 3.293 N/A ASP 105.A N THR 110.A O no hydrogen 2.934 N/A GLU 107.A N ASP 105.A OD1 no hydrogen 3.103 N/A SER 108.A OG ASP 105.A OD2 no hydrogen 2.888 N/A SER 108.A OG THR 110.A OG1 no hydrogen 2.427 N/A THR 110.A N ASP 105.A O no hydrogen 3.362 N/A THR 110.A OG1 SER 108.A OG no hydrogen 2.427 N/A LEU 111.A N VAL 119.A O no hydrogen 3.042 N/A LEU 113.A N MET 117.A O no hydrogen 2.724 N/A GLU 116.A N LEU 113.A O no hydrogen 2.912 N/A MET 117.A N LEU 113.A O no hydrogen 2.926 N/A ALA 118.A N LYS 34.A O no hydrogen 3.012 N/A VAL 119.A N LEU 111.A O no hydrogen 2.819 N/A THR 120.A N GLN 123.A OE1 no hydrogen 2.983 N/A THR 120.A OG1 GLN 123.A OE1 no hydrogen 3.055 N/A ARG 121.A NH1 ASP 134.A OD1 no hydrogen 2.774 N/A ARG 121.A NH1 ASP 138.A OD1 no hydrogen 3.310 N/A ARG 121.A NH2 ASP 138.A OD1 no hydrogen 3.057 N/A GLN 123.A N THR 120.A OG1 no hydrogen 3.294 N/A GLN 123.A NE2 LEU 36.A O no hydrogen 3.051 N/A GLN 123.A NE2 ILE 40.A O no hydrogen 2.992 N/A LEU 124.A N THR 120.A O no hydrogen 3.149 N/A LYS 125.A N ARG 121.A O no hydrogen 2.925 N/A LYS 125.A NZ ASP 134.A OD2 no hydrogen 2.678 N/A ASN 126.A N GLY 122.A O no hydrogen 2.848 N/A GLY 127.A N GLN 123.A O no hydrogen 2.882 N/A GLY 128.A N LYS 125.A O no hydrogen 3.302 N/A LEU 129.A N LEU 124.A O no hydrogen 3.400 N/A GLY 130.A N LYS 125.A O no hydrogen 3.154 N/A SER 133.A N GLY 130.A O no hydrogen 3.062 N/A SER 133.A OG ARG 121.A O no hydrogen 3.176 N/A ALA 135.A N VAL 131.A O no hydrogen 3.186 N/A ILE 136.A N VAL 132.A O no hydrogen 3.130 N/A PHE 137.A N SER 133.A O no hydrogen 3.194 N/A ASP 138.A N ASP 134.A O no hydrogen 2.988 N/A LEU 139.A N ALA 135.A O no hydrogen 3.055 N/A GLY 140.A N ILE 136.A O no hydrogen 2.891 N/A MET 141.A N PHE 137.A O no hydrogen 2.950 N/A SER 142.A N ASP 138.A O no hydrogen 3.113 N/A SER 142.A OG LEU 139.A O no hydrogen 3.232 N/A LEU 143.A N GLY 140.A O no hydrogen 3.256 N/A SER 144.A OG MET 141.A O no hydrogen 3.471 N/A SER 145.A OG SER 142.A O no hydrogen 3.483 N/A ASN 147.A N SER 144.A O no hydrogen 3.095 N/A ASP 149.A N GLU 152.A OE1 no hydrogen 2.655 N/A THR 151.A OG1 THR 16.A OG1 no hydrogen 2.771 N/A GLU 152.A N ASP 149.A OD1 no hydrogen 2.851 N/A VAL 153.A N ASP 149.A O no hydrogen 2.944 N/A ALA 154.A N ASP 150.A O no hydrogen 2.866 N/A LEU 155.A N THR 151.A O no hydrogen 3.008 N/A LEU 156.A N GLU 152.A O no hydrogen 3.110 N/A GLN 157.A N VAL 153.A O no hydrogen 3.032 N/A ALA 158.A N ALA 154.A O no hydrogen 3.031 N/A VAL 159.A N LEU 155.A O no hydrogen 2.809 N/A LEU 160.A N LEU 156.A O no hydrogen 2.964 N/A LEU 161.A N GLN 157.A O no hydrogen 2.825 N/A MET 162.A N ALA 158.A O no hydrogen 2.962 N/A SER 163.A OG LEU 160.A O no hydrogen 2.901 N/A ARG 166.A NH1 GLU 94.A OE2 no hydrogen 3.299 N/A ARG 166.A NH2 GLU 94.A OE1 no hydrogen 2.784 N/A ARG 166.A NH2 GLU 94.A OE2 no hydrogen 3.149 N/A ARG 166.A NH2 LEU 160.A O no hydrogen 3.375 N/A ALA 170.A N ASP 83.A OD1 no hydrogen 3.156 N/A ALA 170.A N ASP 83.A OD2 no hydrogen 3.378 N/A CYS 171.A N ASP 83.A OD2 no hydrogen 2.863 N/A CYS 171.A SG ASP 83.A OD2 no hydrogen 3.232 N/A ARG 174.A NH1 GLU 78.A O no hydrogen 3.523 N/A ARG 174.A NH1 TYR 178.A OH no hydrogen 3.477 N/A ILE 175.A N CYS 171.A O no hydrogen 2.660 N/A GLU 176.A N VAL 172.A O no hydrogen 2.997 N/A LYS 177.A N GLU 173.A O no hydrogen 2.963 N/A TYR 178.A N ARG 174.A O no hydrogen 3.084 N/A GLN 179.A N ILE 175.A O no hydrogen 3.012 N/A GLN 179.A NE2 VAL 159.A O no hydrogen 2.774 N/A ASP 180.A N GLU 176.A O no hydrogen 3.123 N/A SER 181.A N LYS 177.A O no hydrogen 3.312 N/A PHE 182.A N TYR 178.A O no hydrogen 3.235 N/A LEU 183.A N GLN 179.A O no hydrogen 2.947 N/A LEU 184.A N ASP 180.A O no hydrogen 3.069 N/A ALA 185.A N SER 181.A O no hydrogen 3.173 N/A PHE 186.A N PHE 182.A O no hydrogen 2.696 N/A GLU 187.A N LEU 183.A O no hydrogen 2.802 N/A HIS 188.A N LEU 184.A O no hydrogen 2.895 N/A HIS 188.A ND1 GLU 8.A OE1 no hydrogen 2.813 N/A TYR 189.A N ALA 185.A O no hydrogen 2.750 N/A TYR 189.A OH ASP 149.A OD2 no hydrogen 2.718 N/A ILE 190.A N PHE 186.A O no hydrogen 2.826 N/A ASN 191.A N GLU 187.A O no hydrogen 2.791 N/A ASN 191.A ND2 PRO 2.A O no hydrogen 2.940 N/A TYR 192.A N HIS 188.A O no hydrogen 2.971 N/A ARG 193.A N ILE 190.A O no hydrogen 3.207 N/A ARG 193.A NE GLU 152.A OE2 no hydrogen 3.058 N/A ARG 193.A NH2 GLU 152.A OE1 no hydrogen 3.227 N/A LYS 194.A NZ GLU 3.A OE1 no hydrogen 3.310 N/A LYS 194.A NZ ASN 191.A O no hydrogen 3.388 N/A HIS 195.A NE2 GLU 152.A OE2 no hydrogen 2.756 N/A THR 198.A OG1 HIS 199.A ND1 no hydrogen 2.968 N/A LYS 203.A N HIS 199.A O no hydrogen 3.023 N/A LYS 203.A NZ THR 198.A O no hydrogen 2.410 N/A LEU 204.A N PHE 200.A O no hydrogen 2.824 N/A LEU 205.A N TRP 201.A O no hydrogen 2.939 N/A MET 206.A N PRO 202.A O no hydrogen 3.125 N/A LYS 207.A N LYS 203.A O no hydrogen 3.175 N/A LYS 207.A NZ ASP 210.A OD2 no hydrogen 2.762 N/A VAL 208.A N LEU 204.A O no hydrogen 3.129 N/A THR 209.A N LEU 205.A O no hydrogen 3.475 N/A THR 209.A OG1 LEU 205.A O no hydrogen 3.432 N/A ASP 210.A N MET 206.A O no hydrogen 3.040 N/A LEU 211.A N LYS 207.A O no hydrogen 2.956 N/A ARG 212.A N VAL 208.A O no hydrogen 2.986 N/A ARG 212.A NH1 SER 163.A OG no hydrogen 2.953 N/A ARG 212.A NH2 SER 163.A OG no hydrogen 2.292 N/A MET 213.A N THR 209.A O no hydrogen 2.920 N/A ILE 214.A N ASP 210.A O no hydrogen 2.999 N/A GLY 215.A N LEU 211.A O no hydrogen 2.830 N/A ALA 216.A N ARG 212.A O no hydrogen 2.914 N/A CYS 217.A N MET 213.A O no hydrogen 2.909 N/A CYS 217.A N ILE 214.A O no hydrogen 2.940 N/A CYS 217.A SG MET 213.A O no hydrogen 3.399 N/A LEU 218.A N ILE 214.A O no hydrogen 2.848 N/A ALA 219.A N GLY 215.A O no hydrogen 3.319 N/A SER 220.A N ALA 216.A O no hydrogen 3.322 N/A ARG 221.A N CYS 217.A O no hydrogen 2.744 N/A PHE 222.A N LEU 218.A O no hydrogen 2.931 N/A HIS 224.A N SER 220.A O no hydrogen 3.378 N/A MET 225.A N PHE 222.A O no hydrogen 3.172 N/A LYS 226.A N LEU 223.A O no hydrogen 3.285 N/A CYS 229.A SG MET 225.A O no hydrogen 3.693 N/A LEU 233.A N PRO 230.A O no hydrogen 2.811 N/A PHE 234.A N THR 231.A O no hydrogen 3.036 N/A LEU 239.A N PRO 235.A O no hydrogen 3.242 N/A GLU 240.A N PRO 236.A O no hydrogen 3.246 N/A GLU 240.A N LEU 237.A O no hydrogen 3.234 N/A VAL 241.A N PHE 238.A O no hydrogen 3.138 N/A