Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5kct_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG ASP 67.A OD2 no hydrogen 2.317 N/A ALA 5.A N SER 3.A OG no hydrogen 3.304 N/A LEU 6.A N SER 3.A O no hydrogen 3.363 N/A SER 7.A N LEU 4.A O no hydrogen 2.863 N/A SER 7.A OG.A LEU 4.A O no hydrogen 2.647 N/A LEU 8.A N ALA 5.A O no hydrogen 3.352 N/A THR 9.A N GLN 12.A OE1 no hydrogen 3.125 N/A GLN 12.A N THR 9.A OG1 no hydrogen 3.000 N/A MET 13.A N THR 9.A O no hydrogen 2.870 N/A VAL 14.A N ALA 10.A O no hydrogen 3.007 N/A SER 15.A N ASP 11.A O no hydrogen 3.025 N/A SER 15.A OG ASP 11.A O no hydrogen 2.979 N/A ALA 16.A N GLN 12.A O no hydrogen 2.851 N/A LEU 17.A N MET 13.A O no hydrogen 2.983 N/A LEU 18.A N VAL 14.A O no hydrogen 2.879 N/A ASP 19.A N SER 15.A O no hydrogen 2.981 N/A ALA 20.A N ALA 16.A O no hydrogen 3.059 N/A ALA 20.A N LEU 17.A O no hydrogen 3.237 N/A GLU 21.A N LEU 18.A O no hydrogen 3.279 N/A SER 27.A N ASN 105.A OD1 no hydrogen 2.917 N/A SER 27.A OG.A GLU 28.A O no hydrogen 3.440 N/A SER 27.A OG.A ASN 105.A OD1 no hydrogen 3.000 N/A THR 32.A N ASP 30.A OD1 no hydrogen 3.224 N/A THR 32.A OG1 ASP 30.A OD1 no hydrogen 2.881 N/A THR 32.A OG1 ASP 30.A OD2 no hydrogen 3.156 N/A SER 36.A N SER 39.A OG no hydrogen 3.355 N/A SER 36.A OG SER 39.A OG no hydrogen 2.735 N/A SER 39.A N SER 36.A OG no hydrogen 3.115 N/A SER 39.A OG SER 36.A O no hydrogen 3.278 N/A SER 39.A OG SER 36.A OG no hydrogen 2.735 N/A MET 40.A N SER 36.A O no hydrogen 2.966 N/A MET 41.A N GLU 37.A O no hydrogen 2.829 N/A GLY 42.A N ALA 38.A O no hydrogen 2.969 N/A LEU 43.A N SER 39.A O no hydrogen 3.177 N/A LEU 44.A N MET 40.A O no hydrogen 3.012 N/A THR 45.A N MET 41.A O no hydrogen 2.938 N/A THR 45.A OG1.A MET 41.A O no hydrogen 2.834 N/A THR 45.A OG1.A GLY 42.A O no hydrogen 2.945 N/A THR 45.A OG1.B MET 41.A O no hydrogen 2.211 N/A ASN 46.A N GLY 42.A O no hydrogen 3.301 N/A LEU 47.A N LEU 43.A O no hydrogen 3.014 N/A ALA 48.A N LEU 44.A O no hydrogen 2.841 N/A ASP 49.A N THR 45.A O no hydrogen 2.983 N/A ARG 50.A N ASN 46.A O no hydrogen 3.222 N/A ARG 50.A NE ASN 46.A OD1 no hydrogen 2.799 N/A ARG 50.A NH1 TYR 26.A O no hydrogen 2.892 N/A ARG 50.A NH2 TYR 26.A O no hydrogen 2.867 N/A ARG 50.A NH2 ASN 46.A OD1 no hydrogen 2.961 N/A GLU 51.A N LEU 47.A O no hydrogen 2.813 N/A LEU 52.A N ALA 48.A O no hydrogen 2.816 N/A MET 55.A N GLU 51.A O no hydrogen 2.831 N/A ILE 56.A N LEU 52.A O no hydrogen 2.925 N/A ASN 57.A N VAL 53.A O no hydrogen 3.310 N/A ASN 57.A ND2 VAL 53.A O no hydrogen 2.794 N/A TRP 58.A N HIS 54.A O no hydrogen 2.828 N/A ALA 59.A N MET 55.A O no hydrogen 2.843 N/A LYS 60.A N ILE 56.A O no hydrogen 3.434 N/A ARG 61.A N TRP 58.A O no hydrogen 2.869 N/A ARG 61.A NH2 ASP 19.A OD2 no hydrogen 2.564 N/A VAL 62.A N ALA 59.A O no hydrogen 3.008 N/A PHE 65.A N VAL 62.A O no hydrogen 2.966 N/A ASP 67.A N GLY 64.A O no hydrogen 3.208 N/A LEU 68.A N PHE 65.A O no hydrogen 3.142 N/A ASP 72.A N THR 69.A OG1 no hydrogen 3.141 N/A GLN 73.A N THR 69.A O no hydrogen 2.955 N/A GLN 73.A NE2 PHE 65.A O no hydrogen 3.101 N/A GLN 73.A NE2 LEU 68.A O no hydrogen 3.120 N/A VAL 74.A N LEU 70.A O no hydrogen 2.810 N/A HIS 75.A N HIS 71.A O no hydrogen 3.027 N/A HIS 75.A NE2 GLY 155.A O no hydrogen 2.875 N/A HIS 75.A NE2 THR 158.A OG1 no hydrogen 2.842 N/A LEU 76.A N ASP 72.A O no hydrogen 3.000 N/A LEU 77.A N GLN 73.A O no hydrogen 3.150 N/A GLU 78.A N VAL 74.A O no hydrogen 2.910 N/A CYS 79.A N HIS 75.A O no hydrogen 2.965 N/A CYS 79.A SG HIS 75.A O no hydrogen 3.288 N/A ALA 80.A N LEU 76.A O no hydrogen 2.992 N/A TRP 81.A N LEU 77.A O no hydrogen 2.958 N/A ILE 84.A N ALA 80.A O no hydrogen 2.925 N/A LEU 85.A N TRP 81.A O no hydrogen 2.948 N/A MET 86.A N LEU 82.A O no hydrogen 2.867 N/A ILE 87.A N GLU 83.A O no hydrogen 2.876 N/A GLY 88.A N ILE 84.A O no hydrogen 3.112 N/A LEU 89.A N LEU 85.A O no hydrogen 2.955 N/A VAL 90.A N MET 86.A O no hydrogen 2.937 N/A TRP 91.A N ILE 87.A O no hydrogen 2.966 N/A ARG 92.A N GLY 88.A O no hydrogen 2.997 N/A ARG 92.A NE LEU 101.A O no hydrogen 2.924 N/A ARG 92.A NE PHE 102.A O no hydrogen 3.188 N/A ARG 92.A NH2 PHE 102.A O no hydrogen 2.990 N/A SER 93.A N VAL 90.A O no hydrogen 3.203 N/A SER 93.A OG LEU 89.A O no hydrogen 2.669 N/A MET 94.A N TRP 91.A O no hydrogen 3.258 N/A HIS 96.A N SER 93.A O no hydrogen 2.953 N/A LYS 99.A N HIS 96.A O no hydrogen 2.949 N/A LEU 100.A N LEU 108.A O no hydrogen 2.920 N/A LEU 101.A N SER 93.A OG no hydrogen 2.824 N/A ALA 103.A N LEU 106.A O no hydrogen 3.189 N/A ASN 105.A ND2 SER 27.A O no hydrogen 2.949 N/A LEU 106.A N ALA 103.A O no hydrogen 2.795 N/A LEU 108.A N LEU 100.A O no hydrogen 2.914 N/A ASP 109.A N GLN 112.A OE1 no hydrogen 3.056 N/A ARG 110.A NE ASP 124.A OD1 no hydrogen 2.882 N/A ARG 110.A NH1 ASP 124.A OD2 no hydrogen 2.932 N/A GLN 112.A N ASP 109.A O no hydrogen 2.974 N/A GLN 112.A N ASP 109.A OD1 no hydrogen 3.306 N/A GLN 112.A NE2 PRO 34.A O no hydrogen 3.059 N/A LYS 114.A N ARG 110.A O no hydrogen 2.955 N/A LYS 114.A NZ ASN 111.A OD1 no hydrogen 3.115 N/A CYS 115.A N GLN 112.A O no hydrogen 3.389 N/A CYS 115.A SG ASN 111.A O no hydrogen 3.704 N/A VAL 116.A N GLY 113.A O no hydrogen 2.992 N/A MET 119.A N VAL 116.A O no hydrogen 3.072 N/A GLU 121.A N GLU 121.A OE1 no hydrogen 2.720 N/A PHE 123.A N MET 119.A O no hydrogen 2.833 N/A ASP 124.A N VAL 120.A O no hydrogen 2.808 N/A MET 125.A N GLU 121.A O no hydrogen 3.265 N/A LEU 126.A N ILE 122.A O no hydrogen 2.890 N/A LEU 127.A N PHE 123.A O no hydrogen 2.900 N/A ALA 128.A N ASP 124.A O no hydrogen 2.873 N/A THR 129.A N MET 125.A O no hydrogen 3.097 N/A THR 129.A OG1 MET 125.A O no hydrogen 2.767 N/A SER 130.A N LEU 126.A O no hydrogen 2.947 N/A SER 130.A OG VAL 90.A O no hydrogen 3.496 N/A SER 131.A N LEU 127.A O no hydrogen 2.958 N/A ARG 132.A N ALA 128.A O no hydrogen 2.998 N/A PHE 133.A N THR 129.A O no hydrogen 2.910 N/A ARG 134.A N SER 130.A O no hydrogen 2.867 N/A MET 135.A N SER 131.A O no hydrogen 2.884 N/A MET 136.A N ARG 132.A O no hydrogen 3.001 N/A ASN 137.A N ARG 134.A O no hydrogen 3.016 N/A LEU 138.A N PHE 133.A O no hydrogen 3.058 N/A GLN 139.A N GLU 142.A OE2 no hydrogen 2.917 N/A GLU 141.A N GLU 141.A OE1 no hydrogen 2.746 N/A PHE 143.A N GLN 139.A O no hydrogen 2.906 N/A VAL 144.A N GLY 140.A O no hydrogen 3.016 N/A CYS 145.A N GLU 141.A O no hydrogen 3.372 N/A CYS 145.A SG GLU 141.A O no hydrogen 3.435 N/A LEU 146.A N GLU 142.A O no hydrogen 2.945 N/A LYS 147.A N PHE 143.A O no hydrogen 2.963 N/A LYS 147.A NZ GLU 21.A OE1 no hydrogen 3.307 N/A LYS 147.A NZ GLU 21.A OE2 no hydrogen 2.673 N/A SER 148.A N VAL 144.A O no hydrogen 3.154 N/A SER 148.A OG.A VAL 144.A O no hydrogen 3.439 N/A SER 148.A OG.B VAL 144.A O no hydrogen 3.275 N/A SER 148.A OG.B CYS 145.A O no hydrogen 2.432 N/A ILE 149.A N CYS 145.A O no hydrogen 2.991 N/A ILE 150.A N LEU 146.A O no hydrogen 2.998 N/A LEU 151.A N LYS 147.A O no hydrogen 3.126 N/A LEU 152.A N SER 148.A O no hydrogen 3.095 N/A ASN 153.A N ILE 149.A O no hydrogen 2.807 N/A SER 154.A N ILE 150.A O no hydrogen 2.966 N/A SER 154.A OG GLU 83.A OE1 no hydrogen 3.375 N/A SER 154.A OG GLU 83.A OE2 no hydrogen 2.670 N/A SER 154.A OG ILE 150.A O no hydrogen 3.141 N/A VAL 156.A N ASN 153.A O no hydrogen 3.180 N/A THR 158.A N GLY 155.A O no hydrogen 3.238 N/A THR 158.A OG1 HIS 75.A NE2 no hydrogen 2.842 N/A THR 158.A OG1 GLY 155.A O no hydrogen 2.933 N/A HIS 162.A NE2 GLY 64.A O no hydrogen 2.871 N/A HIS 164.A N LYS 160.A O no hydrogen 3.136 N/A ARG 165.A N ASP 161.A O no hydrogen 2.942 N/A ARG 165.A NE.B ASP 161.A OD2.B no hydrogen 2.849 N/A ARG 165.A NH2.B ASP 161.A OD2.B no hydrogen 2.716 N/A VAL 166.A N HIS 162.A O no hydrogen 2.980 N/A LEU 167.A N ILE 163.A O no hydrogen 2.846 N/A ASP 168.A N HIS 164.A O no hydrogen 2.876 N/A LYS 169.A N ARG 165.A O no hydrogen 3.003 N/A LYS 169.A NZ LEU 6.A O no hydrogen 3.070 N/A LYS 169.A NZ LEU 8.A O no hydrogen 3.168 N/A ILE 170.A N VAL 166.A O no hydrogen 2.975 N/A THR 171.A N LEU 167.A O no hydrogen 2.966 N/A THR 171.A OG1 LEU 167.A O no hydrogen 3.387 N/A ASP 172.A N ASP 168.A O no hydrogen 2.955 N/A THR 173.A N LYS 169.A O no hydrogen 2.985 N/A THR 173.A OG1 LYS 169.A O no hydrogen 2.799 N/A LEU 174.A N ILE 170.A O no hydrogen 2.842 N/A ILE 175.A N THR 171.A O no hydrogen 3.023 N/A HIS 176.A N ASP 172.A O no hydrogen 2.959 N/A HIS 176.A NE2 ASP 11.A OD1 no hydrogen 2.895 N/A LEU 177.A N THR 173.A O no hydrogen 2.962 N/A MET 178.A N LEU 174.A O no hydrogen 3.079 N/A ALA 179.A N ILE 175.A O no hydrogen 2.798 N/A LYS 180.A N HIS 176.A O no hydrogen 2.824 N/A LYS 180.A NZ ASP 11.A OD1 no hydrogen 3.209 N/A ALA 181.A N LEU 177.A O no hydrogen 3.015 N/A ALA 181.A N MET 178.A O no hydrogen 3.162 N/A GLY 182.A N ALA 179.A O no hydrogen 2.951 N/A LEU 183.A N MET 178.A O no hydrogen 3.120 N/A THR 184.A N GLN 187.A OE1 no hydrogen 2.807 N/A GLN 187.A N THR 184.A OG1 no hydrogen 3.270 N/A GLN 188.A N THR 184.A O no hydrogen 2.888 N/A GLN 188.A NE2 LEU 183.A O no hydrogen 2.866 N/A HIS 189.A N LEU 185.A O no hydrogen 3.313 N/A GLN 190.A N GLN 186.A O no hydrogen 3.017 N/A ARG 191.A N GLN 187.A O no hydrogen 2.922 N/A ARG 191.A NE GLU 142.A OE1 no hydrogen 2.778 N/A ARG 191.A NH1 MET 136.A O no hydrogen 2.850 N/A ARG 191.A NH2 MET 136.A O no hydrogen 2.897 N/A ARG 191.A NH2 GLU 142.A OE1 no hydrogen 3.538 N/A ARG 191.A NH2 GLU 142.A OE2 no hydrogen 2.896 N/A LEU 192.A N GLN 188.A O no hydrogen 2.978 N/A ALA 193.A N HIS 189.A O no hydrogen 3.053 N/A GLN 194.A N GLN 190.A O no hydrogen 2.948 N/A LEU 195.A N ARG 191.A O no hydrogen 2.952 N/A LEU 196.A N LEU 192.A O no hydrogen 3.089 N/A LEU 197.A N ALA 193.A O no hydrogen 2.901 N/A ILE 198.A N GLN 194.A O no hydrogen 3.238 N/A LEU 199.A N LEU 196.A O no hydrogen 3.091 N/A SER 200.A N LEU 197.A O no hydrogen 3.047 N/A HIS 201.A NE2 MET 125.A O no hydrogen 3.253 N/A ILE 202.A N ILE 198.A O no hydrogen 2.942 N/A ARG 203.A N LEU 199.A O no hydrogen 2.955 N/A ARG 203.A NE GLU 83.A OE1 no hydrogen 3.242 N/A HIS 204.A N SER 200.A O no hydrogen 3.018 N/A MET 205.A N HIS 201.A O no hydrogen 2.769 N/A SER 206.A N ILE 202.A O no hydrogen 2.951 N/A ASN 207.A N ARG 203.A O no hydrogen 2.895 N/A LYS 208.A N HIS 204.A O no hydrogen 3.090 N/A LYS 208.A NZ GLU 211.A OE2 no hydrogen 3.394 N/A GLY 209.A N MET 205.A O no hydrogen 2.779 N/A MET 210.A N SER 206.A O no hydrogen 2.854 N/A GLU 211.A N ASN 207.A O no hydrogen 3.363 N/A HIS 212.A N LYS 208.A O no hydrogen 3.209 N/A HIS 212.A ND1 LYS 208.A O no hydrogen 2.953 N/A LEU 213.A N GLY 209.A O no hydrogen 2.869 N/A TYR 214.A N MET 210.A O no hydrogen 2.978 N/A SER 215.A N GLU 211.A O no hydrogen 3.012 N/A MET 216.A N HIS 212.A O no hydrogen 2.878 N/A LYS 217.A N LEU 213.A O no hydrogen 2.901 N/A CYS 218.A N TYR 214.A O no hydrogen 2.965 N/A CYS 218.A SG TYR 214.A O no hydrogen 3.387 N/A LYS 219.A N SER 215.A O no hydrogen 2.993 N/A ASN 220.A N LYS 217.A O no hydrogen 3.034 N/A SER 225.A OG ASP 49.A OD1 no hydrogen 2.690 N/A SER 225.A OG ASP 49.A OD2 no hydrogen 2.977 N/A LEU 228.A N SER 225.A OG no hydrogen 3.192 N/A LEU 229.A N SER 225.A O no hydrogen 2.914 N/A GLU 230.A N ASP 226.A O no hydrogen 2.964 N/A MET 231.A N LEU 227.A O no hydrogen 2.893 N/A LEU 232.A N LEU 228.A O no hydrogen 2.878 N/A ASP 233.A N.A LEU 229.A O no hydrogen 2.822 N/A ASP 233.A N.B LEU 229.A O no hydrogen 2.835 N/A HIS 235.A N LEU 232.A O no hydrogen 3.022 N/A HIS 235.A NE2 GLU 78.A O no hydrogen 2.656 N/A ARG 236.A N ASP 233.A O.A no hydrogen 3.076 N/A ARG 236.A N ASP 233.A O.B no hydrogen 3.136 N/A