Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3erd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N ALA 3.A O no hydrogen 3.297 N/A THR 7.A N GLN 10.A OE1 no hydrogen 2.798 N/A GLN 10.A N THR 7.A OG1 no hydrogen 3.127 N/A MET 11.A N THR 7.A O no hydrogen 2.843 N/A VAL 12.A N ALA 8.A O no hydrogen 3.073 N/A SER 13.A N ASP 9.A O no hydrogen 2.983 N/A ALA 14.A N GLN 10.A O no hydrogen 2.901 N/A LEU 15.A N MET 11.A O no hydrogen 3.035 N/A LEU 16.A N VAL 12.A O no hydrogen 2.803 N/A ASP 17.A N.A SER 13.A O no hydrogen 2.922 N/A ASP 17.A N.B SER 13.A O no hydrogen 2.906 N/A ALA 18.A N ALA 14.A O no hydrogen 2.975 N/A ALA 18.A N LEU 15.A O no hydrogen 2.977 N/A GLU 19.A N LEU 16.A O no hydrogen 3.175 N/A SER 25.A N ASN 103.A OD1 no hydrogen 2.987 N/A SER 37.A N SER 34.A OG no hydrogen 2.939 N/A MET 38.A N SER 34.A O no hydrogen 2.714 N/A MET 39.A N GLU 35.A O no hydrogen 2.958 N/A GLY 40.A N ALA 36.A O no hydrogen 3.147 N/A LEU 41.A N SER 37.A O no hydrogen 3.185 N/A LEU 42.A N MET 38.A O no hydrogen 2.898 N/A THR 43.A N MET 39.A O no hydrogen 3.019 N/A THR 43.A OG1 MET 39.A O no hydrogen 2.656 N/A THR 43.A OG1 GLY 40.A O no hydrogen 3.328 N/A ASN 44.A N GLY 40.A O no hydrogen 2.944 N/A ASN 44.A ND2 TYR 233.A OH no hydrogen 2.784 N/A LEU 45.A N LEU 41.A O no hydrogen 2.998 N/A ALA 46.A N LEU 42.A O no hydrogen 2.960 N/A ASP 47.A N THR 43.A O no hydrogen 2.782 N/A ARG 48.A N ASN 44.A O no hydrogen 3.175 N/A ARG 48.A NE ASN 44.A OD1 no hydrogen 3.010 N/A ARG 48.A NH1 TYR 24.A O no hydrogen 2.841 N/A ARG 48.A NH2 TYR 24.A O no hydrogen 2.942 N/A ARG 48.A NH2 ASN 44.A OD1 no hydrogen 2.957 N/A GLU 49.A N LEU 45.A O no hydrogen 2.874 N/A LEU 50.A N ALA 46.A O no hydrogen 2.838 N/A MET 53.A N GLU 49.A O no hydrogen 2.784 N/A ILE 54.A N LEU 50.A O no hydrogen 2.999 N/A ASN 55.A N VAL 51.A O no hydrogen 3.425 N/A ASN 55.A ND2 VAL 51.A O no hydrogen 2.960 N/A TRP 56.A N HIS 52.A O no hydrogen 2.840 N/A ALA 57.A N MET 53.A O no hydrogen 2.813 N/A LYS 58.A N ILE 54.A O no hydrogen 3.445 N/A LYS 58.A NZ ASN 55.A OD1 no hydrogen 3.364 N/A ARG 59.A N.A TRP 56.A O no hydrogen 2.779 N/A ARG 59.A N.B TRP 56.A O no hydrogen 2.778 N/A ARG 59.A NH1.A ASP 17.A OD2.A no hydrogen 2.900 N/A ARG 59.A NH2.A ASP 17.A OD2.A no hydrogen 2.778 N/A VAL 60.A N ALA 57.A O no hydrogen 2.948 N/A PHE 63.A N VAL 60.A O no hydrogen 2.847 N/A ASP 65.A N GLY 62.A O no hydrogen 3.123 N/A LEU 66.A N PHE 63.A O no hydrogen 3.278 N/A ASP 70.A N THR 67.A OG1 no hydrogen 3.281 N/A GLN 71.A N THR 67.A O no hydrogen 2.781 N/A GLN 71.A NE2 PHE 63.A O no hydrogen 3.239 N/A GLN 71.A NE2 LEU 66.A O no hydrogen 3.020 N/A VAL 72.A N LEU 68.A O no hydrogen 2.770 N/A HIS 73.A N HIS 69.A O no hydrogen 3.067 N/A HIS 73.A NE2 GLY 153.A O no hydrogen 2.846 N/A LEU 74.A N ASP 70.A O no hydrogen 3.092 N/A LEU 75.A N GLN 71.A O no hydrogen 3.172 N/A GLU 76.A N VAL 72.A O no hydrogen 2.963 N/A CYS 77.A N HIS 73.A O no hydrogen 3.022 N/A ALA 78.A N LEU 74.A O no hydrogen 2.997 N/A TRP 79.A N LEU 75.A O no hydrogen 2.856 N/A ILE 82.A N ALA 78.A O no hydrogen 2.897 N/A LEU 83.A N TRP 79.A O no hydrogen 2.958 N/A MET 84.A N LEU 80.A O no hydrogen 2.902 N/A ILE 85.A N GLU 81.A O no hydrogen 3.000 N/A GLY 86.A N ILE 82.A O no hydrogen 3.228 N/A LEU 87.A N LEU 83.A O no hydrogen 2.991 N/A VAL 88.A N MET 84.A O no hydrogen 2.846 N/A TRP 89.A N ILE 85.A O no hydrogen 2.930 N/A ARG 90.A N GLY 86.A O no hydrogen 2.973 N/A ARG 90.A NE LEU 99.A O no hydrogen 2.959 N/A ARG 90.A NH2 PHE 100.A O no hydrogen 2.943 N/A SER 91.A N LEU 87.A O no hydrogen 3.010 N/A SER 91.A N VAL 88.A O no hydrogen 3.236 N/A SER 91.A OG LEU 87.A O no hydrogen 2.819 N/A MET 92.A N TRP 89.A O no hydrogen 3.447 N/A HIS 94.A N SER 91.A O no hydrogen 2.909 N/A LYS 97.A N HIS 94.A O no hydrogen 3.084 N/A LEU 98.A N LEU 106.A O no hydrogen 2.545 N/A LEU 99.A N SER 91.A OG no hydrogen 2.716 N/A ALA 101.A N LEU 104.A O no hydrogen 3.326 N/A ASN 103.A ND2 SER 25.A O no hydrogen 2.956 N/A LEU 104.A N ALA 101.A O no hydrogen 2.764 N/A LEU 106.A N LEU 98.A O no hydrogen 2.980 N/A ASP 107.A N GLN 110.A OE1 no hydrogen 2.850 N/A ARG 108.A NE ASP 122.A OD1 no hydrogen 2.867 N/A ARG 108.A NH2 ASP 122.A OD2 no hydrogen 2.985 N/A GLN 110.A N ASP 107.A O no hydrogen 2.917 N/A GLN 110.A N ASP 107.A OD1 no hydrogen 3.080 N/A GLY 111.A N ARG 108.A O no hydrogen 2.949 N/A LYS 112.A N ASN 109.A O no hydrogen 3.218 N/A CYS 113.A N GLN 110.A O no hydrogen 3.178 N/A CYS 113.A SG PHE 33.A O no hydrogen 3.933 N/A VAL 114.A N GLY 111.A O no hydrogen 3.445 N/A GLU 115.A N GLU 35.A OE1 no hydrogen 2.825 N/A MET 117.A N VAL 114.A O no hydrogen 3.080 N/A GLU 119.A N GLU 119.A OE1 no hydrogen 2.600 N/A PHE 121.A N MET 117.A O no hydrogen 2.991 N/A ASP 122.A N VAL 118.A O no hydrogen 3.036 N/A MET 123.A N GLU 119.A O no hydrogen 3.329 N/A LEU 124.A N ILE 120.A O no hydrogen 3.049 N/A LEU 125.A N PHE 121.A O no hydrogen 2.825 N/A ALA 126.A N ASP 122.A O no hydrogen 2.899 N/A THR 127.A N MET 123.A O no hydrogen 2.966 N/A THR 127.A OG1 MET 123.A O no hydrogen 2.918 N/A SER 128.A N LEU 124.A O no hydrogen 2.979 N/A SER 128.A OG VAL 88.A O no hydrogen 3.229 N/A SER 129.A N LEU 125.A O no hydrogen 2.733 N/A SER 129.A OG LEU 125.A O no hydrogen 3.340 N/A ARG 130.A N ALA 126.A O no hydrogen 2.890 N/A PHE 131.A N THR 127.A O no hydrogen 2.891 N/A ARG 132.A N SER 128.A O no hydrogen 3.005 N/A ARG 132.A NE MET 92.A O no hydrogen 2.664 N/A ARG 132.A NH2 MET 92.A O no hydrogen 3.403 N/A MET 133.A N SER 129.A O no hydrogen 2.927 N/A MET 134.A N ARG 130.A O no hydrogen 3.035 N/A ASN 135.A N ARG 132.A O no hydrogen 2.860 N/A LEU 136.A N PHE 131.A O no hydrogen 3.025 N/A GLN 137.A N GLU 140.A OE1 no hydrogen 2.825 N/A GLN 137.A NE2 ASN 135.A O no hydrogen 2.881 N/A PHE 141.A N GLN 137.A O no hydrogen 2.878 N/A VAL 142.A N GLY 138.A O no hydrogen 3.042 N/A CYS 143.A SG GLU 139.A O no hydrogen 3.362 N/A LEU 144.A N GLU 140.A O no hydrogen 2.897 N/A LYS 145.A N PHE 141.A O no hydrogen 2.958 N/A LYS 145.A NZ GLU 19.A OE1 no hydrogen 2.519 N/A LYS 145.A NZ GLU 19.A OE2 no hydrogen 3.345 N/A SER 146.A N VAL 142.A O no hydrogen 3.224 N/A SER 146.A OG VAL 142.A O no hydrogen 3.386 N/A ILE 147.A N CYS 143.A O no hydrogen 3.022 N/A ILE 148.A N LEU 144.A O no hydrogen 3.049 N/A LEU 149.A N LYS 145.A O no hydrogen 3.242 N/A LEU 150.A N SER 146.A O no hydrogen 3.071 N/A ASN 151.A N ILE 147.A O no hydrogen 2.766 N/A SER 152.A N ILE 148.A O no hydrogen 3.081 N/A SER 152.A OG GLU 81.A OE1 no hydrogen 2.571 N/A SER 152.A OG ILE 148.A O no hydrogen 3.029 N/A VAL 154.A N ASN 151.A O no hydrogen 3.201 N/A SER 164.A N SER 160.A O no hydrogen 3.383 N/A SER 164.A OG LEU 158.A O no hydrogen 3.211 N/A LEU 165.A N THR 161.A O no hydrogen 3.088 N/A GLU 166.A N LYS 163.A O no hydrogen 2.784 N/A GLU 167.A N LYS 163.A O no hydrogen 3.425 N/A ASP 169.A N LEU 165.A O no hydrogen 3.350 N/A HIS 170.A N GLU 166.A O no hydrogen 3.403 N/A HIS 172.A N LYS 168.A O no hydrogen 2.920 N/A HIS 172.A ND1 LYS 168.A O no hydrogen 2.970 N/A ARG 173.A N ASP 169.A O no hydrogen 2.771 N/A VAL 174.A N HIS 170.A O no hydrogen 3.078 N/A LEU 175.A N ILE 171.A O no hydrogen 2.879 N/A ASP 176.A N HIS 172.A O no hydrogen 2.925 N/A LYS 177.A N ARG 173.A O no hydrogen 2.932 N/A LYS 177.A NZ LEU 4.A O no hydrogen 3.319 N/A LYS 177.A NZ LEU 6.A O no hydrogen 3.040 N/A ILE 178.A N VAL 174.A O no hydrogen 2.939 N/A THR 179.A N LEU 175.A O no hydrogen 3.066 N/A THR 179.A OG1 LEU 175.A O no hydrogen 3.372 N/A ASP 180.A N ASP 176.A O no hydrogen 2.991 N/A THR 181.A N LYS 177.A O no hydrogen 2.938 N/A THR 181.A OG1 LYS 177.A O no hydrogen 2.904 N/A LEU 182.A N ILE 178.A O no hydrogen 2.930 N/A ILE 183.A N THR 179.A O no hydrogen 2.920 N/A HIS 184.A N ASP 180.A O no hydrogen 2.743 N/A HIS 184.A NE2 ASP 9.A OD1 no hydrogen 2.932 N/A LEU 185.A N THR 181.A O no hydrogen 2.826 N/A MET 186.A N LEU 182.A O no hydrogen 3.079 N/A ALA 187.A N ILE 183.A O no hydrogen 2.861 N/A LYS 188.A N HIS 184.A O no hydrogen 2.994 N/A LYS 188.A NZ ASP 9.A OD2 no hydrogen 2.799 N/A LYS 188.A NZ HIS 184.A NE2 no hydrogen 2.441 N/A ALA 189.A N LEU 185.A O no hydrogen 3.154 N/A ALA 189.A N MET 186.A O no hydrogen 3.120 N/A GLY 190.A N ALA 187.A O no hydrogen 2.952 N/A LEU 191.A N MET 186.A O no hydrogen 3.248 N/A THR 192.A N GLN 195.A OE1 no hydrogen 2.879 N/A GLN 195.A N THR 192.A OG1 no hydrogen 2.991 N/A GLN 196.A N THR 192.A O no hydrogen 2.879 N/A GLN 196.A NE2 LEU 191.A O no hydrogen 2.757 N/A GLN 196.A NE2 THR 192.A O no hydrogen 3.385 N/A HIS 197.A N LEU 193.A O no hydrogen 3.150 N/A GLN 198.A N GLN 194.A O no hydrogen 3.058 N/A ARG 199.A N GLN 195.A O no hydrogen 2.962 N/A ARG 199.A NE GLU 140.A OE2 no hydrogen 2.629 N/A ARG 199.A NH1 MET 134.A O no hydrogen 3.063 N/A ARG 199.A NH2 MET 134.A O no hydrogen 2.993 N/A ARG 199.A NH2 GLU 140.A OE1 no hydrogen 3.010 N/A ARG 199.A NH2 GLU 140.A OE2 no hydrogen 3.509 N/A LEU 200.A N GLN 196.A O no hydrogen 2.900 N/A ALA 201.A N HIS 197.A O no hydrogen 3.039 N/A GLN 202.A N GLN 198.A O no hydrogen 2.957 N/A LEU 203.A N ARG 199.A O no hydrogen 2.843 N/A LEU 204.A N LEU 200.A O no hydrogen 3.040 N/A LEU 205.A N ALA 201.A O no hydrogen 2.883 N/A ILE 206.A N LEU 203.A O no hydrogen 3.117 N/A LEU 207.A N LEU 204.A O no hydrogen 3.116 N/A SER 208.A N LEU 205.A O no hydrogen 3.004 N/A ILE 210.A N ILE 206.A O no hydrogen 2.887 N/A ARG 211.A N LEU 207.A O no hydrogen 2.919 N/A ARG 211.A NH1 SER 152.A O no hydrogen 3.251 N/A ARG 211.A NH2 SER 152.A O no hydrogen 3.095 N/A HIS 212.A N SER 208.A O no hydrogen 2.989 N/A MET 213.A N HIS 209.A O no hydrogen 2.878 N/A SER 214.A N ILE 210.A O no hydrogen 3.017 N/A ASN 215.A N ARG 211.A O no hydrogen 2.966 N/A LYS 216.A N HIS 212.A O no hydrogen 3.085 N/A LYS 216.A NZ GLU 219.A OE1 no hydrogen 3.548 N/A GLY 217.A N MET 213.A O no hydrogen 2.680 N/A MET 218.A N SER 214.A O no hydrogen 2.741 N/A GLU 219.A N ASN 215.A O no hydrogen 3.051 N/A HIS 220.A N LYS 216.A O no hydrogen 2.913 N/A HIS 220.A NE2 GLU 115.A O no hydrogen 2.790 N/A LEU 221.A N GLY 217.A O no hydrogen 2.765 N/A TYR 222.A N MET 218.A O no hydrogen 2.886 N/A SER 223.A N GLU 219.A O no hydrogen 2.974 N/A MET 224.A N HIS 220.A O no hydrogen 2.873 N/A LYS 225.A N LEU 221.A O no hydrogen 2.889 N/A CYS 226.A N TYR 222.A O no hydrogen 3.346 N/A CYS 226.A SG TYR 222.A O no hydrogen 3.434 N/A LYS 227.A N SER 223.A O no hydrogen 3.209 N/A ASN 228.A N LYS 225.A O no hydrogen 2.668 N/A VAL 229.A N MET 224.A O no hydrogen 2.973 N/A TYR 233.A N PRO 231.A O no hydrogen 3.097 N/A LEU 236.A N ASP 47.A OD1 no hydrogen 3.012 N/A LEU 237.A N TYR 233.A O no hydrogen 2.912 N/A GLU 238.A N ASP 234.A O no hydrogen 2.741 N/A MET 239.A N LEU 235.A O no hydrogen 3.001 N/A LEU 240.A N LEU 236.A O no hydrogen 3.047 N/A ASP 241.A N LEU 237.A O no hydrogen 2.936 N/A ALA 242.A N GLU 238.A O no hydrogen 3.155 N/A ALA 242.A N MET 239.A O no hydrogen 3.192 N/A HIS 243.A N LEU 240.A O no hydrogen 3.172 N/A HIS 243.A NE2 GLU 76.A O no hydrogen 2.709 N/A