Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q95_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N SER 1.A O no hydrogen 3.261 N/A SER 5.A N LEU 2.A O no hydrogen 3.068 N/A SER 5.A OG LEU 2.A O no hydrogen 2.723 N/A THR 7.A N GLN 10.A OE1 no hydrogen 2.958 N/A THR 7.A OG1 GLN 10.A OE1 no hydrogen 3.123 N/A GLN 10.A N THR 7.A OG1 no hydrogen 3.302 N/A MET 11.A N THR 7.A O no hydrogen 2.813 N/A VAL 12.A N ALA 8.A O no hydrogen 2.830 N/A SER 13.A N ASP 9.A O no hydrogen 2.916 N/A SER 13.A OG ASP 9.A O no hydrogen 3.000 N/A ALA 14.A N GLN 10.A O no hydrogen 3.005 N/A LEU 15.A N MET 11.A O no hydrogen 3.126 N/A LEU 16.A N VAL 12.A O no hydrogen 3.037 N/A ASP 17.A N SER 13.A O no hydrogen 2.900 N/A ALA 18.A N ALA 14.A O no hydrogen 3.107 N/A ALA 18.A N LEU 15.A O no hydrogen 3.156 N/A GLU 19.A N LEU 16.A O no hydrogen 3.142 N/A SER 25.A N ASN 102.A OD1 no hydrogen 3.074 N/A SER 25.A OG.A ASN 102.A OD1 no hydrogen 2.882 N/A TYR 27.A N SER 25.A OG.A no hydrogen 3.100 N/A TYR 27.A N SER 25.A OG.B no hydrogen 2.855 N/A THR 30.A N ASP 28.A OD2 no hydrogen 2.922 N/A THR 30.A OG1 ASP 28.A OD1 no hydrogen 2.675 N/A THR 30.A OG1 ASP 28.A OD2 no hydrogen 2.574 N/A ARG 31.A N ASP 28.A O no hydrogen 2.794 N/A SER 34.A N SER 37.A OG no hydrogen 3.028 N/A SER 37.A N SER 34.A OG no hydrogen 3.146 N/A SER 37.A OG SER 34.A O no hydrogen 3.403 N/A MET 38.A N SER 34.A O no hydrogen 2.913 N/A MET 39.A N GLU 35.A O no hydrogen 3.056 N/A GLY 40.A N ALA 36.A O no hydrogen 2.808 N/A LEU 41.A N SER 37.A O no hydrogen 2.804 N/A LEU 42.A N MET 38.A O no hydrogen 2.978 N/A THR 43.A N MET 39.A O no hydrogen 2.998 N/A THR 43.A OG1 MET 39.A O no hydrogen 2.578 N/A THR 43.A OG1 GLY 40.A O no hydrogen 3.357 N/A ASN 44.A N GLY 40.A O no hydrogen 3.015 N/A ASN 44.A ND2 GLU 26.A OE2 no hydrogen 3.433 N/A LEU 45.A N LEU 41.A O no hydrogen 3.123 N/A ALA 46.A N LEU 42.A O no hydrogen 2.943 N/A ASP 47.A N THR 43.A O no hydrogen 2.811 N/A ARG 48.A N ASN 44.A O no hydrogen 2.985 N/A ARG 48.A NE ASN 44.A OD1 no hydrogen 2.868 N/A ARG 48.A NH1 TYR 24.A O no hydrogen 2.788 N/A ARG 48.A NH2 TYR 24.A O no hydrogen 3.052 N/A ARG 48.A NH2 ASN 44.A OD1 no hydrogen 2.727 N/A GLU 49.A N LEU 45.A O no hydrogen 2.865 N/A LEU 50.A N ALA 46.A O no hydrogen 2.922 N/A MET 53.A N GLU 49.A O no hydrogen 2.822 N/A ILE 54.A N LEU 50.A O no hydrogen 2.931 N/A ASN 55.A N VAL 51.A O no hydrogen 3.324 N/A TRP 56.A N HIS 52.A O no hydrogen 2.826 N/A ALA 57.A N MET 53.A O no hydrogen 2.869 N/A LYS 58.A N ILE 54.A O no hydrogen 3.459 N/A ARG 59.A N TRP 56.A O no hydrogen 3.047 N/A ARG 59.A NH2.A ASN 55.A O no hydrogen 2.487 N/A VAL 60.A N ALA 57.A O no hydrogen 2.935 N/A PHE 63.A N VAL 60.A O no hydrogen 3.033 N/A ASP 65.A N GLY 62.A O no hydrogen 2.930 N/A LEU 66.A N PHE 63.A O no hydrogen 3.144 N/A ASP 70.A N THR 67.A OG1 no hydrogen 3.302 N/A GLN 71.A N THR 67.A O no hydrogen 2.927 N/A GLN 71.A NE2 LEU 66.A O no hydrogen 2.673 N/A VAL 72.A N LEU 68.A O no hydrogen 3.012 N/A HIS 73.A N HIS 69.A O no hydrogen 3.209 N/A HIS 73.A NE2 THR 155.A OG1 no hydrogen 2.897 N/A LEU 74.A N ASP 70.A O no hydrogen 3.015 N/A LEU 75.A N GLN 71.A O no hydrogen 3.188 N/A GLU 76.A N VAL 72.A O no hydrogen 2.881 N/A TRP 78.A N LEU 75.A O no hydrogen 3.050 N/A ILE 81.A N ALA 77.A O no hydrogen 2.936 N/A LEU 82.A N TRP 78.A O no hydrogen 3.020 N/A MET 83.A N LEU 79.A O no hydrogen 2.903 N/A ILE 84.A N GLU 80.A O no hydrogen 2.925 N/A GLY 85.A N ILE 81.A O no hydrogen 3.113 N/A LEU 86.A N LEU 82.A O no hydrogen 2.945 N/A VAL 87.A N MET 83.A O no hydrogen 2.911 N/A TRP 88.A N ILE 84.A O no hydrogen 2.994 N/A ARG 89.A N GLY 85.A O no hydrogen 2.880 N/A ARG 89.A NE LEU 98.A O no hydrogen 3.032 N/A ARG 89.A NH2 PHE 99.A O no hydrogen 2.922 N/A SER 90.A N LEU 86.A O no hydrogen 3.061 N/A SER 90.A N VAL 87.A O no hydrogen 3.130 N/A SER 90.A OG LEU 86.A O no hydrogen 2.722 N/A MET 91.A N TRP 88.A O no hydrogen 3.241 N/A HIS 93.A N SER 90.A O no hydrogen 2.839 N/A LYS 96.A N HIS 93.A O no hydrogen 2.882 N/A LEU 97.A N LEU 105.A O no hydrogen 2.658 N/A LEU 98.A N SER 90.A OG no hydrogen 2.879 N/A ALA 100.A N LEU 103.A O no hydrogen 3.140 N/A ASN 102.A ND2 SER 25.A O no hydrogen 2.875 N/A LEU 103.A N ALA 100.A O no hydrogen 2.900 N/A LEU 105.A N LEU 97.A O no hydrogen 2.794 N/A ASP 106.A N GLN 109.A OE1 no hydrogen 2.943 N/A ARG 107.A NE ASP 121.A OD2 no hydrogen 2.855 N/A ARG 107.A NH2 ASP 121.A OD1 no hydrogen 2.781 N/A GLN 109.A N ASP 106.A O no hydrogen 3.077 N/A GLN 109.A N ASP 106.A OD1 no hydrogen 2.932 N/A GLY 110.A N ASP 106.A O no hydrogen 3.288 N/A LYS 111.A N ASN 108.A O no hydrogen 3.300 N/A CYS 112.A N GLN 109.A O no hydrogen 3.148 N/A VAL 113.A N GLY 110.A O no hydrogen 3.123 N/A GLU 114.A N GLU 35.A OE2 no hydrogen 3.238 N/A MET 116.A N VAL 113.A O no hydrogen 3.154 N/A ILE 119.A N MET 116.A O no hydrogen 2.859 N/A PHE 120.A N MET 116.A O no hydrogen 2.996 N/A ASP 121.A N VAL 117.A O no hydrogen 2.902 N/A MET 122.A N GLU 118.A O no hydrogen 3.344 N/A LEU 123.A N ILE 119.A O no hydrogen 2.939 N/A LEU 124.A N PHE 120.A O no hydrogen 2.724 N/A ALA 125.A N ASP 121.A O no hydrogen 2.929 N/A THR 126.A N MET 122.A O no hydrogen 2.978 N/A THR 126.A OG1 MET 122.A O no hydrogen 2.716 N/A SER 127.A N.A LEU 123.A O no hydrogen 3.091 N/A SER 127.A N.B LEU 123.A O no hydrogen 3.062 N/A SER 127.A OG.A LEU 124.A O no hydrogen 2.869 N/A SER 127.A OG.B VAL 87.A O no hydrogen 3.187 N/A SER 128.A N LEU 124.A O no hydrogen 3.057 N/A SER 128.A OG LEU 124.A O no hydrogen 3.136 N/A ARG 129.A N ALA 125.A O no hydrogen 3.084 N/A PHE 130.A N THR 126.A O no hydrogen 3.012 N/A ARG 131.A N SER 127.A O.A no hydrogen 2.956 N/A ARG 131.A N SER 127.A O.B no hydrogen 2.988 N/A ARG 131.A NE MET 91.A O no hydrogen 2.460 N/A ARG 131.A NH2 MET 91.A O no hydrogen 3.262 N/A MET 132.A N SER 128.A O no hydrogen 3.013 N/A MET 133.A N ARG 129.A O no hydrogen 2.972 N/A ASN 134.A N ARG 131.A O no hydrogen 3.227 N/A LEU 135.A N PHE 130.A O no hydrogen 3.034 N/A GLN 136.A N GLU 139.A OE1 no hydrogen 3.154 N/A GLN 136.A NE2 ASN 134.A O no hydrogen 2.961 N/A GLU 138.A N GLU 138.A OE1 no hydrogen 2.660 N/A PHE 140.A N GLN 136.A O no hydrogen 2.926 N/A VAL 141.A N GLY 137.A O no hydrogen 3.148 N/A CYS 142.A SG GLU 138.A O no hydrogen 3.364 N/A LEU 143.A N GLU 139.A O no hydrogen 2.947 N/A LYS 144.A N PHE 140.A O no hydrogen 2.947 N/A LYS 144.A NZ GLU 19.A OE1 no hydrogen 2.518 N/A SER 145.A N VAL 141.A O no hydrogen 3.373 N/A SER 145.A OG.A VAL 141.A O no hydrogen 3.416 N/A ILE 146.A N CYS 142.A O no hydrogen 2.941 N/A ILE 147.A N LEU 143.A O no hydrogen 2.934 N/A LEU 148.A N LYS 144.A O no hydrogen 3.145 N/A LEU 149.A N SER 145.A O no hydrogen 3.028 N/A ASN 150.A N ILE 146.A O no hydrogen 2.745 N/A SER 151.A N.A ILE 147.A O no hydrogen 3.041 N/A SER 151.A N.B ILE 147.A O no hydrogen 3.034 N/A SER 151.A OG.A GLU 80.A OE1 no hydrogen 2.791 N/A SER 151.A OG.A GLU 80.A OE2 no hydrogen 3.264 N/A SER 151.A OG.A ILE 147.A O no hydrogen 3.005 N/A SER 151.A OG.B LEU 74.A O no hydrogen 3.277 N/A SER 151.A OG.B ILE 147.A O no hydrogen 3.344 N/A SER 151.A OG.B LEU 148.A O no hydrogen 3.191 N/A VAL 153.A N ASN 150.A O no hydrogen 3.142 N/A THR 155.A N GLY 152.A O.A no hydrogen 3.366 N/A THR 155.A N GLY 152.A O.B no hydrogen 3.324 N/A THR 155.A OG1 HIS 73.A NE2 no hydrogen 2.897 N/A THR 155.A OG1 GLY 152.A O.A no hydrogen 3.431 N/A THR 155.A OG1 GLY 152.A O.B no hydrogen 3.403 N/A SER 158.A OG SER 161.A OG no hydrogen 3.157 N/A GLU 164.A N LYS 160.A O no hydrogen 2.890 N/A LYS 165.A N SER 161.A O no hydrogen 2.961 N/A ASP 166.A N LEU 162.A O no hydrogen 3.013 N/A HIS 167.A N GLU 164.A O no hydrogen 3.285 N/A HIS 169.A N LYS 165.A O no hydrogen 3.137 N/A ARG 170.A N ASP 166.A O no hydrogen 3.142 N/A ARG 170.A NE ASP 166.A OD2 no hydrogen 3.493 N/A ARG 170.A NH2 ASP 166.A OD2 no hydrogen 3.486 N/A VAL 171.A N HIS 167.A O no hydrogen 3.145 N/A LEU 172.A N ILE 168.A O no hydrogen 3.010 N/A ASP 173.A N HIS 169.A O no hydrogen 3.057 N/A LYS 174.A N ARG 170.A O no hydrogen 3.097 N/A LYS 174.A NZ LEU 6.A O no hydrogen 2.953 N/A ILE 175.A N VAL 171.A O no hydrogen 2.917 N/A THR 176.A N LEU 172.A O no hydrogen 2.935 N/A THR 176.A OG1 LEU 172.A O no hydrogen 3.072 N/A ASP 177.A N ASP 173.A O no hydrogen 2.972 N/A THR 178.A N LYS 174.A O no hydrogen 2.942 N/A THR 178.A OG1 LYS 174.A O no hydrogen 2.869 N/A LEU 179.A N ILE 175.A O no hydrogen 3.003 N/A ILE 180.A N THR 176.A O no hydrogen 3.122 N/A HIS 181.A N ASP 177.A O no hydrogen 2.920 N/A HIS 181.A NE2 ASP 9.A OD1 no hydrogen 3.136 N/A LEU 182.A N THR 178.A O no hydrogen 2.924 N/A MET 183.A N LEU 179.A O no hydrogen 2.977 N/A ALA 184.A N ILE 180.A O no hydrogen 2.789 N/A LYS 185.A N HIS 181.A O no hydrogen 2.898 N/A ALA 186.A N LEU 182.A O no hydrogen 3.046 N/A GLY 187.A N ALA 184.A O no hydrogen 3.133 N/A LEU 188.A N MET 183.A O no hydrogen 3.155 N/A THR 189.A N GLN 192.A OE1 no hydrogen 2.934 N/A THR 189.A OG1 GLN 192.A OE1 no hydrogen 3.222 N/A GLN 192.A N THR 189.A OG1 no hydrogen 3.262 N/A GLN 193.A N THR 189.A O no hydrogen 2.839 N/A GLN 193.A NE2 LEU 188.A O no hydrogen 2.739 N/A HIS 194.A N LEU 190.A O no hydrogen 3.092 N/A GLN 195.A N GLN 191.A O no hydrogen 3.106 N/A ARG 196.A N GLN 192.A O no hydrogen 3.002 N/A ARG 196.A NE GLU 139.A OE1 no hydrogen 3.412 N/A ARG 196.A NE GLU 139.A OE2 no hydrogen 2.661 N/A ARG 196.A NH1 MET 133.A O no hydrogen 2.903 N/A ARG 196.A NH2 MET 133.A O no hydrogen 2.905 N/A ARG 196.A NH2 GLU 139.A OE1 no hydrogen 2.795 N/A LEU 197.A N GLN 193.A O no hydrogen 2.968 N/A ALA 198.A N HIS 194.A O no hydrogen 3.054 N/A GLN 199.A N GLN 195.A O no hydrogen 3.021 N/A LEU 200.A N ARG 196.A O no hydrogen 2.943 N/A LEU 201.A N LEU 197.A O no hydrogen 3.073 N/A LEU 202.A N ALA 198.A O no hydrogen 2.777 N/A ILE 203.A N LEU 200.A O no hydrogen 3.318 N/A LEU 204.A N LEU 201.A O no hydrogen 3.150 N/A ILE 207.A N ILE 203.A O no hydrogen 3.008 N/A ARG 208.A N LEU 204.A O no hydrogen 2.803 N/A ARG 208.A NH1 SER 151.A O.B no hydrogen 3.345 N/A ARG 208.A NH2 SER 151.A O.B no hydrogen 2.943 N/A HIS 209.A N SER 205.A O no hydrogen 3.075 N/A MET 210.A N HIS 206.A O no hydrogen 2.831 N/A SER 211.A N ILE 207.A O no hydrogen 3.002 N/A ASN 212.A N ARG 208.A O no hydrogen 2.946 N/A LYS 213.A N HIS 209.A O no hydrogen 2.955 N/A GLY 214.A N MET 210.A O no hydrogen 2.750 N/A MET 215.A N SER 211.A O no hydrogen 2.862 N/A GLU 216.A N ASN 212.A O no hydrogen 3.301 N/A HIS 217.A N LYS 213.A O no hydrogen 3.056 N/A HIS 217.A NE2 GLU 114.A O no hydrogen 2.878 N/A LEU 218.A N GLY 214.A O no hydrogen 2.872 N/A TYR 219.A N MET 215.A O no hydrogen 3.018 N/A SER 220.A N GLU 216.A O no hydrogen 2.995 N/A SER 220.A OG.A HIS 217.A O no hydrogen 2.520 N/A MET 221.A N HIS 217.A O no hydrogen 2.943 N/A LYS 222.A N LEU 218.A O no hydrogen 2.992 N/A CYS 223.A N TYR 219.A O no hydrogen 2.991 N/A CYS 223.A SG TYR 219.A O no hydrogen 3.211 N/A LYS 224.A N SER 220.A O no hydrogen 3.012 N/A LYS 224.A NZ GLU 114.A OE1 no hydrogen 3.378 N/A ASN 225.A N LYS 222.A O no hydrogen 2.963 N/A VAL 226.A N MET 221.A O no hydrogen 3.206 N/A SER 230.A OG ASP 47.A OD2 no hydrogen 2.297 N/A LEU 233.A N SER 230.A OG no hydrogen 3.250 N/A LEU 234.A N SER 230.A O no hydrogen 2.934 N/A GLU 235.A N ASP 231.A O no hydrogen 3.084 N/A MET 236.A N LEU 232.A O no hydrogen 2.817 N/A LEU 237.A N LEU 233.A O no hydrogen 2.798 N/A ASP 238.A N LEU 234.A O no hydrogen 2.740 N/A ALA 239.A N GLU 235.A O no hydrogen 2.998 N/A HIS 240.A N LEU 237.A O no hydrogen 3.102 N/A ARG 241.A N ASP 238.A O no hydrogen 2.817 N/A