Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q96_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N TYR 71.A O no hydrogen 2.995 N/A THR 10.A N LYS 27.A O no hydrogen 3.214 N/A GLY 12.A N LYS 25.A O no hydrogen 2.731 N/A ILE 15.A N VAL 23.A O no hydrogen 2.849 N/A GLY 16.A N VAL 23.A O no hydrogen 3.360 N/A GLY 18.A N GLY 21.A O no hydrogen 2.835 N/A PHE 20.A N LEU 149.A O no hydrogen 3.158 N/A THR 22.A N MET 36.A O no hydrogen 2.862 N/A THR 22.A OG1 GLY 21.A O no hydrogen 2.947 N/A THR 22.A OG1 ASN 38.A OD1 no hydrogen 2.617 N/A VAL 23.A N GLY 16.A O no hydrogen 2.740 N/A TYR 24.A N VAL 34.A O no hydrogen 2.860 N/A LYS 25.A N GLN 13.A O no hydrogen 3.105 N/A GLY 26.A N VAL 32.A O no hydrogen 2.883 N/A LYS 27.A N THR 10.A O no hydrogen 2.850 N/A LYS 27.A NZ ASP 31.A OD1 no hydrogen 3.229 N/A TRP 28.A N GLY 30.A O no hydrogen 2.996 N/A VAL 32.A N GLY 26.A O no hydrogen 2.912 N/A ALA 33.A N THR 81.A O no hydrogen 2.765 N/A VAL 34.A N TYR 24.A O no hydrogen 2.856 N/A LYS 35.A N ILE 79.A O no hydrogen 2.750 N/A LYS 35.A NZ GLU 53.A OE1 no hydrogen 2.930 N/A LYS 35.A NZ GLU 53.A OE2 no hydrogen 2.855 N/A MET 36.A N THR 22.A O no hydrogen 2.811 N/A LEU 37.A N LEU 77.A O no hydrogen 2.892 N/A ASN 38.A ND2 PHE 20.A O no hydrogen 3.684 N/A ASN 38.A ND2 ASN 38.A O no hydrogen 3.275 N/A THR 43.A N GLN 46.A OE1 no hydrogen 2.852 N/A THR 43.A OG1 GLN 45.A OE1 no hydrogen 3.327 N/A THR 43.A OG1 GLN 46.A OE1 no hydrogen 3.263 N/A GLN 46.A N THR 43.A OG1 no hydrogen 3.162 N/A LEU 47.A N THR 43.A O no hydrogen 2.878 N/A GLN 48.A N PRO 44.A O no hydrogen 2.938 N/A ALA 49.A N GLN 45.A O no hydrogen 3.156 N/A PHE 50.A N GLN 46.A O no hydrogen 3.067 N/A LYS 51.A N LEU 47.A O no hydrogen 3.084 N/A ASN 52.A N GLN 48.A O no hydrogen 3.057 N/A GLU 53.A N ALA 49.A O no hydrogen 3.247 N/A VAL 54.A N PHE 50.A O no hydrogen 3.120 N/A GLY 55.A N LYS 51.A O no hydrogen 2.986 N/A VAL 56.A N ASN 52.A O no hydrogen 2.831 N/A LEU 57.A N GLU 53.A O no hydrogen 2.919 N/A ARG 58.A N VAL 54.A O no hydrogen 3.023 N/A LYS 59.A N VAL 56.A O no hydrogen 2.824 N/A THR 60.A N LEU 57.A O no hydrogen 3.189 N/A THR 60.A OG1 LEU 57.A O no hydrogen 2.669 N/A ASN 64.A N HIS 62.A ND1 no hydrogen 3.000 N/A ASN 64.A ND2 GLN 111.A OE1 no hydrogen 3.176 N/A ASN 64.A ND2 VAL 142.A O no hydrogen 2.866 N/A ILE 65.A N HIS 62.A O no hydrogen 2.704 N/A LEU 66.A N ILE 144.A O no hydrogen 3.059 N/A LEU 67.A N GLN 82.A OE1 no hydrogen 3.210 N/A MET 69.A N VAL 80.A O no hydrogen 2.941 N/A GLY 70.A N VAL 80.A O no hydrogen 3.210 N/A SER 72.A N ALA 78.A O no hydrogen 3.105 N/A THR 73.A OG1 GLU 3.A OE1 no hydrogen 3.242 N/A ALA 78.A N SER 72.A O no hydrogen 2.959 N/A ILE 79.A N LYS 35.A O no hydrogen 2.804 N/A VAL 80.A N GLY 70.A O no hydrogen 2.819 N/A THR 81.A N ALA 33.A O no hydrogen 2.999 N/A THR 81.A OG1 GLN 82.A O no hydrogen 2.969 N/A GLN 82.A N LEU 67.A O no hydrogen 3.074 N/A LEU 89.A N ILE 134.A O no hydrogen 2.760 N/A TYR 90.A N SER 131.A O no hydrogen 3.261 N/A HIS 91.A N SER 88.A OG no hydrogen 3.161 N/A HIS 92.A N SER 88.A O no hydrogen 3.158 N/A HIS 92.A ND1 THR 98.A OG1 no hydrogen 3.030 N/A LEU 93.A N LEU 89.A O no hydrogen 3.009 N/A HIS 94.A N TYR 90.A O no hydrogen 2.946 N/A HIS 94.A NE2 GLU 179.A OE1 no hydrogen 2.610 N/A ILE 95.A N HIS 91.A O no hydrogen 3.150 N/A ILE 96.A N HIS 91.A O no hydrogen 2.939 N/A THR 98.A N HIS 92.A O no hydrogen 2.547 N/A THR 98.A OG1 HIS 92.A ND1 no hydrogen 3.030 N/A LYS 104.A NZ ASP 139.A O no hydrogen 3.354 N/A LEU 105.A N GLU 101.A O no hydrogen 3.148 N/A ILE 106.A N MET 102.A O no hydrogen 3.050 N/A ASP 107.A N ILE 103.A O no hydrogen 3.027 N/A ILE 108.A N LYS 104.A O no hydrogen 2.980 N/A ALA 109.A N LEU 105.A O no hydrogen 2.964 N/A ARG 110.A N ILE 106.A O no hydrogen 2.780 N/A GLN 111.A N ASP 107.A O no hydrogen 2.930 N/A GLN 111.A NE2 ASP 107.A O no hydrogen 3.655 N/A GLN 111.A NE2 ASP 107.A OD1 no hydrogen 3.321 N/A GLN 111.A NE2 LEU 140.A O no hydrogen 3.199 N/A THR 112.A N ILE 108.A O no hydrogen 2.863 N/A THR 112.A OG1 ILE 108.A O no hydrogen 2.573 N/A ALA 113.A N ALA 109.A O no hydrogen 2.973 N/A GLN 114.A N ARG 110.A O no hydrogen 2.601 N/A GLY 115.A N GLN 111.A O no hydrogen 3.082 N/A MET 116.A N THR 112.A O no hydrogen 2.928 N/A ASP 117.A N ALA 113.A O no hydrogen 2.941 N/A TYR 118.A N GLN 114.A O no hydrogen 3.405 N/A LEU 119.A N GLY 115.A O no hydrogen 3.032 N/A HIS 120.A N MET 116.A O no hydrogen 3.061 N/A HIS 120.A NE2 ASP 169.A OD2 no hydrogen 3.046 N/A ALA 121.A N ASP 117.A O no hydrogen 3.028 N/A LYS 122.A N LEU 119.A O no hydrogen 3.163 N/A LYS 122.A NZ LYS 59.A O no hydrogen 2.948 N/A SER 123.A N HIS 120.A O no hydrogen 3.116 N/A ILE 124.A N LEU 119.A O no hydrogen 2.938 N/A HIS 126.A N ASP 169.A OD2 no hydrogen 2.839 N/A HIS 126.A NE2 GLY 145.A O no hydrogen 2.976 N/A ARG 127.A N ASP 169.A OD1 no hydrogen 3.121 N/A ASP 128.A N HIS 126.A ND1 no hydrogen 3.120 N/A SER 131.A OG GLU 179.A OE1 no hydrogen 2.762 N/A SER 131.A OG GLU 179.A OE2 no hydrogen 3.284 N/A ASN 132.A ND2 SER 88.A OG no hydrogen 3.132 N/A ASN 133.A N LYS 130.A O no hydrogen 2.795 N/A ASN 133.A ND2 ASP 128.A O no hydrogen 2.812 N/A ILE 134.A N SER 131.A O no hydrogen 3.129 N/A PHE 135.A N LYS 143.A O no hydrogen 3.269 N/A LEU 136.A N SER 87.A O no hydrogen 2.799 N/A HIS 137.A N THR 141.A O no hydrogen 2.704 N/A GLU 138.A N GLU 85.A O no hydrogen 2.569 N/A ASP 139.A N LEU 136.A O no hydrogen 3.456 N/A LEU 140.A N HIS 137.A O no hydrogen 3.004 N/A THR 141.A N HIS 137.A O no hydrogen 2.928 N/A VAL 142.A N GLN 111.A OE1 no hydrogen 2.791 N/A LYS 143.A N PHE 135.A O no hydrogen 2.928 N/A LYS 143.A NZ VAL 63.A O no hydrogen 3.065 N/A ILE 144.A N ASN 64.A O no hydrogen 2.782 N/A GLY 145.A N ASN 133.A O no hydrogen 3.033 N/A PHE 147.A N ASN 133.A OD1 no hydrogen 2.644 N/A GLY 148.A N ASP 146.A OD2 no hydrogen 2.991 N/A TRP 153.A NE1 GLU 179.A OE2 no hydrogen 2.831 N/A MET 154.A N ILE 151.A O no hydrogen 3.068 N/A GLU 157.A N GLU 157.A OE1 no hydrogen 2.802 N/A VAL 158.A N ALA 155.A O no hydrogen 2.873 N/A ILE 159.A N ALA 155.A O no hydrogen 3.197 N/A ILE 159.A N PRO 156.A O no hydrogen 2.939 N/A ARG 160.A N PRO 156.A O no hydrogen 2.933 N/A ARG 160.A NE GLY 201.A O no hydrogen 2.868 N/A SER 165.A N SER 168.A OG no hydrogen 3.331 N/A SER 165.A OG GLN 167.A OE1 no hydrogen 3.095 N/A GLN 167.A N SER 165.A OG no hydrogen 3.151 N/A GLN 167.A N GLN 167.A OE1 no hydrogen 2.839 N/A SER 168.A N SER 165.A O no hydrogen 2.953 N/A SER 168.A OG SER 165.A O no hydrogen 2.961 N/A VAL 170.A N PHE 166.A O no hydrogen 3.368 N/A TYR 171.A N GLN 167.A O no hydrogen 3.197 N/A ALA 172.A N SER 168.A O no hydrogen 3.372 N/A PHE 173.A N ASP 169.A O no hydrogen 2.860 N/A GLY 174.A N VAL 170.A O no hydrogen 2.706 N/A ILE 175.A N TYR 171.A O no hydrogen 2.931 N/A VAL 176.A N ALA 172.A O no hydrogen 2.958 N/A LEU 177.A N PHE 173.A O no hydrogen 2.799 N/A TYR 178.A N GLY 174.A O no hydrogen 2.972 N/A TYR 178.A OH ASP 208.A O no hydrogen 3.325 N/A GLU 179.A N ILE 175.A O no hydrogen 2.947 N/A LEU 180.A N VAL 176.A O no hydrogen 3.027 N/A MET 181.A N LEU 177.A O no hydrogen 3.035 N/A THR 182.A N TYR 178.A O no hydrogen 2.857 N/A THR 182.A OG1 TYR 178.A O no hydrogen 2.691 N/A THR 182.A OG1 GLN 184.A O no hydrogen 3.023 N/A GLY 183.A N GLU 179.A O no hydrogen 2.545 N/A GLN 184.A N THR 182.A OG1 no hydrogen 3.105 N/A ILE 190.A N TYR 187.A O no hydrogen 3.192 N/A GLN 195.A N ASN 192.A O no hydrogen 2.938 N/A GLN 195.A N ASN 192.A OD1 no hydrogen 3.208 N/A ILE 196.A N ASN 192.A O no hydrogen 3.328 N/A ILE 197.A N ARG 193.A O no hydrogen 3.205 N/A PHE 198.A N ASP 194.A O no hydrogen 3.219 N/A MET 199.A N GLN 195.A O no hydrogen 2.767 N/A VAL 200.A N ILE 196.A O no hydrogen 2.905 N/A ARG 202.A N PHE 198.A O no hydrogen 3.158 N/A ARG 202.A N MET 199.A O no hydrogen 3.093 N/A GLY 203.A N VAL 200.A O no hydrogen 3.327 N/A TYR 204.A N MET 199.A O no hydrogen 2.925 N/A LEU 205.A N MET 199.A O no hydrogen 3.467 N/A SER 210.A N ASP 208.A OD1 no hydrogen 3.319 N/A SER 210.A OG ASP 208.A OD1 no hydrogen 2.852 N/A SER 210.A OG ASP 208.A OD2 no hydrogen 2.927 N/A LYS 211.A N ASP 208.A O no hydrogen 3.386 N/A LYS 211.A NZ GLN 184.A OE1 no hydrogen 3.180 N/A ARG 213.A N MET 181.A O no hydrogen 2.976 N/A ARG 213.A NH1 PHE 100.A O no hydrogen 3.000 N/A ARG 213.A NH2 PHE 100.A O no hydrogen 3.358 N/A CYS 216.A N ARG 213.A O no hydrogen 3.127 N/A CYS 216.A SG PRO 217.A O no hydrogen 3.806 N/A MET 220.A N PRO 217.A O no hydrogen 2.882 N/A LYS 221.A N PRO 217.A O no hydrogen 3.239 N/A ARG 222.A N LYS 218.A O no hydrogen 2.884 N/A LEU 223.A N ALA 219.A O no hydrogen 3.204 N/A MET 224.A N MET 220.A O no hydrogen 2.964 N/A ALA 225.A N LYS 221.A O no hydrogen 3.347 N/A GLU 226.A N ARG 222.A O no hydrogen 3.331 N/A CYS 227.A N LEU 223.A O no hydrogen 3.113 N/A CYS 227.A SG LEU 223.A O no hydrogen 3.574 N/A LEU 228.A N MET 224.A O no hydrogen 3.161 N/A LEU 228.A N ALA 225.A O no hydrogen 3.094 N/A LYS 229.A N GLU 226.A O no hydrogen 3.456 N/A LYS 230.A NZ GLY 203.A O no hydrogen 2.782 N/A LYS 230.A NZ SER 206.A OG no hydrogen 2.919 N/A GLU 234.A N LYS 231.A O no hydrogen 3.265 N/A ARG 235.A N ARG 232.A O no hydrogen 3.056 N/A ARG 235.A NE GLN 167.A O no hydrogen 3.222 N/A ARG 235.A NH1 LYS 229.A O no hydrogen 2.271 N/A ARG 235.A NH2 GLU 157.A OE1 no hydrogen 3.081 N/A ILE 241.A N LEU 237.A O no hydrogen 3.031 N/A LEU 242.A N PHE 238.A O no hydrogen 2.777 N/A ALA 243.A N PRO 239.A O no hydrogen 3.133 N/A SER 244.A N GLN 240.A O no hydrogen 3.043 N/A SER 244.A OG GLN 240.A O no hydrogen 2.647 N/A ILE 245.A N ILE 241.A O no hydrogen 3.169 N/A GLU 246.A N LEU 242.A O no hydrogen 2.787 N/A LEU 247.A N ALA 243.A O no hydrogen 2.915 N/A LEU 248.A N SER 244.A O no hydrogen 3.223 N/A ALA 249.A N ILE 245.A O no hydrogen 2.733 N/A LEU 252.A N ARG 250.A O no hydrogen 3.223 N/A