Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qq3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N GLU 33.A OE2 no hydrogen 3.038 N/A SER 3.A N GLU 33.A OE1 no hydrogen 2.792 N/A ALA 5.A N GLU 16.A O no hydrogen 2.841 N/A ARG 7.A N ILE 14.A O no hydrogen 2.923 N/A ARG 7.A NE GLU 9.A OE2 no hydrogen 3.201 N/A ARG 7.A NH2 GLU 9.A OE2 no hydrogen 3.403 N/A GLU 9.A N VAL 12.A O no hydrogen 3.062 N/A VAL 12.A N GLU 9.A O no hydrogen 3.165 N/A GLY 13.A N VAL 49.A O no hydrogen 2.735 N/A ILE 14.A N ARG 7.A O no hydrogen 2.854 N/A ILE 15.A N VAL 51.A O no hydrogen 2.810 N/A GLU 16.A N ALA 5.A O no hydrogen 2.837 N/A LEU 17.A N THR 53.A O no hydrogen 2.948 N/A ALA 18.A N SER 3.A O no hydrogen 2.691 N/A ARG 19.A N ASN 24.A OD1 no hydrogen 2.785 N/A ARG 19.A NE ASP 21.A OD1 no hydrogen 3.223 N/A ARG 19.A NH2 ASP 21.A OD2 no hydrogen 3.374 N/A VAL 22.A N ARG 19.A O no hydrogen 2.862 N/A LEU 23.A N PRO 20.A O no hydrogen 3.166 N/A ASN 24.A N ARG 19.A O no hydrogen 2.847 N/A ASN 24.A ND2 ARG 55.A O no hydrogen 3.054 N/A ASN 24.A ND2 ALA 58.A O no hydrogen 2.922 N/A ASN 24.A ND2 PHE 59.A O no hydrogen 3.132 N/A ALA 25.A N VAL 22.A O no hydrogen 3.099 N/A LEU 26.A N GLY 62.A O no hydrogen 2.893 N/A ARG 28.A N GLU 67.A OE2 no hydrogen 3.005 N/A ARG 28.A NE GLN 81.A OE1 no hydrogen 3.173 N/A ARG 28.A NH1 ASP 71.A OD2 no hydrogen 2.735 N/A ARG 28.A NH1 GLN 81.A OE1 no hydrogen 2.885 N/A ARG 28.A NH2 ASP 71.A OD2 no hydrogen 3.237 N/A MET 30.A N SER 27.A OG no hydrogen 3.108 N/A VAL 31.A N SER 27.A O no hydrogen 2.981 N/A ALA 32.A N ARG 28.A O no hydrogen 3.096 N/A GLU 33.A N GLN 29.A O no hydrogen 3.101 N/A ILE 34.A N MET 30.A O no hydrogen 2.974 N/A VAL 35.A N VAL 31.A O no hydrogen 2.907 N/A ALA 36.A N ALA 32.A O no hydrogen 3.005 N/A ALA 37.A N GLU 33.A O no hydrogen 2.954 N/A VAL 38.A N ILE 34.A O no hydrogen 2.830 N/A GLU 39.A N VAL 35.A O no hydrogen 2.879 N/A ALA 40.A N ALA 36.A O no hydrogen 3.131 N/A PHE 41.A N ALA 37.A O no hydrogen 3.057 N/A ASP 42.A N VAL 38.A O no hydrogen 2.851 N/A ARG 43.A N GLU 39.A O no hydrogen 2.995 N/A ASN 44.A N ALA 40.A O no hydrogen 3.068 N/A LYS 46.A N ASN 44.A OD1 no hydrogen 2.717 N/A VAL 47.A N ASN 44.A O no hydrogen 3.076 N/A ARG 48.A N ALA 11.A O no hydrogen 2.762 N/A ARG 48.A NH1 ALA 195.A O no hydrogen 2.944 N/A VAL 49.A N ALA 11.A O no hydrogen 3.414 N/A ILE 50.A N PRO 94.A O no hydrogen 2.999 N/A VAL 51.A N GLY 13.A O no hydrogen 2.749 N/A LEU 52.A N ILE 96.A O no hydrogen 2.915 N/A THR 53.A N ILE 15.A O no hydrogen 3.053 N/A THR 53.A OG1 ALA 98.A O no hydrogen 2.767 N/A THR 53.A OG1 ASN 100.A OD1 no hydrogen 3.528 N/A GLY 54.A N ASN 100.A OD1 no hydrogen 3.141 N/A ARG 55.A N LEU 17.A O no hydrogen 3.016 N/A ARG 55.A NE GLU 16.A OE1 no hydrogen 2.814 N/A ARG 55.A NH2 GLU 16.A OE1 no hydrogen 2.908 N/A PHE 59.A N LEU 102.A O no hydrogen 2.949 N/A ALA 60.A N LEU 102.A O no hydrogen 2.812 N/A ALA 61.A N LEU 23.A O no hydrogen 3.058 N/A GLY 62.A N ALA 60.A O no hydrogen 3.164 N/A GLY 62.A N LEU 104.A O no hydrogen 2.711 N/A GLU 67.A N ASP 64.A OD2 no hydrogen 3.144 N/A MET 68.A N ILE 65.A O no hydrogen 2.877 N/A ALA 69.A N ILE 65.A O no hydrogen 2.768 N/A ASP 71.A N MET 68.A O no hydrogen 2.843 N/A ARG 75.A N ASP 72.A OD1 no hydrogen 2.862 N/A LEU 76.A N ASP 72.A O no hydrogen 3.219 N/A GLU 77.A N PRO 73.A O no hydrogen 2.870 N/A TRP 78.A N ILE 74.A O no hydrogen 3.061 N/A LEU 79.A N ARG 75.A O no hydrogen 2.996 N/A ASN 80.A N LEU 76.A O no hydrogen 2.926 N/A ALA 83.A N ASN 80.A O no hydrogen 3.178 N/A ASP 84.A N GLN 81.A O no hydrogen 3.271 N/A ASP 86.A N PHE 82.A O no hydrogen 3.083 N/A ARG 87.A N ALA 83.A O no hydrogen 3.230 N/A ARG 87.A NE GLU 39.A OE2 no hydrogen 3.092 N/A ARG 87.A NH2 GLU 39.A OE1 no hydrogen 2.713 N/A ARG 87.A NH2 GLU 39.A OE2 no hydrogen 3.484 N/A LEU 88.A N ASP 84.A O no hydrogen 3.338 N/A SER 89.A N TRP 85.A O no hydrogen 2.999 N/A SER 89.A OG TRP 85.A O no hydrogen 3.149 N/A ILE 90.A N ASP 86.A O no hydrogen 3.265 N/A VAL 91.A N LEU 88.A O no hydrogen 3.284 N/A LYS 92.A NZ GLU 207.A OE2 no hydrogen 2.596 N/A THR 93.A N ASP 42.A OD1 no hydrogen 3.111 N/A THR 93.A OG1 ASP 42.A OD1 no hydrogen 2.543 N/A MET 95.A N ASP 115.A OD2 no hydrogen 2.767 N/A ILE 96.A N ILE 50.A O no hydrogen 2.818 N/A ALA 97.A N LEU 116.A O no hydrogen 2.957 N/A ALA 98.A N LEU 52.A O no hydrogen 2.721 N/A VAL 99.A N VAL 118.A O no hydrogen 2.909 N/A ASN 100.A ND2 GLY 56.A O no hydrogen 3.133 N/A ASN 100.A ND2 ALA 58.A O no hydrogen 3.265 N/A ALA 103.A N GLU 124.A O no hydrogen 2.939 N/A LEU 104.A N ALA 60.A O no hydrogen 3.010 N/A GLY 105.A N GLY 126.A O no hydrogen 2.818 N/A GLY 107.A N LEU 104.A O no hydrogen 2.791 N/A PHE 108.A N GLY 105.A O no hydrogen 2.736 N/A GLU 109.A N GLY 105.A O no hydrogen 2.942 N/A LEU 110.A N GLY 106.A O no hydrogen 2.830 N/A ALA 111.A N GLY 107.A O no hydrogen 3.172 N/A LEU 112.A N PHE 108.A O no hydrogen 2.834 N/A SER 113.A N GLU 109.A O no hydrogen 3.021 N/A SER 113.A N LEU 110.A O no hydrogen 3.246 N/A SER 113.A OG GLU 109.A O no hydrogen 2.742 N/A CYS 114.A N ALA 111.A O no hydrogen 3.179 N/A CYS 114.A SG LEU 110.A O no hydrogen 3.606 N/A ASP 115.A N MET 95.A O no hydrogen 2.765 N/A LEU 116.A N MET 95.A O no hydrogen 3.265 N/A VAL 118.A N ALA 97.A O no hydrogen 2.836 N/A ALA 119.A N ARG 176.A O no hydrogen 2.769 N/A SER 120.A N VAL 99.A O no hydrogen 2.872 N/A SER 121.A N VAL 178.A O no hydrogen 2.859 N/A SER 121.A OG VAL 178.A O no hydrogen 3.101 N/A ALA 122.A N SER 120.A OG no hydrogen 3.005 N/A ALA 123.A N SER 120.A O no hydrogen 2.792 N/A PHE 125.A N MET 163.A O no hydrogen 2.790 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.638 N/A ASN 131.A N PRO 128.A O no hydrogen 2.876 N/A ASN 131.A ND2 THR 159.A O no hydrogen 3.297 N/A LEU 132.A N GLU 129.A O no hydrogen 2.734 N/A GLY 133.A N VAL 130.A O no hydrogen 3.108 N/A VAL 134.A N GLU 129.A O no hydrogen 3.206 N/A ALA 138.A N GLU 109.A OE2 no hydrogen 2.660 N/A GLY 140.A N GLU 109.A OE2 no hydrogen 2.893 N/A THR 141.A OG1 GLN 142.A OE1 no hydrogen 2.899 N/A ARG 143.A N GLY 139.A O no hydrogen 2.832 N/A ARG 143.A NH2 SER 89.A OG no hydrogen 2.856 N/A LEU 144.A N GLY 140.A O no hydrogen 3.086 N/A THR 145.A N THR 141.A O no hydrogen 3.467 N/A THR 145.A OG1 THR 141.A O no hydrogen 2.795 N/A LYS 146.A N GLN 142.A O no hydrogen 3.117 N/A LEU 147.A N ARG 143.A O no hydrogen 3.201 N/A LEU 147.A N LEU 144.A O no hydrogen 3.023 N/A ILE 148.A N LEU 144.A O no hydrogen 3.005 N/A GLY 149.A N THR 145.A O no hydrogen 2.831 N/A ARG 152.A NE ILE 148.A O no hydrogen 2.943 N/A ARG 152.A NH2 ILE 148.A O no hydrogen 3.110 N/A ALA 153.A N GLY 149.A O no hydrogen 2.958 N/A LEU 154.A N PRO 150.A O no hydrogen 2.944 N/A GLU 155.A N LYS 151.A O no hydrogen 3.411 N/A TRP 156.A N ARG 152.A O no hydrogen 3.266 N/A LEU 157.A N ALA 153.A O no hydrogen 2.931 N/A TRP 158.A N LEU 154.A O no hydrogen 2.738 N/A THR 159.A N GLU 155.A O no hydrogen 3.229 N/A THR 159.A OG1 GLU 155.A O no hydrogen 2.789 N/A GLY 160.A N TRP 156.A O no hydrogen 2.963 N/A ALA 161.A N THR 159.A OG1 no hydrogen 3.237 N/A ARG 162.A NE GLU 124.A OE2 no hydrogen 2.814 N/A MET 163.A N PHE 125.A O no hydrogen 2.541 N/A GLU 167.A N SER 164.A OG no hydrogen 3.110 N/A ALA 168.A N SER 164.A O no hydrogen 2.927 N/A GLU 169.A N ALA 165.A O no hydrogen 2.877 N/A GLN 170.A N LYS 166.A O no hydrogen 2.991 N/A LEU 171.A N GLU 167.A O no hydrogen 2.905 N/A GLY 172.A N GLU 169.A O no hydrogen 3.117 N/A ILE 173.A N ALA 168.A O no hydrogen 2.874 N/A VAL 174.A N ALA 168.A O no hydrogen 3.207 N/A ASN 175.A N ILE 117.A O no hydrogen 2.875 N/A ARG 176.A N ILE 117.A O no hydrogen 3.362 N/A VAL 178.A N ALA 119.A O no hydrogen 2.938 N/A SER 179.A OG GLU 181.A OE1 no hydrogen 2.648 N/A SER 179.A OG GLU 181.A OE2 no hydrogen 2.431 N/A LEU 182.A N SER 179.A O no hydrogen 3.025 N/A GLU 186.A N LEU 182.A O no hydrogen 2.836 N/A THR 187.A N LEU 183.A O no hydrogen 2.804 N/A THR 187.A OG1 LEU 183.A O no hydrogen 2.789 N/A MET 188.A N MET 184.A O no hydrogen 2.712 N/A ARG 189.A N GLU 185.A O no hydrogen 3.100 N/A LEU 190.A N GLU 186.A O no hydrogen 2.990 N/A ALA 191.A N THR 187.A O no hydrogen 2.789 N/A GLY 192.A N MET 188.A O no hydrogen 2.849 N/A ARG 193.A N ARG 189.A O no hydrogen 2.955 N/A LEU 194.A N LEU 190.A O no hydrogen 2.899 N/A ALA 195.A N ALA 191.A O no hydrogen 2.871 N/A GLU 196.A N ARG 193.A O no hydrogen 3.112 N/A GLN 197.A N LEU 194.A O no hydrogen 2.989 N/A LEU 202.A N PRO 198.A O no hydrogen 3.071 N/A ARG 203.A N PRO 199.A O no hydrogen 3.006 N/A LEU 204.A N LEU 200.A O no hydrogen 2.955 N/A ILE 205.A N ALA 201.A O no hydrogen 2.880 N/A LYS 206.A N LEU 202.A O no hydrogen 2.960 N/A LYS 206.A NZ VAL 91.A O no hydrogen 2.965 N/A LYS 206.A NZ THR 93.A O no hydrogen 3.034 N/A LYS 206.A NZ ASP 115.A OD2 no hydrogen 2.717 N/A GLU 207.A N ARG 203.A O no hydrogen 3.214 N/A ALA 208.A N LEU 204.A O no hydrogen 3.121 N/A VAL 209.A N ILE 205.A O no hydrogen 2.870 N/A GLN 210.A N LYS 206.A O no hydrogen 2.966 N/A LYS 211.A N GLU 207.A O no hydrogen 3.006 N/A ALA 212.A N ALA 208.A O no hydrogen 2.886 N/A VAL 213.A N VAL 209.A O no hydrogen 3.209 N/A VAL 213.A N GLN 210.A O no hydrogen 3.306 N/A ASP 214.A N LYS 211.A O no hydrogen 3.029 N/A TYR 215.A N LYS 211.A O no hydrogen 2.661 N/A GLY 220.A N PRO 216.A O no hydrogen 2.907 N/A MET 221.A N LEU 217.A O no hydrogen 2.896 N/A GLN 222.A N TYR 218.A O no hydrogen 3.081 N/A PHE 223.A N GLU 219.A O no hydrogen 3.037 N/A GLU 224.A N GLY 220.A O no hydrogen 2.857 N/A ARG 225.A N MET 221.A O no hydrogen 3.032 N/A ARG 225.A NE MET 221.A O no hydrogen 3.105 N/A LYS 226.A N PHE 223.A O no hydrogen 3.029 N/A ASN 227.A N PHE 223.A O no hydrogen 3.156 N/A ASN 227.A ND2 LEU 204.A O no hydrogen 3.087 N/A ASN 227.A ND2 GLU 207.A OE1 no hydrogen 3.254 N/A PHE 228.A N GLU 224.A O no hydrogen 2.919 N/A TYR 229.A N ARG 225.A O no hydrogen 2.908 N/A LEU 230.A N LYS 226.A O no hydrogen 3.090 N/A LEU 231.A N ASN 227.A O no hydrogen 3.139 N/A LEU 231.A N PHE 228.A O no hydrogen 3.197 N/A PHE 232.A N TYR 229.A O no hydrogen 2.930 N/A ALA 233.A N LEU 230.A O no hydrogen 2.985 N/A SER 234.A N LEU 231.A O no hydrogen 2.996 N/A SER 234.A OG LEU 231.A O no hydrogen 2.649 N/A ASP 236.A N LYS 255.A O no hydrogen 2.677 N/A GLN 237.A N SER 234.A OG no hydrogen 3.143 N/A LYS 238.A NZ GLN 237.A OE1 no hydrogen 2.699 N/A GLU 239.A N GLU 235.A O no hydrogen 2.799 N/A GLY 240.A N ASP 236.A O no hydrogen 2.724 N/A MET 241.A N GLN 237.A O no hydrogen 3.119 N/A ALA 242.A N LYS 238.A O no hydrogen 2.863 N/A ALA 243.A N GLU 239.A O no hydrogen 2.772 N/A PHE 244.A N GLY 240.A O no hydrogen 3.254 N/A LEU 245.A N MET 241.A O no hydrogen 3.135 N/A GLU 246.A N ALA 242.A O no hydrogen 2.784 N/A LYS 247.A N PHE 244.A O no hydrogen 3.211 N/A ARG 248.A N ALA 243.A O no hydrogen 2.912 N/A ARG 248.A NE GLU 246.A OE1 no hydrogen 2.748 N/A ARG 248.A NH1 GLU 239.A OE2 no hydrogen 2.598 N/A ARG 248.A NH2 GLU 239.A OE1 no hydrogen 2.924 N/A ARG 248.A NH2 GLU 239.A OE2 no hydrogen 3.037 N/A ARG 248.A NH2 GLU 246.A OE1 no hydrogen 3.488 N/A GLN 253.A N ASP 236.A OD1 no hydrogen 2.838 N/A GLY 254.A N ASP 236.A OD2 no hydrogen 3.021 N/A