Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q9l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 114.A O no hydrogen 3.232 N/A ARG 2.A N GLU 114.A O no hydrogen 3.056 N/A ARG 2.A NE GLU 137.A OE2 no hydrogen 2.618 N/A ARG 2.A NH1 LEU 245.A O no hydrogen 2.792 N/A ARG 2.A NH2 GLU 137.A OE1 no hydrogen 2.961 N/A ARG 2.A NH2 GLU 137.A OE2 no hydrogen 3.183 N/A ARG 2.A NH2 LEU 245.A O no hydrogen 2.942 N/A ILE 3.A N ASP 136.A OD2 no hydrogen 3.081 N/A ILE 4.A N ILE 116.A O no hydrogen 2.929 N/A VAL 5.A N GLU 137.A O no hydrogen 3.041 N/A VAL 6.A N CYS 118.A O no hydrogen 2.736 N/A THR 7.A N ILE 139.A O no hydrogen 3.014 N/A SER 8.A OG LYS 10.A O no hydrogen 2.576 N/A LYS 10.A N SER 8.A O no hydrogen 2.762 N/A LYS 15.A NZ SER 8.A OG no hydrogen 3.120 N/A LYS 15.A NZ LYS 10.A O no hydrogen 3.469 N/A THR 16.A OG1 ASP 119.A OD1 no hydrogen 3.327 N/A THR 16.A OG1 ASP 119.A OD2 no hydrogen 2.623 N/A SER 18.A N GLY 14.A O no hydrogen 2.929 N/A SER 18.A OG GLY 14.A O no hydrogen 2.845 N/A SER 18.A OG TYR 238.A OH no hydrogen 2.577 N/A SER 19.A N LYS 15.A O no hydrogen 2.690 N/A SER 19.A OG LYS 15.A O no hydrogen 2.968 N/A SER 19.A OG ASP 119.A OD1 no hydrogen 3.272 N/A ALA 20.A N THR 16.A O no hydrogen 2.936 N/A ALA 21.A N THR 17.A O no hydrogen 3.021 N/A ILE 22.A N SER 18.A O no hydrogen 2.750 N/A ALA 23.A N SER 19.A O no hydrogen 2.914 N/A THR 24.A N ALA 20.A O no hydrogen 3.063 N/A THR 24.A OG1 ALA 20.A O no hydrogen 2.815 N/A GLY 25.A N ALA 21.A O no hydrogen 2.969 N/A LEU 26.A N ILE 22.A O no hydrogen 2.957 N/A ALA 27.A N ALA 23.A O no hydrogen 3.200 N/A GLN 28.A N THR 24.A O no hydrogen 2.858 N/A LYS 29.A N GLY 25.A O no hydrogen 3.112 N/A LYS 29.A N LEU 26.A O no hydrogen 2.924 N/A LYS 29.A NZ GLU 243.A OE2 no hydrogen 2.591 N/A GLY 30.A N ALA 27.A O no hydrogen 2.943 N/A LYS 31.A N LEU 26.A O no hydrogen 3.218 N/A LYS 32.A NZ MET 111.A O no hydrogen 2.900 N/A THR 33.A N ASN 81.A O no hydrogen 2.753 N/A THR 33.A OG1 LYS 31.A O no hydrogen 2.746 N/A VAL 34.A N PHE 115.A O no hydrogen 2.930 N/A VAL 35.A N TYR 83.A O no hydrogen 2.942 N/A ILE 36.A N VAL 117.A O no hydrogen 2.666 N/A ASP 37.A N LEU 85.A O no hydrogen 2.903 N/A PHE 38.A N ASP 119.A O no hydrogen 3.134 N/A ALA 39.A N ASP 37.A OD1 no hydrogen 2.860 N/A ILE 40.A N PHE 38.A O no hydrogen 2.793 N/A ARG 43.A NH1 ALA 87.A O no hydrogen 2.847 N/A ASN 44.A N ASP 37.A OD2 no hydrogen 3.100 N/A LEU 45.A N ASP 37.A OD2 no hydrogen 2.970 N/A ILE 48.A N ASN 44.A O no hydrogen 3.075 N/A MET 49.A N LEU 45.A O no hydrogen 2.869 N/A GLY 50.A N LEU 47.A O no hydrogen 3.094 N/A CYS 51.A N ASP 46.A O no hydrogen 2.972 N/A CYS 51.A SG ASP 46.A O no hydrogen 3.913 N/A ARG 54.A N CYS 51.A O no hydrogen 2.798 N/A ARG 54.A NH1 LYS 75.A O no hydrogen 2.872 N/A ARG 54.A NH2 LYS 75.A O no hydrogen 2.695 N/A VAL 55.A N GLU 52.A O no hydrogen 3.171 N/A ASP 58.A N ASN 61.A OD1 no hydrogen 2.829 N/A PHE 59.A N PRO 86.A O no hydrogen 3.053 N/A ASN 61.A N ASP 58.A OD1 no hydrogen 2.899 N/A VAL 62.A N ASP 58.A O no hydrogen 2.960 N/A ILE 63.A N PHE 59.A O no hydrogen 3.099 N/A GLN 64.A N VAL 60.A O no hydrogen 2.859 N/A GLY 65.A N VAL 62.A O no hydrogen 2.999 N/A ASP 66.A N ASN 61.A O no hydrogen 2.844 N/A THR 68.A N GLN 71.A OE1 no hydrogen 3.120 N/A THR 68.A OG1 GLN 71.A OE1 no hydrogen 3.327 N/A GLN 71.A N THR 68.A OG1 no hydrogen 3.256 N/A ALA 72.A N THR 68.A O no hydrogen 2.953 N/A LEU 73.A N LEU 69.A O no hydrogen 2.620 N/A ILE 74.A N ILE 84.A O no hydrogen 2.777 N/A ASP 76.A N LEU 82.A O no hydrogen 3.018 N/A ARG 78.A N ASP 76.A OD2 no hydrogen 2.984 N/A ARG 78.A NH1 MET 49.A O no hydrogen 2.975 N/A ARG 78.A NH1 GLY 223.A O no hydrogen 2.921 N/A THR 79.A N ASP 76.A OD2 no hydrogen 2.911 N/A TYR 83.A N THR 33.A O no hydrogen 2.775 N/A ILE 84.A N ILE 74.A O no hydrogen 2.802 N/A LEU 85.A N VAL 35.A O no hydrogen 2.994 N/A SER 88.A OG ASP 58.A OD2 no hydrogen 3.527 N/A THR 90.A N SER 88.A OG no hydrogen 2.946 N/A LYS 93.A NZ THR 126.A OG1 no hydrogen 2.964 N/A ALA 95.A N ASP 92.A O no hydrogen 2.943 N/A GLY 100.A N THR 97.A OG1 no hydrogen 2.775 N/A VAL 101.A N THR 97.A O no hydrogen 2.739 N/A ALA 102.A N ARG 98.A O no hydrogen 2.897 N/A LYS 103.A N GLU 99.A O no hydrogen 3.027 N/A LYS 103.A NZ ASP 107.A OD1 no hydrogen 2.967 N/A LYS 103.A NZ ASP 107.A OD2 no hydrogen 3.146 N/A VAL 104.A N GLY 100.A O no hydrogen 2.933 N/A LEU 105.A N VAL 101.A O no hydrogen 2.920 N/A ASP 106.A N ALA 102.A O no hydrogen 3.011 N/A ASP 107.A N LYS 103.A O no hydrogen 2.828 N/A LEU 108.A N VAL 104.A O no hydrogen 2.901 N/A LYS 109.A N LEU 105.A O no hydrogen 3.011 N/A ALA 110.A N ASP 106.A O no hydrogen 2.927 N/A MET 111.A N ASP 107.A O no hydrogen 3.042 N/A MET 111.A N LEU 108.A O no hydrogen 2.880 N/A ASP 112.A N LYS 109.A O no hydrogen 2.811 N/A PHE 113.A N LEU 108.A O no hydrogen 3.291 N/A GLU 114.A N LYS 32.A O no hydrogen 2.827 N/A PHE 115.A N LYS 32.A O no hydrogen 3.140 N/A ILE 116.A N ARG 2.A O no hydrogen 3.154 N/A VAL 117.A N VAL 34.A O no hydrogen 2.785 N/A CYS 118.A N ILE 4.A O no hydrogen 2.823 N/A CYS 118.A SG ILE 116.A O no hydrogen 3.848 N/A ASP 119.A N ILE 36.A O no hydrogen 2.888 N/A SER 120.A N VAL 6.A O no hydrogen 2.990 N/A SER 120.A OG PRO 121.A O no hydrogen 2.762 N/A GLY 123.A N GLY 9.A O no hydrogen 2.652 N/A LEU 129.A N GLU 125.A O no hydrogen 3.037 N/A MET 130.A N THR 126.A O no hydrogen 2.820 N/A ALA 131.A N GLY 127.A O no hydrogen 3.297 N/A LEU 132.A N ALA 128.A O no hydrogen 3.194 N/A LEU 132.A N LEU 129.A O no hydrogen 3.220 N/A TYR 133.A N LEU 129.A O no hydrogen 2.814 N/A TYR 133.A OH GLU 167.A OE1 no hydrogen 3.341 N/A ALA 135.A N LEU 132.A O no hydrogen 2.987 N/A ASP 136.A N ILE 3.A O no hydrogen 2.808 N/A GLU 137.A N ILE 3.A O no hydrogen 3.042 N/A ALA 138.A N LYS 174.A O no hydrogen 2.743 N/A ILE 139.A N VAL 5.A O no hydrogen 2.793 N/A ILE 140.A N HIS 176.A O no hydrogen 2.747 N/A THR 141.A N THR 7.A O no hydrogen 2.839 N/A THR 141.A OG1 THR 7.A O no hydrogen 3.360 N/A THR 141.A OG1 ILE 139.A O no hydrogen 3.566 N/A THR 142.A N LEU 178.A O no hydrogen 2.814 N/A THR 142.A OG1 ILE 140.A O no hydrogen 3.219 N/A THR 142.A OG1 SER 152.A OG no hydrogen 2.831 N/A ASN 143.A N SER 148.A OG no hydrogen 2.787 N/A ASN 143.A ND2 VAL 13.A O no hydrogen 3.170 N/A ASN 143.A ND2 THR 180.A O no hydrogen 3.222 N/A GLU 145.A N ASN 143.A O no hydrogen 2.622 N/A SER 148.A OG ASN 143.A O no hydrogen 3.126 N/A VAL 149.A N GLU 145.A O no hydrogen 2.836 N/A ARG 150.A N VAL 146.A O no hydrogen 2.742 N/A ASP 151.A N SER 147.A O no hydrogen 2.862 N/A SER 152.A N SER 148.A O no hydrogen 2.839 N/A SER 152.A OG THR 142.A OG1 no hydrogen 2.831 N/A SER 152.A OG SER 148.A O no hydrogen 3.109 N/A ASP 153.A N VAL 149.A O no hydrogen 3.130 N/A ARG 154.A N ARG 150.A O no hydrogen 3.017 N/A ILE 155.A N ASP 151.A O no hydrogen 2.881 N/A LEU 156.A N SER 152.A O no hydrogen 3.036 N/A GLY 157.A N ASP 153.A O no hydrogen 3.280 N/A ILE 158.A N ARG 154.A O no hydrogen 3.102 N/A LEU 159.A N ILE 155.A O no hydrogen 2.830 N/A ALA 160.A N LEU 156.A O no hydrogen 3.130 N/A ALA 160.A N GLY 157.A O no hydrogen 3.066 N/A SER 161.A N ILE 158.A O no hydrogen 3.286 N/A SER 161.A OG GLY 157.A O no hydrogen 3.368 N/A LYS 162.A N ILE 158.A O no hydrogen 2.901 N/A SER 163.A OG LEU 159.A O no hydrogen 2.853 N/A ARG 164.A N TYR 133.A O no hydrogen 2.939 N/A ARG 164.A NE GLU 170.A OE2 no hydrogen 3.385 N/A ARG 164.A NH2 GLU 170.A OE2 no hydrogen 3.167 N/A ARG 165.A NE ASP 136.A OD1 no hydrogen 3.230 N/A ARG 165.A NH1 GLU 171.A O no hydrogen 2.969 N/A ARG 165.A NH2 ASP 136.A OD1 no hydrogen 3.012 N/A ALA 166.A N SER 163.A OG no hydrogen 3.242 N/A GLU 167.A N SER 163.A O no hydrogen 3.065 N/A GLU 167.A N ARG 164.A O no hydrogen 2.919 N/A ASN 168.A N ARG 164.A O no hydrogen 2.988 N/A ASN 168.A ND2 GLU 170.A OE2 no hydrogen 3.308 N/A GLU 170.A N ARG 165.A O no hydrogen 2.925 N/A LYS 174.A N ASP 136.A O no hydrogen 3.019 N/A HIS 176.A N ALA 138.A O no hydrogen 2.824 N/A HIS 176.A NE2 GLU 137.A OE1 no hydrogen 2.690 N/A LEU 177.A N LYS 205.A O no hydrogen 2.810 N/A LEU 178.A N ILE 140.A O no hydrogen 2.960 N/A LEU 179.A N GLY 208.A O no hydrogen 3.019 N/A THR 180.A N THR 142.A O no hydrogen 2.845 N/A THR 180.A OG1 VAL 13.A O no hydrogen 2.824 N/A ARG 181.A NE GLU 212.A OE2 no hydrogen 2.597 N/A ARG 181.A NH2 GLU 212.A OE1 no hydrogen 2.846 N/A ARG 181.A NH2 GLU 212.A OE2 no hydrogen 3.288 N/A TYR 182.A N ILE 210.A O no hydrogen 2.999 N/A ARG 186.A N ASN 183.A OD1 no hydrogen 2.926 N/A ARG 186.A NH1 ASP 191.A OD2 no hydrogen 3.241 N/A VAL 187.A N ASN 183.A O no hydrogen 2.864 N/A SER 188.A N PRO 184.A O no hydrogen 2.894 N/A SER 188.A OG GLY 185.A O no hydrogen 3.336 N/A SER 188.A OG GLU 257.A OE1 no hydrogen 2.556 N/A ARG 189.A N GLY 185.A O no hydrogen 3.089 N/A GLY 190.A N VAL 187.A O no hydrogen 3.090 N/A ASP 191.A N ARG 186.A O no hydrogen 3.203 N/A LEU 193.A N PRO 144.A O no hydrogen 2.911 N/A SER 194.A N ASP 197.A OD2 no hydrogen 2.815 N/A MET 195.A N TYR 182.A OH no hydrogen 2.630 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.746 N/A ASP 197.A N SER 194.A OG no hydrogen 2.616 N/A VAL 198.A N SER 194.A O no hydrogen 3.066 N/A LEU 199.A N MET 195.A O no hydrogen 3.053 N/A GLU 200.A N GLU 196.A O no hydrogen 3.033 N/A ILE 201.A N ASP 197.A O no hydrogen 3.316 N/A LEU 202.A N VAL 198.A O no hydrogen 2.770 N/A VAL 207.A N LEU 177.A O no hydrogen 2.750 N/A GLY 208.A N LEU 177.A O no hydrogen 3.426 N/A ILE 210.A N LEU 179.A O no hydrogen 2.562 N/A GLU 212.A N TYR 182.A O no hydrogen 2.932 N/A SER 215.A N ASP 213.A OD1 no hydrogen 2.993 N/A SER 215.A OG ASP 213.A OD1 no hydrogen 2.497 N/A SER 215.A OG ASP 213.A OD2 no hydrogen 2.979 N/A VAL 216.A N ASP 213.A O no hydrogen 3.153 N/A ALA 219.A N SER 215.A O no hydrogen 2.658 N/A SER 220.A N VAL 216.A O no hydrogen 2.870 N/A SER 220.A OG.A VAL 216.A O no hydrogen 3.137 N/A ASN 221.A N LEU 217.A O no hydrogen 2.926 N/A GLN 222.A N ARG 218.A O no hydrogen 3.037 N/A GLY 223.A N SER 220.A O no hydrogen 2.671 N/A GLU 224.A N ALA 219.A O no hydrogen 2.819 N/A LEU 228.A N PRO 225.A O no hydrogen 2.819 N/A ASP 229.A N VAL 226.A O no hydrogen 2.731 N/A ASN 231.A N ASP 229.A OD1 no hydrogen 2.965 N/A ALA 232.A N ASP 229.A O no hydrogen 3.266 N/A ALA 234.A N ASP 213.A OD2 no hydrogen 2.843 N/A LYS 236.A N ALA 232.A O no hydrogen 2.819 N/A ALA 237.A N ASP 233.A O no hydrogen 2.746 N/A TYR 238.A N ALA 234.A O no hydrogen 2.890 N/A TYR 238.A OH SER 18.A OG no hydrogen 2.577 N/A ALA 239.A N GLY 235.A O no hydrogen 2.951 N/A ASP 240.A N LYS 236.A O no hydrogen 2.823 N/A THR 241.A N ALA 237.A O no hydrogen 2.988 N/A THR 241.A OG1 ALA 237.A O no hydrogen 2.934 N/A VAL 242.A N TYR 238.A O no hydrogen 2.938 N/A GLU 243.A N ALA 239.A O no hydrogen 3.068 N/A ARG 244.A N ASP 240.A O no hydrogen 2.960 N/A ARG 244.A NE ARG 250.A O no hydrogen 3.219 N/A ARG 244.A NH1 VAL 207.A O no hydrogen 2.916 N/A ARG 244.A NH2 ARG 250.A O no hydrogen 3.493 N/A ARG 244.A NH2 PRO 251.A O no hydrogen 3.320 N/A LEU 245.A N THR 241.A O no hydrogen 2.858 N/A LEU 246.A N VAL 242.A O no hydrogen 3.124 N/A LEU 246.A N GLU 243.A O no hydrogen 2.980 N/A GLY 247.A N ARG 244.A O no hydrogen 2.991 N/A GLU 248.A N GLU 243.A O no hydrogen 3.093 N/A ARG 250.A NH1 GLU 249.A O no hydrogen 3.068 N/A ARG 253.A NE ASP 240.A OD2 no hydrogen 2.728 N/A ARG 253.A NH2 ASP 240.A OD1 no hydrogen 2.907 N/A ARG 253.A NH2 ASP 240.A OD2 no hydrogen 3.078 N/A