Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xq3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A N PRO 1.A O no hydrogen 2.648 N/A VAL 6.A N ILE 2.A O no hydrogen 3.029 N/A LEU 7.A N PHE 3.A O no hydrogen 3.143 N/A GLU 8.A N LEU 4.A O no hydrogen 2.957 N/A ALA 9.A N ASN 5.A O no hydrogen 3.018 N/A ILE 10.A N VAL 6.A O no hydrogen 2.980 N/A GLU 11.A N GLU 8.A O no hydrogen 3.421 N/A ALA 17.A N ASP 97.A OD1 no hydrogen 2.898 N/A GLY 18.A N ASP 97.A OD2 no hydrogen 2.662 N/A HIS 19.A ND1 SER 33.A OG no hydrogen 2.483 N/A ASN 21.A ND2 ASP 97.A O no hydrogen 3.083 N/A ASN 22.A N ASP 20.A OD2 no hydrogen 3.070 N/A GLN 23.A N ASP 20.A O no hydrogen 3.374 N/A ALA 29.A N SER 26.A OG no hydrogen 3.054 N/A LEU 30.A N SER 26.A O no hydrogen 2.854 N/A LEU 31.A N PHE 27.A O no hydrogen 3.151 N/A SER 32.A N ALA 28.A O no hydrogen 3.047 N/A SER 32.A OG ALA 28.A O no hydrogen 2.686 N/A SER 33.A N ALA 29.A O no hydrogen 3.110 N/A SER 33.A OG HIS 19.A ND1 no hydrogen 2.483 N/A SER 33.A OG ALA 29.A O no hydrogen 3.281 N/A LEU 34.A N LEU 30.A O no hydrogen 2.906 N/A ASN 35.A N LEU 31.A O no hydrogen 2.842 N/A ASN 35.A ND2 ASP 214.A O no hydrogen 3.064 N/A GLU 36.A N SER 32.A O no hydrogen 3.029 N/A LEU 37.A N SER 33.A O no hydrogen 2.820 N/A GLY 38.A N LEU 34.A O no hydrogen 2.689 N/A GLU 39.A N ASN 35.A O no hydrogen 2.976 N/A ARG 40.A N GLU 36.A O no hydrogen 3.012 N/A ARG 40.A NE GLU 36.A OE1 no hydrogen 2.898 N/A ARG 40.A NH1 CYS 16.A O no hydrogen 2.956 N/A GLN 41.A N LEU 37.A O no hydrogen 2.779 N/A LEU 42.A N GLY 38.A O no hydrogen 2.884 N/A VAL 43.A N GLU 39.A O no hydrogen 3.237 N/A VAL 45.A N GLN 41.A O no hydrogen 2.838 N/A VAL 46.A N LEU 42.A O no hydrogen 3.026 N/A LYS 47.A N VAL 43.A O no hydrogen 3.266 N/A TRP 48.A N HIS 44.A O no hydrogen 2.835 N/A ALA 49.A N VAL 45.A O no hydrogen 2.898 N/A LYS 50.A N VAL 46.A O no hydrogen 3.058 N/A ALA 51.A N TRP 48.A O no hydrogen 3.041 N/A LEU 52.A N ALA 49.A O no hydrogen 3.049 N/A PHE 55.A N LEU 52.A O no hydrogen 3.084 N/A ASN 57.A N GLY 54.A O no hydrogen 2.900 N/A LEU 58.A N PHE 55.A O no hydrogen 3.099 N/A HIS 59.A NE2 ASP 61.A OD2 no hydrogen 2.963 N/A GLN 63.A N HIS 59.A O no hydrogen 3.028 N/A GLN 63.A NE2 LEU 58.A O no hydrogen 2.765 N/A ALA 65.A N ASP 61.A O no hydrogen 3.347 N/A VAL 66.A N ASP 62.A O no hydrogen 2.914 N/A ILE 67.A N GLN 63.A O no hydrogen 3.338 N/A GLN 68.A N MET 64.A O no hydrogen 2.895 N/A TYR 69.A N ALA 65.A O no hydrogen 2.995 N/A SER 70.A N VAL 66.A O no hydrogen 3.085 N/A SER 70.A OG VAL 66.A O no hydrogen 3.282 N/A SER 70.A OG LEU 141.A O no hydrogen 3.452 N/A SER 70.A OG LEU 142.A O no hydrogen 2.887 N/A TRP 71.A N ILE 67.A O no hydrogen 2.941 N/A LEU 74.A N SER 70.A O no hydrogen 2.853 N/A MET 75.A N TRP 71.A O no hydrogen 2.942 N/A VAL 76.A N MET 72.A O no hydrogen 2.974 N/A PHE 77.A N GLY 73.A O no hydrogen 2.883 N/A ALA 78.A N LEU 74.A O no hydrogen 3.049 N/A MET 79.A N MET 75.A O no hydrogen 2.952 N/A GLY 80.A N VAL 76.A O no hydrogen 2.955 N/A TRP 81.A N PHE 77.A O no hydrogen 3.106 N/A ARG 82.A N ALA 78.A O no hydrogen 2.871 N/A ARG 82.A NE TYR 93.A O no hydrogen 3.285 N/A ARG 82.A NH2 PHE 94.A O no hydrogen 2.882 N/A SER 83.A N MET 79.A O no hydrogen 2.860 N/A SER 83.A OG MET 79.A O no hydrogen 3.003 N/A SER 83.A OG MET 91.A O no hydrogen 3.388 N/A PHE 84.A N GLY 80.A O no hydrogen 2.990 N/A THR 85.A N TRP 81.A O no hydrogen 2.992 N/A THR 85.A OG1 TRP 81.A O no hydrogen 3.340 N/A THR 85.A OG1 ARG 82.A O no hydrogen 3.440 N/A THR 85.A OG1 ASN 86.A OD1 no hydrogen 2.825 N/A ASN 86.A N ARG 82.A O no hydrogen 2.878 N/A VAL 87.A N SER 83.A O no hydrogen 3.072 N/A SER 89.A N SER 83.A O no hydrogen 2.798 N/A SER 89.A OG SER 121.A OG no hydrogen 2.705 N/A ARG 90.A N VAL 87.A O no hydrogen 2.741 N/A LEU 92.A N PHE 100.A O no hydrogen 3.341 N/A TYR 93.A N SER 83.A OG no hydrogen 2.742 N/A LEU 98.A N ALA 95.A O no hydrogen 2.829 N/A PHE 100.A N LEU 92.A O no hydrogen 2.907 N/A ARG 104.A N ASN 101.A OD1 no hydrogen 2.819 N/A ARG 104.A NE ASP 25.A OD1 no hydrogen 2.633 N/A ARG 104.A NH1 VAL 99.A O no hydrogen 2.908 N/A ARG 104.A NH2 ASN 21.A OD1 no hydrogen 3.151 N/A ARG 104.A NH2 ASP 25.A OD1 no hydrogen 3.043 N/A MET 105.A N ASN 101.A O no hydrogen 2.992 N/A HIS 106.A N GLU 102.A O no hydrogen 3.114 N/A LYS 107.A N TYR 103.A O no hydrogen 2.896 N/A SER 108.A N ARG 104.A O no hydrogen 2.925 N/A SER 108.A OG ARG 104.A O no hydrogen 3.047 N/A SER 108.A OG MET 105.A O no hydrogen 3.002 N/A ARG 109.A N HIS 106.A O no hydrogen 3.091 N/A TYR 111.A OH GLU 102.A OE1 no hydrogen 2.635 N/A TYR 111.A OH GLU 102.A OE2 no hydrogen 3.284 N/A SER 112.A OG GLN 113.A OE1 no hydrogen 3.312 N/A GLN 113.A N GLN 113.A OE1 no hydrogen 2.700 N/A CYS 114.A N MET 110.A O no hydrogen 2.786 N/A CYS 114.A SG MET 110.A O no hydrogen 3.500 N/A VAL 115.A N TYR 111.A O no hydrogen 2.805 N/A ARG 116.A N SER 112.A O no hydrogen 3.002 N/A ARG 116.A NE GLU 196.A OE2 no hydrogen 3.080 N/A ARG 116.A NH2 GLU 196.A OE2 no hydrogen 2.743 N/A MET 117.A N GLN 113.A O no hydrogen 2.870 N/A ARG 118.A N CYS 114.A O no hydrogen 2.809 N/A HIS 119.A N VAL 115.A O no hydrogen 3.000 N/A LEU 120.A N ARG 116.A O no hydrogen 3.142 N/A SER 121.A N MET 117.A O no hydrogen 2.954 N/A SER 121.A OG GLY 80.A O no hydrogen 2.943 N/A SER 121.A OG SER 89.A OG no hydrogen 2.705 N/A GLN 122.A N ARG 118.A O no hydrogen 2.915 N/A GLU 123.A N HIS 119.A O no hydrogen 3.004 N/A PHE 124.A N SER 121.A O no hydrogen 3.053 N/A GLY 125.A N GLN 122.A O no hydrogen 2.855 N/A TRP 126.A N GLN 122.A O no hydrogen 2.901 N/A LEU 127.A N GLU 123.A O no hydrogen 2.895 N/A GLN 128.A N GLY 125.A O no hydrogen 2.772 N/A ILE 129.A N PHE 124.A O no hydrogen 2.982 N/A THR 130.A N GLU 133.A OE1 no hydrogen 2.911 N/A GLU 133.A N THR 130.A OG1 no hydrogen 3.159 N/A PHE 134.A N THR 130.A O no hydrogen 2.895 N/A LEU 135.A N PRO 131.A O no hydrogen 2.993 N/A CYS 136.A N GLN 132.A O no hydrogen 3.066 N/A CYS 136.A SG GLN 132.A O no hydrogen 3.328 N/A MET 137.A N GLU 133.A O no hydrogen 2.853 N/A LYS 138.A N PHE 134.A O no hydrogen 2.883 N/A LYS 138.A NZ GLU 11.A OE1 no hydrogen 2.835 N/A ALA 139.A N LEU 135.A O no hydrogen 3.102 N/A LEU 140.A N CYS 136.A O no hydrogen 2.990 N/A LEU 141.A N MET 137.A O no hydrogen 2.844 N/A LEU 142.A N ALA 139.A O no hydrogen 2.892 N/A PHE 143.A N LEU 140.A O no hydrogen 2.944 N/A SER 144.A OG LEU 140.A O no hydrogen 2.728 N/A ILE 146.A N LYS 236.A O no hydrogen 3.059 N/A VAL 148.A N LYS 234.A O no hydrogen 2.783 N/A GLY 150.A N PRO 147.A O no hydrogen 2.974 N/A LEU 151.A N GLN 154.A OE1 no hydrogen 2.974 N/A LYS 152.A N ASP 62.A OD1 no hydrogen 2.782 N/A ASN 153.A N ASP 62.A OD2 no hydrogen 2.907 N/A GLN 154.A NE2 ASP 158.A OD1 no hydrogen 2.765 N/A ASP 158.A N GLN 154.A O no hydrogen 2.836 N/A GLU 159.A N LYS 155.A O no hydrogen 3.075 N/A LEU 160.A N PHE 156.A O no hydrogen 2.961 N/A ARG 161.A N PHE 157.A O no hydrogen 2.816 N/A ARG 161.A NH1 PHE 143.A O no hydrogen 2.930 N/A ARG 161.A NH1 SER 144.A OG no hydrogen 3.289 N/A MET 162.A N ASP 158.A O no hydrogen 2.977 N/A ASN 163.A N GLU 159.A O no hydrogen 3.094 N/A TYR 164.A N LEU 160.A O no hydrogen 3.122 N/A TYR 164.A OH PRO 53.A O no hydrogen 2.656 N/A ILE 165.A N ARG 161.A O no hydrogen 3.039 N/A ILE 165.A N MET 162.A O no hydrogen 3.224 N/A LYS 166.A N MET 162.A O no hydrogen 3.048 N/A GLU 167.A N ASN 163.A O no hydrogen 2.944 N/A LEU 168.A N TYR 164.A O no hydrogen 3.214 N/A ASP 169.A N ILE 165.A O no hydrogen 3.026 N/A ARG 170.A N LYS 166.A O no hydrogen 2.983 N/A ILE 171.A N GLU 167.A O no hydrogen 3.137 N/A ILE 172.A N LEU 168.A O no hydrogen 3.095 N/A ALA 173.A N ASP 169.A O no hydrogen 2.921 N/A ARG 179.A N SER 175.A O no hydrogen 2.905 N/A ARG 179.A NE GLU 133.A OE2 no hydrogen 3.003 N/A ARG 179.A NH1 LEU 127.A O no hydrogen 2.757 N/A ARG 179.A NH2 LEU 127.A O no hydrogen 3.130 N/A ARG 179.A NH2 GLN 128.A O no hydrogen 3.058 N/A ARG 179.A NH2 GLU 133.A OE1 no hydrogen 2.670 N/A ARG 179.A NH2 GLU 133.A OE2 no hydrogen 3.410 N/A PHE 180.A N CYS 176.A O no hydrogen 2.808 N/A TYR 181.A N SER 177.A O no hydrogen 3.024 N/A GLN 182.A N ARG 178.A O no hydrogen 2.991 N/A LEU 183.A N ARG 179.A O no hydrogen 2.897 N/A THR 184.A N PHE 180.A O no hydrogen 3.090 N/A THR 184.A OG1 PHE 180.A O no hydrogen 2.780 N/A THR 184.A OG1 TYR 181.A O no hydrogen 2.900 N/A LYS 185.A N TYR 181.A O no hydrogen 3.050 N/A LEU 186.A N GLN 182.A O no hydrogen 3.103 N/A LEU 187.A N LEU 183.A O no hydrogen 2.903 N/A ASP 188.A N THR 184.A O no hydrogen 2.934 N/A SER 189.A N LYS 185.A O no hydrogen 2.987 N/A SER 189.A OG LEU 186.A O no hydrogen 2.688 N/A VAL 190.A N LEU 187.A O no hydrogen 3.288 N/A GLN 191.A N ASP 188.A O no hydrogen 3.145 N/A ALA 194.A N VAL 190.A O no hydrogen 2.787 N/A ARG 195.A N GLN 191.A O no hydrogen 2.762 N/A ARG 195.A NH2 LEU 231.A O no hydrogen 3.169 N/A GLU 196.A N PRO 192.A O no hydrogen 3.170 N/A LEU 197.A N ILE 193.A O no hydrogen 3.122 N/A HIS 198.A N ALA 194.A O no hydrogen 2.846 N/A GLN 199.A N ARG 195.A O no hydrogen 2.983 N/A GLN 199.A NE2 GLN 199.A O no hydrogen 3.350 N/A GLN 199.A NE2 ASP 203.A OD1 no hydrogen 3.028 N/A GLN 199.A NE2 ASP 203.A OD2 no hydrogen 3.404 N/A PHE 200.A N GLU 196.A O no hydrogen 2.866 N/A THR 201.A N LEU 197.A O no hydrogen 2.743 N/A PHE 202.A N HIS 198.A O no hydrogen 3.025 N/A ASP 203.A N GLN 199.A O no hydrogen 3.037 N/A LEU 204.A N PHE 200.A O no hydrogen 2.960 N/A LEU 205.A N THR 201.A O no hydrogen 2.870 N/A ILE 206.A N PHE 202.A O no hydrogen 3.169 N/A LYS 207.A N ASP 203.A O no hydrogen 3.306 N/A LYS 207.A N LEU 204.A O no hydrogen 3.207 N/A SER 208.A N LEU 205.A O no hydrogen 3.241 N/A SER 208.A OG LEU 205.A O no hydrogen 2.858 N/A MET 210.A N LYS 207.A O no hydrogen 3.007 N/A VAL 211.A N LYS 207.A O no hydrogen 3.183 N/A VAL 213.A N SER 208.A O no hydrogen 3.072 N/A ASP 214.A N SER 32.A OG no hydrogen 3.307 N/A MET 218.A N GLU 39.A OE2 no hydrogen 3.201 N/A MET 219.A N GLU 39.A OE1 no hydrogen 3.065 N/A ALA 220.A N PRO 216.A O no hydrogen 2.955 N/A GLU 221.A N GLU 217.A O no hydrogen 3.081 N/A ILE 222.A N MET 218.A O no hydrogen 3.072 N/A ILE 223.A N MET 219.A O no hydrogen 2.818 N/A SER 224.A N ALA 220.A O no hydrogen 3.155 N/A SER 224.A N GLU 221.A O no hydrogen 3.245 N/A SER 224.A OG ALA 220.A O no hydrogen 2.629 N/A SER 224.A OG GLU 221.A O no hydrogen 3.185 N/A VAL 225.A N GLU 221.A O no hydrogen 2.819 N/A GLN 226.A N ILE 222.A O no hydrogen 2.909 N/A VAL 227.A N ILE 222.A O no hydrogen 2.955 N/A LYS 229.A N GLN 226.A O no hydrogen 3.073 N/A ILE 230.A N VAL 227.A O no hydrogen 2.810 N/A LEU 231.A N VAL 227.A O no hydrogen 2.961 N/A SER 232.A N PRO 228.A O no hydrogen 2.863 N/A SER 232.A OG PRO 228.A O no hydrogen 2.760 N/A SER 232.A OG LYS 229.A O no hydrogen 3.508 N/A GLY 233.A N ILE 230.A O no hydrogen 3.102 N/A LYS 234.A N LYS 229.A O no hydrogen 2.793 N/A VAL 235.A N LYS 229.A O no hydrogen 3.045 N/A LYS 236.A N ILE 146.A O no hydrogen 2.848 N/A ILE 238.A N SER 144.A O no hydrogen 2.743 N/A PHE 240.A N ASP 188.A OD1 no hydrogen 2.725 N/A PHE 240.A N ASP 188.A OD2 no hydrogen 3.201 N/A HIS 241.A N ASP 188.A OD2 no hydrogen 2.948 N/A HIS 241.A ND1 ASP 188.A OD2 no hydrogen 3.285 N/A