Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4quw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ASP 3.A OD1 no hydrogen 2.881 N/A SER 6.A N ASP 3.A OD1 no hydrogen 3.128 N/A SER 6.A OG ASP 3.A O no hydrogen 3.149 N/A LYS 10.A N SER 6.A O no hydrogen 3.501 N/A LYS 10.A NZ LEU 66.A O no hydrogen 2.944 N/A LYS 10.A NZ SER 67.A O no hydrogen 2.431 N/A ASP 11.A N GLU 7.A O no hydrogen 3.001 N/A ALA 12.A N SER 8.A O no hydrogen 2.939 N/A TYR 13.A N TYR 9.A O no hydrogen 2.697 N/A TYR 13.A OH TYR 117.A OH no hydrogen 2.798 N/A SER 14.A N LYS 10.A O no hydrogen 2.921 N/A SER 14.A N ASP 11.A O no hydrogen 3.024 N/A SER 14.A OG ASP 11.A O no hydrogen 2.566 N/A ARG 15.A N ALA 12.A O no hydrogen 3.171 N/A ARG 15.A NE ASP 179.A OD2 no hydrogen 2.500 N/A ARG 15.A NH1 ASP 11.A OD1 no hydrogen 3.137 N/A ARG 15.A NH2 ASP 11.A OD2 no hydrogen 3.216 N/A ARG 15.A NH2 ASP 179.A OD1 no hydrogen 2.697 N/A ILE 16.A N ALA 12.A O no hydrogen 3.039 N/A ASN 17.A N TYR 13.A O no hydrogen 2.863 N/A ASN 17.A ND2 PHE 59.A O no hydrogen 3.025 N/A ILE 19.A N ARG 15.A O no hydrogen 2.879 N/A VAL 20.A N ILE 16.A O no hydrogen 3.177 N/A ILE 21.A N ASN 17.A O no hydrogen 2.983 N/A GLU 22.A N ALA 18.A O no hydrogen 2.781 N/A GLY 23.A N ILE 19.A O no hydrogen 2.802 N/A GLU 24.A N VAL 20.A O no hydrogen 2.849 N/A GLN 25.A N ILE 21.A O no hydrogen 2.851 N/A GLN 25.A NE2 ASP 29.A OD2 no hydrogen 3.436 N/A GLU 26.A N GLU 22.A O no hydrogen 2.879 N/A ALA 27.A N GLY 23.A O no hydrogen 2.931 N/A PHE 28.A N GLU 24.A O no hydrogen 2.902 N/A ASP 29.A N GLN 25.A O no hydrogen 3.086 N/A ASN 30.A N GLU 26.A O no hydrogen 2.657 N/A ASN 30.A ND2 GLN 102.A OE1 no hydrogen 2.768 N/A TYR 31.A N ALA 27.A O no hydrogen 2.842 N/A TYR 31.A OH GLU 107.A OE1 no hydrogen 3.201 N/A TYR 31.A OH GLU 107.A OE2 no hydrogen 2.306 N/A ASN 32.A N PHE 28.A O no hydrogen 3.133 N/A ASN 32.A N ASP 29.A O no hydrogen 2.692 N/A ARG 33.A N ASP 29.A O no hydrogen 3.000 N/A LEU 34.A N ASN 30.A O no hydrogen 2.912 N/A ALA 35.A N TYR 31.A O no hydrogen 3.250 N/A GLU 36.A N ASN 32.A O no hydrogen 3.181 N/A MET 37.A N ARG 33.A O no hydrogen 3.019 N/A LEU 38.A N LEU 34.A O no hydrogen 3.086 N/A GLN 41.A N LEU 38.A O no hydrogen 2.851 N/A ARG 42.A N PRO 39.A O no hydrogen 3.064 N/A LEU 45.A N GLN 41.A O no hydrogen 2.783 N/A HIS 46.A N ASP 43.A O no hydrogen 2.870 N/A HIS 46.A ND1 ARG 42.A O no hydrogen 2.623 N/A LYS 47.A N ASP 43.A O no hydrogen 3.074 N/A LYS 50.A N HIS 46.A O no hydrogen 3.221 N/A LYS 50.A NZ GLN 53.A OE1 no hydrogen 3.266 N/A MET 51.A N LYS 47.A O no hydrogen 3.037 N/A GLU 52.A N LEU 48.A O no hydrogen 2.947 N/A GLN 53.A N ALA 49.A O no hydrogen 3.038 N/A ARG 54.A N LYS 50.A O no hydrogen 2.999 N/A HIS 55.A N MET 51.A O no hydrogen 3.011 N/A HIS 55.A ND1 GLU 52.A OE1 no hydrogen 3.172 N/A HIS 55.A NE2 ASP 135.A OD2 no hydrogen 2.871 N/A MET 56.A N GLU 52.A O no hydrogen 2.683 N/A LYS 57.A N GLN 53.A O no hydrogen 2.925 N/A GLY 58.A N ARG 54.A O no hydrogen 2.954 N/A PHE 59.A N HIS 55.A O no hydrogen 3.052 N/A MET 60.A N MET 56.A O no hydrogen 3.010 N/A ALA 61.A N LYS 57.A O no hydrogen 2.939 N/A CYS 62.A N GLY 58.A O no hydrogen 2.962 N/A CYS 62.A SG GLY 58.A O no hydrogen 3.498 N/A GLY 63.A N PHE 59.A O no hydrogen 3.073 N/A LYS 64.A N MET 60.A O no hydrogen 3.143 N/A ASN 65.A N ALA 61.A O no hydrogen 3.049 N/A LEU 66.A N GLY 63.A O no hydrogen 3.056 N/A SER 67.A N LYS 64.A O no hydrogen 2.700 N/A VAL 68.A N GLY 63.A O no hydrogen 2.975 N/A ASP 71.A N SER 14.A O no hydrogen 3.046 N/A GLY 73.A N ASP 71.A OD2 no hydrogen 3.211 N/A PHE 74.A N ASP 71.A OD2 no hydrogen 3.017 N/A ALA 75.A N ASP 71.A O no hydrogen 3.438 N/A GLN 76.A N MET 72.A O no hydrogen 3.176 N/A GLN 76.A N GLY 73.A O no hydrogen 3.163 N/A LYS 77.A N GLY 73.A O no hydrogen 3.304 N/A PHE 78.A N PHE 74.A O no hydrogen 3.113 N/A PHE 79.A N ALA 75.A O no hydrogen 3.242 N/A GLU 80.A N LYS 77.A O no hydrogen 3.438 N/A HIS 83.A N PHE 79.A O no hydrogen 2.811 N/A GLU 84.A N GLU 80.A O no hydrogen 2.674 N/A ASN 85.A N ARG 81.A O no hydrogen 2.982 N/A ASN 85.A ND2 ASN 165.A OD1 no hydrogen 2.696 N/A PHE 86.A N LEU 82.A O no hydrogen 2.947 N/A LYS 87.A N HIS 83.A O no hydrogen 2.980 N/A ALA 88.A N GLU 84.A O no hydrogen 2.893 N/A ALA 89.A N ASN 85.A O no hydrogen 2.951 N/A ALA 90.A N PHE 86.A O no hydrogen 2.810 N/A ALA 91.A N LYS 87.A O no hydrogen 2.835 N/A GLU 92.A N ALA 88.A O no hydrogen 3.331 N/A GLU 92.A N ALA 89.A O no hydrogen 3.081 N/A GLY 93.A N ALA 90.A O no hydrogen 3.182 N/A LYS 94.A N ALA 89.A O no hydrogen 3.016 N/A VAL 95.A N GLY 93.A O no hydrogen 2.962 N/A THR 97.A N GLU 157.A OE2 no hydrogen 2.837 N/A THR 97.A OG1 GLU 157.A OE2 no hydrogen 2.431 N/A CYS 98.A N LYS 94.A O no hydrogen 3.360 N/A CYS 98.A SG PHE 86.A O no hydrogen 3.655 N/A CYS 98.A SG LYS 94.A O no hydrogen 3.378 N/A LEU 99.A N VAL 95.A O no hydrogen 2.914 N/A LEU 100.A N VAL 96.A O no hydrogen 2.953 N/A ILE 101.A N THR 97.A O no hydrogen 3.067 N/A GLN 102.A N CYS 98.A O no hydrogen 2.989 N/A GLN 102.A NE2 GLU 107.A OE2 no hydrogen 2.924 N/A SER 103.A N LEU 99.A O no hydrogen 2.593 N/A LEU 104.A N LEU 99.A O no hydrogen 3.287 N/A ILE 105.A N LEU 100.A O no hydrogen 2.849 N/A ILE 106.A N ILE 101.A O no hydrogen 2.835 N/A GLU 107.A N GLN 102.A O no hydrogen 3.244 N/A CYS 108.A N LEU 104.A O no hydrogen 3.140 N/A CYS 108.A SG LEU 104.A O no hydrogen 2.978 N/A PHE 109.A N ILE 105.A O no hydrogen 3.024 N/A ALA 110.A N ILE 106.A O no hydrogen 3.015 N/A ILE 111.A N GLU 107.A O no hydrogen 3.075 N/A ALA 112.A N CYS 108.A O no hydrogen 2.993 N/A ALA 113.A N PHE 109.A O no hydrogen 2.939 N/A TYR 114.A N ALA 110.A O no hydrogen 2.771 N/A TYR 114.A OH GLU 24.A OE2 no hydrogen 3.120 N/A ASN 115.A N ILE 111.A O no hydrogen 3.208 N/A ASN 115.A ND2 TYR 137.A OH no hydrogen 3.311 N/A ILE 116.A N ALA 112.A O no hydrogen 3.186 N/A TYR 117.A N ALA 113.A O no hydrogen 2.845 N/A ILE 118.A N TYR 114.A O no hydrogen 3.055 N/A VAL 120.A N TYR 117.A O no hydrogen 2.918 N/A ALA 121.A N ILE 118.A O no hydrogen 3.142 N/A ALA 125.A N ASP 122.A OD1 no hydrogen 2.904 N/A ARG 126.A N ASP 122.A O no hydrogen 2.853 N/A LYS 127.A N ALA 123.A O no hydrogen 3.138 N/A ILE 128.A N PHE 124.A O no hydrogen 3.178 N/A THR 129.A N ALA 125.A O no hydrogen 2.914 N/A THR 129.A OG1 ALA 125.A O no hydrogen 2.622 N/A GLU 130.A N ARG 126.A O no hydrogen 2.891 N/A GLY 131.A N LYS 127.A O no hydrogen 2.976 N/A VAL 132.A N ILE 128.A O no hydrogen 2.779 N/A VAL 133.A N THR 129.A O no hydrogen 2.879 N/A ARG 134.A N GLU 130.A O no hydrogen 2.984 N/A ARG 134.A NE ASP 135.A OD1 no hydrogen 3.086 N/A ARG 134.A NH2 ASP 135.A OD1 no hydrogen 3.135 N/A ASP 135.A N GLY 131.A O no hydrogen 2.918 N/A GLU 136.A N VAL 132.A O no hydrogen 3.036 N/A TYR 137.A N VAL 133.A O no hydrogen 3.096 N/A LEU 138.A N ARG 134.A O no hydrogen 3.001 N/A HIS 139.A ND1 ASP 135.A O no hydrogen 2.840 N/A ASN 141.A ND2 SER 103.A O no hydrogen 3.325 N/A GLU 144.A N ASN 141.A OD1 no hydrogen 3.456 N/A GLU 145.A N ASN 141.A O no hydrogen 3.073 N/A TRP 146.A N PHE 142.A O no hydrogen 2.916 N/A LEU 147.A N GLY 143.A O no hydrogen 2.908 N/A LYS 148.A N GLU 144.A O no hydrogen 3.016 N/A ALA 149.A N GLU 145.A O no hydrogen 2.791 N/A ASN 150.A N TRP 146.A O no hydrogen 2.762 N/A ASN 150.A N LEU 147.A O no hydrogen 3.219 N/A ASN 150.A ND2 TRP 146.A O no hydrogen 3.090 N/A SER 154.A N ASN 150.A O no hydrogen 3.195 N/A SER 154.A N PHE 151.A O no hydrogen 2.769 N/A SER 154.A OG ASN 150.A O no hydrogen 2.638 N/A LYS 155.A NZ GLU 211.A OE1 no hydrogen 3.212 N/A LYS 155.A NZ GLU 211.A OE2 no hydrogen 2.522 N/A LEU 158.A N SER 154.A O no hydrogen 3.067 N/A GLU 159.A N LYS 155.A O no hydrogen 3.151 N/A GLU 160.A N ALA 156.A O no hydrogen 3.107 N/A ALA 161.A N GLU 157.A O no hydrogen 2.628 N/A ASN 162.A N LEU 158.A O no hydrogen 2.711 N/A ASN 162.A ND2 MET 215.A O no hydrogen 3.105 N/A ARG 163.A N GLU 159.A O no hydrogen 3.050 N/A ARG 163.A NH2 GLU 160.A OE2 no hydrogen 3.480 N/A GLN 164.A N GLU 160.A O no hydrogen 2.849 N/A ASN 165.A N ALA 161.A O no hydrogen 2.789 N/A ASN 165.A ND2 ALA 161.A O no hydrogen 2.809 N/A ASN 165.A ND2 GLN 164.A OE1 no hydrogen 3.140 N/A LEU 166.A N ASN 162.A O no hydrogen 2.783 N/A LEU 168.A N ASN 165.A O no hydrogen 2.948 N/A VAL 169.A N LEU 166.A O no hydrogen 3.061 N/A TRP 170.A N LEU 166.A O no hydrogen 3.246 N/A LEU 171.A N PRO 167.A O no hydrogen 3.033 N/A MET 172.A N LEU 168.A O no hydrogen 3.118 N/A LEU 173.A N VAL 169.A O no hydrogen 2.947 N/A ASN 174.A N TRP 170.A O no hydrogen 3.303 N/A GLU 175.A N LEU 171.A O no hydrogen 2.901 N/A VAL 176.A N MET 172.A O no hydrogen 3.048 N/A ALA 180.A N VAL 176.A O no hydrogen 2.972 N/A ARG 181.A N ALA 177.A O no hydrogen 2.903 N/A ARG 181.A NH1 GLU 188.A OE1 no hydrogen 3.119 N/A GLU 182.A N ASP 178.A O no hydrogen 3.095 N/A LEU 183.A N ASP 179.A O no hydrogen 3.209 N/A GLY 184.A N ARG 181.A O no hydrogen 2.865 N/A MET 185.A N ALA 180.A O no hydrogen 2.697 N/A ARG 187.A NH2 ASN 174.A OD1 no hydrogen 2.770 N/A GLU 188.A N GLU 188.A OE1 no hydrogen 2.782 N/A LEU 190.A N GLU 186.A O no hydrogen 3.200 N/A VAL 191.A N ARG 187.A O no hydrogen 3.111 N/A GLU 192.A N GLU 188.A O no hydrogen 3.033 N/A ASP 193.A N SER 189.A O no hydrogen 2.838 N/A PHE 194.A N LEU 190.A O no hydrogen 2.867 N/A MET 195.A N VAL 191.A O no hydrogen 3.083 N/A ILE 196.A N GLU 192.A O no hydrogen 2.990 N/A ALA 197.A N ASP 193.A O no hydrogen 3.029 N/A TYR 198.A N PHE 194.A O no hydrogen 2.750 N/A TYR 198.A OH ASN 162.A OD1 no hydrogen 2.717 N/A GLY 199.A N MET 195.A O no hydrogen 2.686 N/A GLU 200.A N ILE 196.A O no hydrogen 3.072 N/A ALA 201.A N ALA 197.A O no hydrogen 2.937 N/A LEU 202.A N TYR 198.A O no hydrogen 2.828 N/A GLU 203.A N GLY 199.A O no hydrogen 2.962 N/A ASN 204.A N GLU 200.A O no hydrogen 2.952 N/A ILE 205.A N ALA 201.A O no hydrogen 3.153 N/A GLY 206.A N LEU 202.A O no hydrogen 3.243 N/A GLY 206.A N GLU 203.A O no hydrogen 2.860 N/A PHE 207.A N LEU 202.A O no hydrogen 3.066 N/A THR 208.A N GLU 211.A OE1 no hydrogen 2.889 N/A GLU 211.A N THR 208.A OG1 no hydrogen 3.108 N/A ILE 212.A N THR 208.A O no hydrogen 2.731 N/A MET 213.A N THR 209.A O no hydrogen 2.979 N/A ARG 214.A N ARG 210.A O no hydrogen 3.160 N/A MET 215.A N GLU 211.A O no hydrogen 2.909 N/A SER 216.A N ILE 212.A O no hydrogen 2.888 N/A SER 216.A OG ILE 212.A O no hydrogen 2.821 N/A ALA 217.A N MET 213.A O no hydrogen 3.186 N/A TYR 218.A N MET 215.A O no hydrogen 3.400 N/A ALA 221.A N ALA 217.A O no hydrogen 3.122 N/A ALA 222.A N GLY 219.A O no hydrogen 3.377 N/A VAL 223.A N LEU 220.A O no hydrogen 3.106 N/A