Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rqr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 7.A N ASN 130.A OD1 no hydrogen 3.139 N/A THR 9.A OG1 GLU 78.A OE1 no hydrogen 3.495 N/A VAL 12.A N THR 9.A O no hydrogen 2.942 N/A LEU 18.A N PRO 15.A O no hydrogen 3.044 N/A ASP 19.A N GLU 16.A O no hydrogen 3.036 N/A ILE 22.A N LEU 18.A O no hydrogen 2.929 N/A ASN 23.A N ASP 19.A O no hydrogen 3.069 N/A LYS 24.A N SER 20.A O no hydrogen 2.956 N/A PHE 25.A N PHE 21.A O no hydrogen 2.907 N/A ALA 26.A N ILE 22.A O no hydrogen 2.861 N/A GLU 27.A N ASN 23.A O no hydrogen 3.053 N/A TYR 28.A N LYS 24.A O no hydrogen 2.981 N/A TYR 28.A OH GLU 174.A OE1.B no hydrogen 2.885 N/A TYR 28.A OH GLU 174.A OE2.A no hydrogen 3.024 N/A THR 29.A N PHE 25.A O no hydrogen 2.860 N/A THR 29.A OG1 PHE 25.A O no hydrogen 2.787 N/A HIS 30.A N ALA 26.A O no hydrogen 3.015 N/A HIS 30.A ND1 TYR 72.A OH no hydrogen 2.896 N/A HIS 30.A NE2 ARG 59.A O no hydrogen 2.711 N/A GLU 31.A N GLU 27.A O no hydrogen 2.885 N/A LYS 32.A N TYR 28.A O no hydrogen 2.856 N/A LYS 32.A NZ ASP 36.A OD1 no hydrogen 2.925 N/A LYS 32.A NZ ASP 36.A OD2 no hydrogen 2.924 N/A TRP 33.A N THR 29.A O no hydrogen 3.020 N/A ALA 34.A N HIS 30.A O no hydrogen 2.731 N/A PHE 35.A N GLU 31.A O no hydrogen 2.780 N/A ASP 36.A N LYS 32.A O no hydrogen 3.138 N/A LYS 37.A N TRP 33.A O no hydrogen 3.314 N/A ILE 38.A N ALA 34.A O no hydrogen 2.889 N/A GLN 39.A N PHE 35.A O no hydrogen 2.957 N/A ASN 40.A N LYS 37.A O no hydrogen 2.926 N/A ASN 40.A ND2 ASN 40.A O no hydrogen 2.889 N/A ASN 41.A N ILE 38.A O no hydrogen 3.327 N/A TRP 42.A N LYS 37.A O no hydrogen 2.954 N/A SER 43.A N LYS 53.A O no hydrogen 2.896 N/A ASP 49.A N THR 54.A O no hydrogen 2.938 N/A GLU 51.A N ASP 49.A OD2 no hydrogen 3.277 N/A THR 54.A N ASP 49.A O no hydrogen 3.063 N/A THR 54.A OG1 SER 43.A O no hydrogen 3.290 N/A HIS 55.A N SER 43.A O no hydrogen 3.187 N/A MET 57.A N HIS 55.A ND1 no hydrogen 3.142 N/A LEU 58.A N HIS 55.A O no hydrogen 3.363 N/A ARG 59.A N MET 57.A O no hydrogen 2.844 N/A ARG 59.A NE PRO 56.A O no hydrogen 2.842 N/A ARG 59.A NH1 THR 63.A OG1 no hydrogen 3.242 N/A THR 63.A N PRO 60.A O no hydrogen 3.008 N/A THR 63.A OG1 PRO 60.A O no hydrogen 2.519 N/A PHE 64.A N TYR 61.A O no hydrogen 3.207 N/A ASP 68.A N SER 65.A OG no hydrogen 3.248 N/A LYS 69.A N SER 65.A O no hydrogen 2.909 N/A LYS 69.A NZ GLU 66.A OE1 no hydrogen 3.165 N/A GLU 70.A N LYS 67.A O no hydrogen 3.125 N/A ILE 71.A N ASP 68.A O no hydrogen 3.128 N/A TYR 72.A N LYS 69.A O no hydrogen 3.031 N/A TYR 72.A OH HIS 30.A ND1 no hydrogen 2.896 N/A ARG 73.A N LYS 69.A O no hydrogen 3.028 N/A ARG 73.A NE ASN 23.A OD1 no hydrogen 3.313 N/A ARG 73.A NH1 GLU 66.A OE2 no hydrogen 3.070 N/A ARG 73.A NH1 GLU 70.A OE2 no hydrogen 3.285 N/A ARG 73.A NH2 ASN 23.A OD1 no hydrogen 3.343 N/A ARG 73.A NH2 GLU 66.A OE2 no hydrogen 2.645 N/A TRP 74.A N GLU 70.A O no hydrogen 3.057 N/A LYS 77.A N ARG 73.A O no hydrogen 2.896 N/A LYS 77.A NZ GLU 70.A OE1 no hydrogen 3.187 N/A LYS 77.A NZ GLU 70.A OE2 no hydrogen 3.479 N/A GLU 78.A N TRP 74.A O no hydrogen 3.174 N/A SER 79.A N PRO 75.A O no hydrogen 3.097 N/A SER 79.A OG PRO 75.A O no hydrogen 3.321 N/A SER 79.A OG TYR 131.A OH no hydrogen 2.613 N/A LEU 80.A N ILE 76.A O no hydrogen 2.990 N/A LYS 81.A N LYS 77.A O no hydrogen 2.690 N/A ALA 82.A N GLU 78.A O no hydrogen 3.135 N/A MET 83.A N SER 79.A O no hydrogen 3.163 N/A ILE 84.A N LEU 80.A O no hydrogen 2.981 N/A ALA 85.A N LYS 81.A O no hydrogen 2.799 N/A TRP 86.A N ALA 82.A O no hydrogen 3.093 N/A GLU 87.A N ILE 84.A O no hydrogen 2.872 N/A TRP 88.A N MET 83.A O no hydrogen 3.036 N/A THR 89.A N THR 187.A O no hydrogen 2.875 N/A THR 89.A OG1 THR 187.A OG1 no hydrogen 2.546 N/A GLU 91.A N ALA 185.A O no hydrogen 3.019 N/A LYS 92.A NZ ASN 182.A O no hydrogen 2.812 N/A ALA 93.A N GLY 183.A O no hydrogen 2.738 N/A ARG 94.A N GLY 183.A O no hydrogen 3.039 N/A ARG 94.A NH2 GLN 180.A O no hydrogen 2.891 N/A ARG 94.A NH2 TYR 184.A O no hydrogen 2.944 N/A GLU 97.A N GLU 95.A O no hydrogen 2.866 N/A ARG 101.A N ASN 105.A OD1 no hydrogen 3.154 N/A ASN 105.A ND2 GLY 103.A O no hydrogen 3.586 N/A SER 112.A N ASP 110.A OD2 no hydrogen 3.361 N/A SER 112.A OG ASP 110.A OD2 no hydrogen 2.991 N/A VAL 114.A N LEU 111.A O no hydrogen 3.414 N/A LEU 120.A N SER 117.A OG no hydrogen 3.237 N/A GLN 121.A N SER 117.A O no hydrogen 3.000 N/A GLN 121.A NE2 LEU 116.A O no hydrogen 2.937 N/A ALA 122.A N ARG 118.A O no hydrogen 2.981 N/A MET 123.A N GLU 119.A O no hydrogen 2.980 N/A ALA 124.A N LEU 120.A O no hydrogen 2.812 N/A GLU 125.A N GLN 121.A O no hydrogen 3.035 N/A GLN 126.A N ALA 122.A O no hydrogen 3.056 N/A LEU 127.A N MET 123.A O no hydrogen 2.978 N/A ALA 128.A N ALA 124.A O no hydrogen 2.827 N/A GLU 129.A N GLU 125.A O no hydrogen 2.986 N/A ASN 130.A N GLN 126.A O no hydrogen 3.140 N/A TYR 131.A N LEU 127.A O no hydrogen 2.924 N/A TYR 131.A OH SER 79.A OG no hydrogen 2.613 N/A HIS 132.A N ALA 128.A O no hydrogen 3.030 N/A HIS 132.A NE2 VAL 155.A O no hydrogen 2.748 N/A ASN 133.A N GLU 129.A O no hydrogen 2.888 N/A THR 134.A N ASN 130.A O no hydrogen 2.877 N/A THR 134.A OG1 ASN 130.A O no hydrogen 2.649 N/A TRP 135.A N TYR 131.A O no hydrogen 3.060 N/A GLY 136.A N HIS 132.A O no hydrogen 2.822 N/A ARG 137.A N ASN 133.A O no hydrogen 2.881 N/A ARG 137.A NH1 PRO 4.A O no hydrogen 3.179 N/A LYS 138.A N THR 134.A O no hydrogen 3.138 N/A LYS 139.A N TRP 135.A O no hydrogen 2.816 N/A LYS 139.A NZ GLU 142.A OE1 no hydrogen 3.329 N/A LYS 140.A N GLY 136.A O no hydrogen 2.875 N/A LYS 140.A NZ PHE 2.A O no hydrogen 2.910 N/A GLN 141.A N ARG 137.A O no hydrogen 3.072 N/A GLU 142.A N LYS 138.A O no hydrogen 2.959 N/A LEU 143.A N LYS 139.A O no hydrogen 2.870 N/A GLU 144.A N LYS 140.A O no hydrogen 2.999 N/A ALA 145.A N GLN 141.A O no hydrogen 2.973 N/A LYS 146.A N GLU 142.A O no hydrogen 2.783 N/A HIS 151.A N THR 150.A OG1 no hydrogen 2.689 N/A LEU 153.A N HIS 151.A ND1 no hydrogen 2.971 N/A LEU 154.A N HIS 151.A O no hydrogen 2.989 N/A TYR 157.A OH GLU 125.A OE1 no hydrogen 2.704 N/A THR 159.A N PRO 156.A O no hydrogen 3.047 N/A THR 159.A OG1 PRO 156.A O no hydrogen 2.711 N/A LEU 160.A N TYR 157.A O no hydrogen 3.176 N/A THR 161.A N GLU 164.A OE1 no hydrogen 2.775 N/A GLU 164.A N THR 161.A OG1 no hydrogen 3.204 N/A LYS 165.A N THR 161.A O no hydrogen 3.037 N/A LYS 165.A NZ GLU 125.A OE2 no hydrogen 3.136 N/A ALA 166.A N LYS 163.A O no hydrogen 3.367 N/A ARG 169.A N LYS 165.A O no hydrogen 2.956 N/A ARG 169.A NE GLU 125.A OE1 no hydrogen 2.689 N/A ARG 169.A NH2 GLU 125.A OE1 no hydrogen 3.434 N/A ARG 169.A NH2 GLU 125.A OE2 no hydrogen 3.048 N/A GLU 170.A N ALA 166.A O no hydrogen 2.771 N/A LYS 171.A N ARG 167.A O no hydrogen 3.221 N/A ALA 172.A N ASP 168.A O no hydrogen 3.116 N/A GLN 173.A N ARG 169.A O no hydrogen 2.860 N/A GLU 174.A N.A GLU 170.A O no hydrogen 2.930 N/A GLU 174.A N.B GLU 170.A O no hydrogen 2.939 N/A LEU 175.A N LYS 171.A O no hydrogen 3.356 N/A LEU 176.A N ALA 172.A O no hydrogen 3.179 N/A LYS 177.A N GLN 173.A O no hydrogen 2.880 N/A LYS 177.A NZ LEU 111.A O no hydrogen 2.860 N/A LYS 177.A NZ VAL 114.A O no hydrogen 2.816 N/A PHE 178.A N GLU 174.A O.A no hydrogen 3.031 N/A PHE 178.A N GLU 174.A O.B no hydrogen 3.042 N/A LEU 179.A N LEU 175.A O no hydrogen 2.938 N/A GLN 180.A N LEU 176.A O no hydrogen 2.991 N/A GLN 180.A NE2 THR 115.A O no hydrogen 2.756 N/A MET 181.A N LYS 177.A O no hydrogen 2.783 N/A ASN 182.A N PHE 178.A O no hydrogen 2.994 N/A ASN 182.A N LEU 179.A O no hydrogen 3.244 N/A ASN 182.A ND2 PHE 178.A O no hydrogen 2.721 N/A GLY 183.A N GLN 180.A O no hydrogen 3.015 N/A TYR 184.A N LEU 179.A O no hydrogen 3.048 N/A ALA 185.A N GLU 91.A O no hydrogen 2.762 N/A THR 187.A N THR 89.A O no hydrogen 3.061 N/A THR 187.A OG1 THR 89.A OG1 no hydrogen 2.546 N/A ARG 188.A NE GLU 119.A OE2 no hydrogen 2.707 N/A ARG 188.A NH2 GLU 119.A OE1 no hydrogen 3.108 N/A ARG 188.A NH2 GLU 119.A OE2 no hydrogen 3.408 N/A GLY 189.A N THR 187.A OG1 no hydrogen 3.353 N/A