Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8rhq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N VAL 100.A O no hydrogen 2.999 N/A HIS 3.A ND1 ASP 26.A OD2 no hydrogen 2.663 N/A SER 4.A N ASP 26.A OD1 no hydrogen 3.013 N/A MET 5.A N CYS 98.A O no hydrogen 2.887 N/A ARG 6.A N TYR 24.A O no hydrogen 2.908 N/A ARG 6.A NH1 MET 5.A O no hydrogen 3.082 N/A ARG 6.A NH1 CYS 98.A O no hydrogen 3.235 N/A ARG 6.A NH1 ASP 99.A OD1 no hydrogen 2.869 N/A ARG 6.A NH2 ASP 99.A OD1 no hydrogen 2.862 N/A TYR 7.A N TYR 96.A O no hydrogen 2.827 N/A PHE 8.A N VAL 22.A O no hydrogen 2.945 N/A TYR 9.A N ILE 94.A O no hydrogen 2.839 N/A TYR 9.A OH TYR 96.A OH no hydrogen 2.755 N/A THR 10.A N ILE 20.A O no hydrogen 2.822 N/A SER 11.A N ILE 92.A O no hydrogen 2.825 N/A VAL 12.A N ARG 18.A O no hydrogen 2.726 N/A SER 13.A N HIS 90.A O no hydrogen 2.813 N/A SER 13.A OG HIS 90.A O no hydrogen 3.407 N/A ARG 14.A NH1 ASP 36.A OD1 no hydrogen 3.445 N/A ARG 18.A N VAL 12.A O no hydrogen 2.793 N/A ARG 18.A NH2 ASP 34.A OD2 no hydrogen 2.963 N/A PHE 19.A N SER 35.A OG no hydrogen 2.792 N/A ILE 20.A N THR 10.A O no hydrogen 2.891 N/A ALA 21.A N PHE 33.A O no hydrogen 2.856 N/A VAL 22.A N PHE 8.A O no hydrogen 3.017 N/A GLY 23.A N VAL 31.A O no hydrogen 3.096 N/A TYR 24.A N ARG 6.A O no hydrogen 2.717 N/A VAL 25.A N THR 28.A O no hydrogen 2.932 N/A ASP 26.A N SER 4.A O no hydrogen 2.884 N/A ASP 27.A N TYR 206.A OH no hydrogen 3.387 N/A THR 28.A N VAL 25.A O no hydrogen 2.877 N/A THR 28.A OG1 TYR 206.A OH no hydrogen 2.762 N/A GLN 29.A NE2 VAL 31.A O no hydrogen 3.172 N/A PHE 30.A N GLY 23.A O no hydrogen 2.808 N/A ARG 32.A N GLU 43.A O no hydrogen 3.060 N/A ARG 32.A NE GLU 43.A OE1 no hydrogen 2.964 N/A ARG 32.A NH2 GLU 43.A OE1 no hydrogen 3.184 N/A PHE 33.A N ALA 21.A O no hydrogen 2.780 N/A SER 35.A N PHE 19.A O no hydrogen 2.843 N/A SER 35.A OG PHE 19.A O no hydrogen 3.367 N/A SER 35.A OG ASP 36.A OD1 no hydrogen 3.454 N/A ASP 36.A N ASP 34.A OD1 no hydrogen 2.776 N/A GLN 40.A NE2 SER 35.A O no hydrogen 2.773 N/A MET 42.A N THR 61.A OG1 no hydrogen 2.785 N/A GLU 43.A N ARG 32.A O no hydrogen 2.791 N/A ARG 45.A N PHE 30.A O no hydrogen 2.896 N/A ILE 49.A N ALA 46.A O no hydrogen 3.291 N/A GLU 50.A N PRO 47.A O no hydrogen 3.266 N/A GLU 52.A N ILE 49.A O no hydrogen 2.858 N/A GLU 55.A N GLU 55.A OE1 no hydrogen 2.632 N/A TYR 56.A OH TYR 168.A OH no hydrogen 2.736 N/A TRP 57.A N GLY 53.A O no hydrogen 3.410 N/A ASP 58.A N PRO 54.A O no hydrogen 2.980 N/A GLN 59.A N GLU 55.A O no hydrogen 3.042 N/A GLU 60.A N TYR 56.A O no hydrogen 2.934 N/A THR 61.A N TRP 57.A O no hydrogen 3.008 N/A THR 61.A OG1 TRP 57.A O no hydrogen 2.793 N/A ARG 62.A N ASP 58.A O no hydrogen 2.873 N/A ASN 63.A N GLN 59.A O no hydrogen 2.852 N/A VAL 64.A N GLU 60.A O no hydrogen 2.889 N/A LYS 65.A N THR 61.A O no hydrogen 2.966 N/A LYS 65.A NZ GLN 40.A O no hydrogen 3.211 N/A ALA 66.A N ARG 62.A O no hydrogen 2.966 N/A GLN 67.A N ASN 63.A O no hydrogen 3.389 N/A GLN 67.A NE2 GLN 67.A O no hydrogen 3.504 N/A GLN 67.A NE2 ASP 71.A OD1 no hydrogen 2.890 N/A SER 68.A N VAL 64.A O no hydrogen 3.187 N/A SER 68.A OG LYS 65.A O no hydrogen 2.639 N/A GLN 69.A N LYS 65.A O no hydrogen 2.971 N/A THR 70.A N ALA 66.A O no hydrogen 3.300 N/A ASP 71.A N GLN 67.A O no hydrogen 2.807 N/A ARG 72.A N SER 68.A O no hydrogen 2.770 N/A VAL 73.A N GLN 69.A O no hydrogen 3.114 N/A ASP 74.A N THR 70.A O no hydrogen 2.926 N/A LEU 75.A N ASP 71.A O no hydrogen 2.930 N/A GLY 76.A N ARG 72.A O no hydrogen 3.408 N/A THR 77.A N VAL 73.A O no hydrogen 2.958 N/A THR 77.A OG1 VAL 73.A O no hydrogen 3.252 N/A LEU 78.A N ASP 74.A O no hydrogen 2.812 N/A ARG 79.A N LEU 75.A O no hydrogen 3.010 N/A GLY 80.A N GLY 76.A O no hydrogen 3.154 N/A TYR 81.A N THR 77.A O no hydrogen 2.832 N/A TYR 82.A N LEU 78.A O no hydrogen 2.955 N/A ASN 83.A N GLY 80.A O no hydrogen 3.358 N/A GLN 84.A N ARG 79.A O no hydrogen 2.948 N/A GLN 84.A NE2 ASP 116.A OD2 no hydrogen 3.404 N/A SER 85.A OG ASP 87.A OD1 no hydrogen 2.633 N/A GLY 88.A N SER 85.A O no hydrogen 3.386 N/A SER 89.A OG SER 13.A O no hydrogen 2.287 N/A HIS 90.A N SER 13.A OG no hydrogen 2.717 N/A HIS 90.A ND1 ASP 116.A OD2 no hydrogen 2.759 N/A THR 91.A N ASP 116.A OD1 no hydrogen 3.034 N/A ILE 92.A N SER 11.A O no hydrogen 2.957 N/A GLN 93.A N ALA 114.A O no hydrogen 2.948 N/A ILE 94.A N TYR 9.A O no hydrogen 2.926 N/A MET 95.A N GLN 112.A O no hydrogen 2.998 N/A TYR 96.A N TYR 7.A O no hydrogen 3.098 N/A TYR 96.A OH TYR 9.A OH no hydrogen 2.755 N/A GLY 97.A N TYR 110.A O no hydrogen 3.112 N/A CYS 98.A N MET 5.A O no hydrogen 3.044 N/A ASP 99.A N ARG 108.A O no hydrogen 2.916 N/A VAL 100.A N HIS 3.A O no hydrogen 2.916 N/A GLY 101.A N ARG 105.A O no hydrogen 3.078 N/A GLY 104.A N GLY 101.A O no hydrogen 2.940 N/A ARG 105.A N ASP 103.A OD1 no hydrogen 3.190 N/A LEU 107.A N ASP 99.A O no hydrogen 2.673 N/A ARG 108.A NH1 ASP 99.A OD2 no hydrogen 2.910 N/A TYR 110.A N GLY 97.A O no hydrogen 2.859 N/A ARG 111.A NE ASP 113.A OD1 no hydrogen 2.747 N/A ARG 111.A NH1 GLN 153.A OE1 no hydrogen 3.027 N/A ARG 111.A NH2 ASP 113.A OD1 no hydrogen 3.301 N/A ARG 111.A NH2 ASP 113.A OD2 no hydrogen 2.906 N/A GLN 112.A N MET 95.A O no hydrogen 2.970 N/A ASP 113.A N ILE 121.A O no hydrogen 2.612 N/A ALA 114.A N GLN 93.A O no hydrogen 2.884 N/A TYR 115.A N LYS 118.A O no hydrogen 2.963 N/A TYR 115.A OH GLN 84.A OE1 no hydrogen 2.503 N/A ASP 116.A N THR 91.A O no hydrogen 2.829 N/A LYS 118.A N TYR 115.A O no hydrogen 3.052 N/A LYS 118.A NZ ASP 119.A O no hydrogen 2.929 N/A TYR 120.A N ASP 113.A O no hydrogen 2.804 N/A TYR 120.A OH THR 140.A OG1 no hydrogen 2.853 N/A ILE 121.A N ASP 113.A O no hydrogen 3.361 N/A ALA 122.A N THR 131.A O no hydrogen 2.969 N/A LEU 123.A N ARG 111.A O no hydrogen 2.694 N/A ASN 124.A N SER 129.A O no hydrogen 2.860 N/A ASN 124.A ND2 SER 129.A OG no hydrogen 2.751 N/A LEU 127.A N ASN 124.A O no hydrogen 2.805 N/A ARG 128.A N ASP 126.A OD1 no hydrogen 2.777 N/A SER 129.A N ASP 126.A OD1 no hydrogen 3.184 N/A SER 129.A OG ASP 126.A OD1 no hydrogen 3.364 N/A SER 129.A OG ASP 126.A OD2 no hydrogen 3.346 N/A THR 131.A N ALA 122.A O no hydrogen 2.891 N/A THR 131.A OG1 ASN 124.A OD1 no hydrogen 2.503 N/A ALA 133.A N TYR 120.A O no hydrogen 2.893 N/A ALA 136.A N TYR 82.A OH no hydrogen 3.159 N/A GLN 138.A N MET 135.A O.A no hydrogen 2.947 N/A GLN 138.A N MET 135.A O.B no hydrogen 2.999 N/A GLN 138.A NE2 ALA 133.A O no hydrogen 2.529 N/A THR 140.A N ALA 136.A O no hydrogen 3.107 N/A THR 140.A OG1 TYR 120.A OH no hydrogen 2.853 N/A LYS 141.A N ALA 137.A O no hydrogen 2.852 N/A LYS 141.A NZ TRP 130.A O no hydrogen 3.155 N/A ARG 142.A N.A GLN 138.A O no hydrogen 3.119 N/A ARG 142.A N.B GLN 138.A O no hydrogen 3.104 N/A LYS 143.A N ILE 139.A O no hydrogen 2.924 N/A TRP 144.A N THR 140.A O no hydrogen 2.733 N/A GLU 145.A N LYS 141.A O no hydrogen 2.917 N/A ALA 146.A N ARG 142.A O.A no hydrogen 3.088 N/A ALA 146.A N ARG 142.A O.B no hydrogen 3.145 N/A ALA 147.A N LYS 143.A O no hydrogen 2.899 N/A HIS 148.A N GLU 145.A O no hydrogen 3.285 N/A HIS 148.A ND1 GLU 151.A OE2 no hydrogen 3.284 N/A ALA 149.A N TRP 144.A O no hydrogen 3.009 N/A GLU 151.A N GLU 151.A OE1 no hydrogen 2.717 N/A GLN 153.A N ALA 149.A O no hydrogen 2.762 N/A GLN 153.A NE2 GLN 153.A O no hydrogen 3.462 N/A ARG 154.A N ALA 150.A O no hydrogen 2.725 N/A ARG 154.A NE GLU 158.A OE2 no hydrogen 2.895 N/A ARG 154.A NH2 GLU 158.A OE2 no hydrogen 3.505 N/A ALA 155.A N GLU 151.A O no hydrogen 3.006 N/A TYR 156.A N GLN 152.A O no hydrogen 3.258 N/A LEU 157.A N GLN 153.A O no hydrogen 3.017 N/A GLU 158.A N ARG 154.A O no hydrogen 2.888 N/A GLY 159.A N TYR 156.A O no hydrogen 3.164 N/A CYS 161.A N TYR 156.A O no hydrogen 2.911 N/A GLU 163.A N GLY 159.A O no hydrogen 2.913 N/A TRP 164.A N ARG 160.A O no hydrogen 2.874 N/A LEU 165.A N CYS 161.A O no hydrogen 2.940 N/A ARG 166.A N VAL 162.A O no hydrogen 2.986 N/A ARG 166.A NH1 GLY 104.A O no hydrogen 2.879 N/A ARG 167.A N GLU 163.A O no hydrogen 3.235 N/A ARG 167.A NE GLU 52.A OE2 no hydrogen 3.062 N/A ARG 167.A NH2 GLU 52.A OE1 no hydrogen 3.551 N/A TYR 168.A N TRP 164.A O no hydrogen 2.850 N/A LEU 169.A N LEU 165.A O no hydrogen 2.950 N/A GLU 170.A N ARG 166.A O no hydrogen 3.299 N/A ASN 171.A N ARG 167.A O no hydrogen 3.069 N/A GLY 172.A N TYR 168.A O no hydrogen 2.777 N/A LYS 173.A N GLU 170.A O no hydrogen 3.133 N/A THR 175.A N GLY 172.A O no hydrogen 3.105 N/A THR 175.A OG1 GLY 172.A O no hydrogen 3.227 N/A LEU 176.A N GLY 172.A O no hydrogen 2.718 N/A GLN 177.A N LYS 173.A O no hydrogen 3.075 N/A GLN 177.A NE2 LEU 169.A O no hydrogen 2.750 N/A ARG 178.A NE ASP 180.A OD2 no hydrogen 2.791 N/A ARG 178.A NH1 THR 175.A O no hydrogen 2.792 N/A ARG 178.A NH2 ASP 180.A OD2 no hydrogen 3.422 N/A ARG 178.A NH2 GLY 236.A O no hydrogen 3.106 N/A ASP 180.A N TYR 206.A O no hydrogen 3.036 N/A LYS 183.A N LEU 203.A O no hydrogen 2.811 N/A HIS 185.A N TRP 201.A O no hydrogen 3.365 N/A THR 187.A N ARG 199.A O no hydrogen 2.870 N/A THR 187.A OG1 HIS 189.A NE2 no hydrogen 2.803 N/A THR 187.A OG1 ARG 199.A O no hydrogen 3.518 N/A HIS 188.A NE2 GLU 251.A OE2 no hydrogen 3.036 N/A HIS 189.A N THR 197.A O no hydrogen 2.852 N/A HIS 189.A NE2 THR 187.A OG1 no hydrogen 2.803 N/A ILE 191.A N GLU 195.A O no hydrogen 3.240 N/A SER 192.A N GLU 195.A O no hydrogen 3.329 N/A ASP 193.A N ASP 193.A OD1 no hydrogen 2.548 N/A HIS 194.A N SER 192.A OG no hydrogen 3.141 N/A GLU 195.A N SER 192.A OG no hydrogen 3.126 N/A ALA 196.A N VAL 246.A O no hydrogen 2.977 N/A THR 197.A N HIS 189.A O no hydrogen 2.859 N/A LEU 198.A N VAL 244.A O no hydrogen 3.017 N/A ARG 199.A N THR 187.A O no hydrogen 3.058 N/A CYS 200.A N ALA 242.A O no hydrogen 2.777 N/A TRP 201.A N HIS 185.A O no hydrogen 2.822 N/A TRP 201.A NE1 THR 187.A OG1 no hydrogen 3.188 N/A ALA 202.A N LYS 240.A O no hydrogen 2.956 N/A LEU 203.A N LYS 183.A O no hydrogen 2.936 N/A PHE 205.A N PHE 238.A O no hydrogen 3.343 N/A TYR 206.A N ASP 180.A O no hydrogen 2.989 N/A TYR 206.A OH THR 28.A OG1 no hydrogen 2.762 N/A ALA 208.A N ASP 27.A OD2 no hydrogen 2.715 N/A THR 211.A N GLN 259.A O no hydrogen 3.056 N/A THR 213.A N HIS 257.A O no hydrogen 3.047 N/A GLN 215.A N THR 255.A O no hydrogen 2.798 N/A ARG 216.A N GLU 219.A O no hydrogen 2.751 N/A ARG 216.A NH1 GLU 250.A OE1 no hydrogen 3.142 N/A ARG 216.A NH1 TYR 254.A OH no hydrogen 2.960 N/A ASP 217.A N ARG 253.A O no hydrogen 2.884 N/A GLU 219.A N ARG 216.A O no hydrogen 2.900 N/A GLN 221.A N TRP 214.A O no hydrogen 3.023 N/A THR 225.A OG1 THR 222.A O no hydrogen 2.715 N/A GLU 226.A N ALA 243.A O no hydrogen 2.779 N/A VAL 228.A N TRP 241.A O no hydrogen 3.312 N/A ARG 231.A N GLN 239.A O no hydrogen 2.838 N/A ARG 231.A NE GLN 239.A OE1 no hydrogen 2.986 N/A ARG 231.A NH2 GLN 239.A OE1 no hydrogen 3.212 N/A ALA 233.A N THR 237.A O no hydrogen 2.894 N/A THR 237.A N ASP 235.A OD1 no hydrogen 2.988 N/A THR 237.A OG1 ASP 235.A OD1 no hydrogen 2.591 N/A PHE 238.A N PHE 205.A O no hydrogen 2.889 N/A GLN 239.A N ARG 231.A O no hydrogen 2.736 N/A LYS 240.A N ALA 202.A O no hydrogen 3.058 N/A LYS 240.A NZ VAL 228.A O no hydrogen 2.849 N/A LYS 240.A NZ THR 230.A OG1 no hydrogen 3.050 N/A ALA 242.A N CYS 200.A O no hydrogen 3.072 N/A ALA 243.A N GLU 226.A O no hydrogen 2.673 N/A VAL 244.A N LEU 198.A O no hydrogen 3.052 N/A VAL 245.A N ASP 224.A O no hydrogen 3.052 N/A VAL 246.A N ALA 196.A O no hydrogen 2.879 N/A SER 248.A N HIS 194.A O no hydrogen 2.865 N/A SER 248.A OG ASP 193.A O no hydrogen 3.555 N/A GLU 250.A N PRO 247.A O no hydrogen 3.042 N/A GLU 251.A N GLU 251.A OE1 no hydrogen 2.610 N/A GLN 252.A NE2 TRP 271.A O no hydrogen 3.158 N/A ARG 253.A N GLU 250.A O no hydrogen 3.129 N/A TYR 254.A N GLU 251.A O no hydrogen 3.156 N/A THR 255.A N GLN 215.A O no hydrogen 2.796 N/A THR 255.A OG1 HIS 257.A NE2 no hydrogen 2.827 N/A CYS 256.A N LEU 269.A O no hydrogen 2.861 N/A HIS 257.A N THR 213.A O no hydrogen 2.793 N/A HIS 257.A NE2 THR 255.A OG1 no hydrogen 2.827 N/A VAL 258.A N LEU 267.A O no hydrogen 3.052 N/A GLN 259.A N THR 211.A O no hydrogen 2.879 N/A HIS 260.A NE2 PRO 207.A O no hydrogen 3.000 N/A GLY 262.A N HIS 260.A ND1 no hydrogen 2.899 N/A LEU 263.A N HIS 260.A O no hydrogen 3.028 N/A LEU 267.A N VAL 258.A O no hydrogen 3.069 N/A LEU 269.A N CYS 256.A O no hydrogen 2.765 N/A ARG 270.A NH1 GLN 252.A O no hydrogen 2.908 N/A