Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8sko_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N PHE 11.A O no hydrogen 2.806 N/A PHE 6.A N LEU 9.A O no hydrogen 2.934 N/A LEU 9.A N PHE 6.A O no hydrogen 2.972 N/A VAL 10.A N THR 22.A O no hydrogen 3.077 N/A PHE 11.A N GLN 4.A O no hydrogen 2.812 N/A ARG 12.A N GLN 20.A O no hydrogen 3.003 N/A ARG 12.A NE ASP 3.A OD2 no hydrogen 2.854 N/A ARG 12.A NH2 ASP 3.A OD1 no hydrogen 3.502 N/A ARG 12.A NH2 ASP 3.A OD2 no hydrogen 3.077 N/A GLN 13.A NE2.B ALA 15.A O no hydrogen 3.106 N/A GLN 13.A NE2.B PRO 16.A O no hydrogen 3.153 N/A LEU 14.A N VAL 18.A O no hydrogen 2.844 N/A ALA 15.A N VAL 18.A O no hydrogen 3.275 N/A ASN 17.A ND2 ARG 41.A O no hydrogen 3.028 N/A VAL 18.A N ALA 15.A O no hydrogen 3.117 N/A TRP 19.A N ILE 39.A O no hydrogen 2.830 N/A TRP 19.A NE1 GLN 13.A OE1.A no hydrogen 3.140 N/A GLN 20.A N ARG 12.A O no hydrogen 2.763 N/A HIS 21.A N GLY 37.A O no hydrogen 2.917 N/A HIS 21.A NE2 VAL 49.A O no hydrogen 3.207 N/A HIS 21.A NE2 ASP 50.A O no hydrogen 2.898 N/A THR 22.A N VAL 10.A O no hydrogen 2.863 N/A THR 22.A OG1 ASN 36.A OD1 no hydrogen 2.696 N/A SER 23.A N SER 35.A O no hydrogen 3.031 N/A LEU 25.A N.A VAL 33.A O no hydrogen 3.109 N/A LEU 25.A N.B VAL 33.A O no hydrogen 3.105 N/A MET 27.A N.A GLY 31.A O.A no hydrogen 2.712 N/A MET 27.A N.A GLY 31.A O.B no hydrogen 3.141 N/A MET 27.A N.B GLY 31.A O.A no hydrogen 2.584 N/A MET 27.A N.B GLY 31.A O.B no hydrogen 3.185 N/A PHE 30.A N.A MET 27.A O.A no hydrogen 3.107 N/A PHE 30.A N.B MET 27.A O.B no hydrogen 2.924 N/A GLY 31.A N.A MET 27.A O.A no hydrogen 3.041 N/A GLY 31.A N.A MET 27.A O.B no hydrogen 3.280 N/A GLY 31.A N.B MET 27.A O.A no hydrogen 3.095 N/A GLY 31.A N.B MET 27.A O.B no hydrogen 2.959 N/A VAL 33.A N LEU 25.A O.A no hydrogen 2.959 N/A VAL 33.A N LEU 25.A O.B no hydrogen 2.824 N/A SER 35.A N SER 23.A O no hydrogen 2.817 N/A ASN 36.A N SER 209.A O no hydrogen 2.788 N/A ASN 36.A ND2 MET 208.A O no hydrogen 2.935 N/A GLY 37.A N HIS 21.A O no hydrogen 2.890 N/A LEU 38.A N VAL 49.A O no hydrogen 2.985 N/A ILE 39.A N TRP 19.A O no hydrogen 2.787 N/A VAL 40.A N LEU 47.A O no hydrogen 2.868 N/A ARG 41.A N ASN 17.A O no hydrogen 2.890 N/A ARG 41.A NH1 GLY 43.A O no hydrogen 2.951 N/A ASP 42.A N ARG 45.A O no hydrogen 2.860 N/A ARG 45.A N ASP 42.A O no hydrogen 3.179 N/A ARG 45.A NE ASP 42.A OD2 no hydrogen 3.034 N/A ARG 45.A NH1 ASN 136.A O no hydrogen 2.969 N/A ARG 45.A NH2 ASP 42.A OD2 no hydrogen 2.715 N/A ARG 45.A NH2 ASN 136.A O no hydrogen 2.879 N/A VAL 46.A N PRO 72.A O no hydrogen 2.852 N/A LEU 47.A N VAL 40.A O no hydrogen 2.765 N/A VAL 48.A N LEU 75.A O no hydrogen 3.098 N/A VAL 49.A N LEU 38.A O no hydrogen 2.824 N/A ASP 50.A N VAL 77.A O no hydrogen 2.870 N/A THR 51.A N LYS 85.A O no hydrogen 2.951 N/A THR 51.A OG1 ALA 52.A O no hydrogen 2.719 N/A ALA 52.A N THR 58.A OG1 no hydrogen 3.077 N/A TRP 53.A NE1 SER 23.A O no hydrogen 3.128 N/A THR 54.A N GLN 57.A OE1 no hydrogen 3.260 N/A GLN 57.A N THR 54.A OG1 no hydrogen 3.040 N/A GLN 57.A NE2 TYR 24.A O no hydrogen 2.912 N/A THR 58.A N THR 54.A O no hydrogen 2.939 N/A THR 58.A OG1 THR 54.A O no hydrogen 2.797 N/A ALA 59.A N ASP 55.A O no hydrogen 2.850 N/A GLN 60.A N ASP 56.A O no hydrogen 3.057 N/A ILE 61.A N GLN 57.A O no hydrogen 3.005 N/A LEU 62.A N THR 58.A O no hydrogen 3.071 N/A ASN 63.A N ALA 59.A O no hydrogen 2.886 N/A ASN 63.A ND2 GLN 60.A OE1 no hydrogen 2.888 N/A TRP 64.A N GLN 60.A O no hydrogen 2.917 N/A TRP 64.A NE1 GLN 4.A OE1 no hydrogen 2.849 N/A ILE 65.A N ILE 61.A O no hydrogen 2.919 N/A LYS 66.A N LEU 62.A O no hydrogen 2.945 N/A GLN 67.A N ASN 63.A O no hydrogen 3.014 N/A GLN 67.A NE2 GLU 68.A OE2 no hydrogen 2.800 N/A GLU 68.A N TRP 64.A O no hydrogen 2.834 N/A ILE 69.A N ILE 65.A O no hydrogen 2.802 N/A ASN 70.A N ILE 65.A O no hydrogen 2.808 N/A ALA 74.A N VAL 46.A O no hydrogen 2.818 N/A ALA 76.A N ALA 98.A O no hydrogen 2.976 N/A VAL 77.A N VAL 48.A O no hydrogen 2.873 N/A VAL 78.A N TYR 100.A O no hydrogen 2.992 N/A THR 79.A N ASP 50.A OD1 no hydrogen 2.842 N/A THR 79.A OG1 ASP 50.A OD1 no hydrogen 2.950 N/A THR 79.A OG1 ASP 50.A OD2 no hydrogen 3.064 N/A HIS 80.A NE2 HIS 82.A ND1 no hydrogen 3.077 N/A ALA 81.A N ASP 152.A OD2 no hydrogen 2.969 N/A HIS 82.A NE2 ASP 183.A OD2 no hydrogen 2.745 N/A GLN 83.A NE2 TRP 53.A O no hydrogen 3.398 N/A LYS 85.A N HIS 82.A O no hydrogen 3.070 N/A LYS 85.A NZ ASP 50.A OD2 no hydrogen 2.742 N/A LYS 85.A NZ SER 209.A OG no hydrogen 2.948 N/A MET 86.A N HIS 82.A O no hydrogen 2.916 N/A GLY 87.A N GLN 83.A O no hydrogen 2.813 N/A GLY 88.A N THR 51.A OG1 no hydrogen 2.964 N/A MET 89.A N MET 86.A O no hydrogen 3.454 N/A ALA 91.A N ASP 55.A OD1 no hydrogen 3.398 N/A LEU 92.A N GLY 88.A O no hydrogen 3.329 N/A HIS 93.A N MET 89.A O no hydrogen 2.960 N/A HIS 93.A NE2 THR 99.A OG1 no hydrogen 2.720 N/A ALA 94.A N ASP 90.A O no hydrogen 2.807 N/A ALA 95.A N ALA 91.A O no hydrogen 3.221 N/A ALA 95.A N LEU 92.A O no hydrogen 3.092 N/A GLY 96.A N HIS 93.A O no hydrogen 2.942 N/A ILE 97.A N LEU 92.A O no hydrogen 3.040 N/A THR 99.A N GLN 118.A OE1 no hydrogen 3.288 N/A THR 99.A OG1 HIS 93.A NE2 no hydrogen 2.720 N/A TYR 100.A N ALA 76.A O no hydrogen 2.960 N/A ALA 101.A N HIS 119.A O no hydrogen 3.103 N/A ASN 102.A ND2 ASP 152.A O no hydrogen 3.038 N/A ALA 103.A N LEU 121.A O no hydrogen 3.005 N/A LEU 104.A N ASN 102.A OD1 no hydrogen 3.327 N/A SER 105.A OG ASP 152.A OD2 no hydrogen 2.556 N/A ASN 106.A N ASN 102.A O no hydrogen 3.140 N/A ASN 106.A ND2 HIS 119.A O no hydrogen 3.154 N/A ASN 106.A ND2 SER 120.A OG no hydrogen 2.887 N/A GLN 107.A N ALA 103.A O no hydrogen 2.979 N/A LEU 108.A N LEU 104.A O no hydrogen 2.934 N/A GLU 112.A N LEU 108.A O no hydrogen 3.185 N/A GLY 113.A N PRO 110.A O no hydrogen 2.915 N/A LEU 114.A N ALA 109.A O no hydrogen 2.909 N/A ALA 117.A N ASN 106.A OD1 no hydrogen 2.839 N/A GLN 118.A N THR 99.A OG1 no hydrogen 2.893 N/A LEU 121.A N ALA 101.A O no hydrogen 2.743 N/A ALA 124.A N TRP 128.A O no hydrogen 2.895 N/A GLY 127.A N ALA 124.A O no hydrogen 2.975 N/A TRP 128.A N ASN 126.A OD1 no hydrogen 3.036 N/A VAL 129.A N VAL 142.A O no hydrogen 3.022 N/A GLU 130.A N THR 122.A O no hydrogen 2.827 N/A THR 133.A N GLU 130.A O no hydrogen 2.897 N/A THR 133.A OG1 GLU 130.A O no hydrogen 2.846 N/A ALA 134.A N PRO 131.A O no hydrogen 3.047 N/A LEU 140.A N PHE 137.A O no hydrogen 2.953 N/A LYS 141.A N GLY 157.A O no hydrogen 2.854 N/A PHE 143.A N THR 155.A O no hydrogen 2.907 N/A TYR 144.A N GLY 127.A O no hydrogen 2.755 N/A TYR 144.A OH SER 151.A O no hydrogen 2.851 N/A GLY 148.A N THR 150.A O no hydrogen 2.955 N/A THR 150.A N ASN 153.A OD1 no hydrogen 3.111 N/A THR 150.A OG1 ASP 152.A OD1 no hydrogen 2.684 N/A ASN 153.A ND2 GLY 146.A O no hydrogen 2.944 N/A ASN 153.A ND2 ASN 153.A O no hydrogen 2.726 N/A ILE 154.A N THR 79.A O no hydrogen 3.043 N/A THR 155.A N PHE 143.A O no hydrogen 2.873 N/A THR 155.A OG1 PHE 143.A O no hydrogen 2.871 N/A VAL 156.A N PHE 165.A O no hydrogen 3.024 N/A GLY 157.A N LYS 141.A O no hydrogen 2.860 N/A ILE 158.A N ILE 163.A O no hydrogen 3.204 N/A ASP 159.A N PRO 139.A O no hydrogen 2.851 N/A THR 161.A N ILE 158.A O no hydrogen 3.202 N/A THR 161.A OG1 ILE 158.A O no hydrogen 2.793 N/A ILE 163.A N THR 161.A OG1 no hydrogen 3.034 N/A ALA 164.A N MET 205.A O no hydrogen 3.099 N/A PHE 165.A N VAL 156.A O no hydrogen 2.790 N/A GLY 166.A N VAL 207.A O no hydrogen 2.782 N/A CYS 168.A SG ASP 84.A OD2 no hydrogen 3.346 N/A CYS 168.A SG SER 209.A OG no hydrogen 3.049 N/A CYS 168.A SG HIS 210.A NE2 no hydrogen 3.462 N/A LEU 169.A N GLY 166.A O no hydrogen 3.086 N/A LYS 171.A N THR 222.A OG1 no hydrogen 2.915 N/A LYS 171.A NZ CYS 168.A O no hydrogen 2.875 N/A SER 173.A N ASP 214.A OD2 no hydrogen 2.755 N/A SER 173.A OG ASP 214.A OD2 no hydrogen 2.747 N/A LYS 174.A N ASP 172.A OD1.A no hydrogen 2.807 N/A LYS 174.A N ASP 172.A OD1.B no hydrogen 3.271 N/A ALA 175.A N ASP 172.A O no hydrogen 3.057 N/A GLY 179.A N SER 177.A OG no hydrogen 3.025 N/A GLY 182.A N ASN 180.A OD1 no hydrogen 2.569 N/A ALA 184.A N LEU 181.A O no hydrogen 2.934 N/A ASP 185.A N GLY 148.A O no hydrogen 2.826 N/A HIS 188.A N ASP 185.A O no hydrogen 3.247 N/A HIS 188.A N ASP 185.A OD1 no hydrogen 3.066 N/A HIS 188.A ND1 ASP 185.A OD1 no hydrogen 2.913 N/A HIS 188.A ND1 ASP 185.A OD2 no hydrogen 2.879 N/A TYR 189.A OH LEU 169.A O no hydrogen 2.698 N/A SER 192.A N HIS 188.A O no hydrogen 3.014 N/A SER 192.A OG PRO 145.A O no hydrogen 3.296 N/A SER 192.A OG PRO 147.A O no hydrogen 2.736 N/A SER 192.A OG HIS 188.A O no hydrogen 3.126 N/A ALA 193.A N TYR 189.A O no hydrogen 2.936 N/A ARG 194.A N ALA 190.A O no hydrogen 2.997 N/A ARG 194.A NH1 ASP 227.A OD1 no hydrogen 2.775 N/A ARG 194.A NH2 ASP 227.A OD2 no hydrogen 2.981 N/A ALA 195.A N ALA 191.A O no hydrogen 2.756 N/A PHE 196.A N SER 192.A O no hydrogen 2.935 N/A GLY 197.A N ALA 193.A O no hydrogen 3.226 N/A ALA 198.A N ARG 194.A O no hydrogen 2.912 N/A ALA 199.A N ALA 195.A O no hydrogen 2.900 N/A ALA 199.A N PHE 196.A O no hydrogen 3.146 N/A PHE 200.A N PHE 196.A O no hydrogen 3.266 N/A ALA 203.A N PHE 200.A O no hydrogen 3.189 N/A SER 204.A N ASP 162.A O no hydrogen 2.984 N/A MET 205.A N ASP 162.A O no hydrogen 3.007 N/A ILE 206.A N ASP 214.A O no hydrogen 2.813 N/A VAL 207.A N ALA 164.A O no hydrogen 2.855 N/A SER 209.A N GLY 167.A O no hydrogen 2.973 N/A HIS 210.A ND1 ALA 34.A O no hydrogen 2.784 N/A SER 211.A OG ASP 172.A OD2.A no hydrogen 2.595 N/A ASP 214.A N ILE 206.A O no hydrogen 2.945 N/A SER 215.A N ASP 214.A OD1 no hydrogen 2.877 N/A ARG 216.A NH1 PHE 200.A O no hydrogen 2.742 N/A ARG 216.A NH1 ALA 203.A O no hydrogen 2.980 N/A ARG 216.A NH2 GLY 197.A O no hydrogen 2.763 N/A ALA 217.A N SER 215.A OG no hydrogen 3.000 N/A ALA 218.A N SER 215.A O no hydrogen 3.026 N/A ILE 219.A N ARG 216.A O no hydrogen 2.857 N/A THR 220.A N ARG 216.A O no hydrogen 3.278 N/A THR 220.A OG1 ALA 217.A O no hydrogen 3.200 N/A HIS 221.A N ALA 217.A O no hydrogen 2.871 N/A HIS 221.A NE2 ALA 175.A O no hydrogen 2.750 N/A THR 222.A N ALA 218.A O no hydrogen 2.882 N/A THR 222.A OG1 LYS 171.A O no hydrogen 2.903 N/A THR 222.A OG1 ALA 218.A O no hydrogen 2.845 N/A ALA 223.A N ILE 219.A O no hydrogen 2.902 N/A ARG 224.A N THR 220.A O no hydrogen 2.888 N/A ARG 224.A NH2.B ASP 227.A OD2 no hydrogen 2.965 N/A MET 225.A N HIS 221.A O no hydrogen 2.976 N/A ALA 226.A N THR 222.A O no hydrogen 2.911 N/A ASP 227.A N ALA 223.A O no hydrogen 2.834 N/A LYS 228.A N MET 225.A O no hydrogen 3.245 N/A LEU 229.A N ALA 226.A O no hydrogen 3.086 N/A ARG 230.A N ASP 227.A O no hydrogen 3.480 N/A ARG 230.A NE GLU 187.A O no hydrogen 2.978 N/A ARG 230.A NE GLU 187.A OE1 no hydrogen 3.401 N/A ARG 230.A NH2 GLU 187.A OE1 no hydrogen 2.934 N/A