Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pbq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N THR 65.A O no hydrogen 2.978 N/A LYS 3.A N ASP 103.A OD2 no hydrogen 3.094 N/A ILE 4.A N GLU 67.A O no hydrogen 2.826 N/A VAL 5.A N MET 104.A O no hydrogen 3.055 N/A THR 6.A N HIS 69.A O no hydrogen 3.090 N/A THR 6.A OG1 VAL 106.A O no hydrogen 2.841 N/A ILE 7.A N THR 6.A OG1 no hydrogen 2.766 N/A HIS 8.A NE2 GLU 10.A OE2 no hydrogen 3.092 N/A GLN 9.A N VAL 13.A O no hydrogen 2.974 N/A GLN 9.A NE2 GLU 10.A O no hydrogen 3.066 N/A PHE 12.A N GLN 9.A O no hydrogen 2.873 N/A VAL 13.A N GLN 9.A O no hydrogen 2.973 N/A TYR 14.A N TYR 48.A O no hydrogen 2.710 N/A LYS 16.A N CYS 46.A O no hydrogen 2.873 N/A MET 19.A N THR 23.A O no hydrogen 2.783 N/A GLY 22.A N MET 19.A O no hydrogen 2.871 N/A THR 23.A N ASP 21.A OD1 no hydrogen 3.203 N/A THR 23.A OG1 ASP 21.A OD1 no hydrogen 2.918 N/A THR 23.A OG1 ASP 21.A OD2 no hydrogen 3.467 N/A THR 29.A N ASP 33.A O no hydrogen 2.810 N/A THR 29.A OG1 ASP 33.A O no hydrogen 3.555 N/A GLY 32.A N THR 29.A O no hydrogen 2.656 N/A ASP 33.A N THR 29.A OG1 no hydrogen 3.229 N/A VAL 35.A N GLU 27.A O no hydrogen 2.968 N/A LYS 37.A NZ LYS 25.A O no hydrogen 2.901 N/A LYS 37.A NZ GLU 27.A OE2 no hydrogen 2.642 N/A VAL 38.A N CYS 47.A O no hydrogen 3.027 N/A CYS 40.A N GLN 45.A O no hydrogen 2.794 N/A CYS 40.A SG GLN 45.A O no hydrogen 3.662 N/A THR 41.A N VAL 68.A O no hydrogen 3.129 N/A GLN 45.A N CYS 40.A O no hydrogen 2.870 N/A GLN 45.A NE2 VAL 43.A O no hydrogen 3.426 N/A CYS 46.A N LYS 16.A O no hydrogen 2.765 N/A CYS 46.A SG PRO 17.A O no hydrogen 3.931 N/A CYS 47.A N VAL 38.A O no hydrogen 2.897 N/A CYS 47.A SG TYR 14.A O no hydrogen 3.921 N/A TYR 48.A N TYR 14.A O no hydrogen 3.353 N/A PHE 50.A N PRO 11.A O no hydrogen 3.386 N/A CYS 51.A N PHE 12.A O no hydrogen 3.003 N/A ASP 53.A N GLY 49.A O no hydrogen 2.931 N/A LEU 54.A N PHE 50.A O no hydrogen 3.104 N/A LEU 55.A N CYS 51.A O no hydrogen 2.832 N/A ILE 56.A N ILE 52.A O no hydrogen 3.006 N/A LYS 57.A N ASP 53.A O no hydrogen 3.071 N/A LEU 58.A N LEU 54.A O no hydrogen 2.882 N/A ALA 59.A N LEU 55.A O no hydrogen 2.709 N/A ARG 60.A N ILE 56.A O no hydrogen 2.901 N/A THR 61.A N LYS 57.A O no hydrogen 2.922 N/A THR 61.A OG1 LYS 57.A O no hydrogen 2.867 N/A THR 61.A OG1 LEU 58.A O no hydrogen 3.341 N/A THR 61.A OG1 SER 251.A OG no hydrogen 3.382 N/A MET 62.A N LEU 58.A O no hydrogen 2.753 N/A ASN 63.A N ARG 60.A O no hydrogen 3.286 N/A PHE 64.A N ALA 59.A O no hydrogen 3.073 N/A GLU 67.A N LEU 2.A O no hydrogen 3.004 N/A HIS 69.A N ILE 4.A O no hydrogen 2.979 N/A LEU 70.A N THR 41.A O no hydrogen 2.687 N/A VAL 71.A N THR 6.A O no hydrogen 3.039 N/A ALA 72.A N GLU 96.A OE2 no hydrogen 2.880 N/A GLY 74.A N VAL 71.A O no hydrogen 3.228 N/A LYS 75.A N ASP 73.A OD1 no hydrogen 2.952 N/A THR 78.A OG1 GLU 80.A OE2 no hydrogen 2.706 N/A GLN 79.A NE2 TYR 118.A OH no hydrogen 3.415 N/A GLU 80.A N GLU 89.A O no hydrogen 3.093 N/A VAL 82.A N LYS 87.A O no hydrogen 2.837 N/A SER 85.A N VAL 82.A O no hydrogen 2.823 N/A SER 85.A OG VAL 82.A O no hydrogen 2.777 N/A LYS 87.A N SER 85.A OG no hydrogen 3.011 N/A GLU 89.A N GLU 80.A O no hydrogen 2.786 N/A ASN 91.A N THR 78.A O no hydrogen 3.066 N/A GLY 92.A N ASP 73.A OD2 no hydrogen 2.787 N/A MET 93.A N LYS 75.A O no hydrogen 3.053 N/A MET 94.A N PHE 76.A O no hydrogen 3.248 N/A GLY 95.A N ASN 91.A O no hydrogen 2.925 N/A GLU 96.A N GLY 92.A O no hydrogen 3.212 N/A LEU 97.A N MET 93.A O no hydrogen 3.006 N/A LEU 98.A N MET 94.A O no hydrogen 3.117 N/A SER 99.A N GLY 95.A O no hydrogen 3.020 N/A SER 99.A OG GLY 95.A O no hydrogen 3.288 N/A SER 99.A OG GLU 96.A O no hydrogen 3.144 N/A GLN 101.A NE2 SER 99.A OG no hydrogen 2.603 N/A ALA 102.A N GLU 96.A O no hydrogen 3.156 N/A ASP 103.A N LYS 3.A O no hydrogen 2.798 N/A ILE 105.A N GLY 237.A O no hydrogen 2.727 N/A VAL 106.A N VAL 5.A O no hydrogen 3.110 N/A LEU 109.A N ALA 107.A O no hydrogen 2.764 N/A ILE 111.A N GLY 233.A O no hydrogen 2.893 N/A ARG 115.A NE GLY 77.A O no hydrogen 3.367 N/A ARG 115.A NH1 THR 110.A O no hydrogen 2.941 N/A ARG 115.A NH2 GLY 77.A O no hydrogen 2.766 N/A ALA 116.A N ASN 112.A O no hydrogen 2.958 N/A GLN 117.A N ASN 113.A O no hydrogen 3.194 N/A GLN 117.A N GLU 114.A O no hydrogen 3.373 N/A GLN 117.A NE2 ASN 113.A O no hydrogen 3.552 N/A TYR 118.A N ARG 115.A O no hydrogen 2.906 N/A ILE 119.A N ARG 115.A O no hydrogen 3.015 N/A GLU 120.A N MET 238.A O no hydrogen 2.748 N/A SER 122.A N ILE 236.A O no hydrogen 3.117 N/A SER 122.A OG LYS 123.A O no hydrogen 3.017 N/A LYS 123.A N SER 249.A OG no hydrogen 2.948 N/A PHE 125.A N PHE 234.A O no hydrogen 2.910 N/A GLN 128.A N SER 232.A O no hydrogen 2.736 N/A GLN 128.A NE2 PHE 230.A O no hydrogen 3.687 N/A LEU 130.A N PHE 229.A O no hydrogen 2.904 N/A THR 131.A N TRP 207.A O no hydrogen 3.105 N/A THR 131.A OG1 THR 225.A O no hydrogen 3.470 N/A ILE 132.A N THR 131.A OG1 no hydrogen 2.796 N/A LEU 133.A N PHE 205.A O no hydrogen 2.894 N/A VAL 134.A N VAL 223.A O no hydrogen 3.029 N/A LYS 135.A NZ ARG 198.A O no hydrogen 3.067 N/A LYS 136.A N ASP 221.A O no hydrogen 2.798 N/A THR 138.A N LYS 135.A O no hydrogen 3.052 N/A THR 138.A OG1 LYS 135.A O no hydrogen 3.285 N/A THR 141.A N ASP 145.A OD2 no hydrogen 2.945 N/A ASP 145.A N GLY 142.A O no hydrogen 3.132 N/A ARG 147.A N ASP 145.A OD1 no hydrogen 2.867 N/A ARG 147.A NH2 ARG 139.A O no hydrogen 2.883 N/A LEU 148.A N ASP 145.A O no hydrogen 2.905 N/A ARG 149.A N ASP 145.A O no hydrogen 2.974 N/A ASN 150.A N PRO 146.A O no hydrogen 2.846 N/A LYS 154.A N SER 152.A OG no hydrogen 3.093 N/A PHE 155.A N SER 152.A O no hydrogen 3.225 N/A ILE 156.A N HIS 203.A ND1 no hydrogen 2.721 N/A ALA 158.A N ALA 204.A O no hydrogen 3.025 N/A THR 159.A OG1 ILE 206.A O no hydrogen 3.018 N/A LYS 161.A N TYR 187.A O no hydrogen 2.836 N/A GLN 162.A N ASP 166.A OD2 no hydrogen 2.745 N/A SER 163.A N VAL 160.A O no hydrogen 3.129 N/A SER 163.A OG VAL 160.A O no hydrogen 2.494 N/A ASP 166.A N SER 163.A OG no hydrogen 3.202 N/A ILE 167.A N SER 163.A O no hydrogen 2.907 N/A TYR 168.A N SER 164.A O no hydrogen 2.989 N/A PHE 169.A N VAL 165.A O no hydrogen 2.937 N/A ARG 170.A N ASP 166.A O no hydrogen 2.990 N/A ARG 170.A NE TYR 179.A OH no hydrogen 3.131 N/A ARG 170.A NH2 ASP 166.A OD2 no hydrogen 3.211 N/A ARG 171.A N ILE 167.A O no hydrogen 3.175 N/A ARG 171.A N TYR 168.A O no hydrogen 3.295 N/A LEU 175.A N GLN 172.A O no hydrogen 2.985 N/A SER 176.A N VAL 173.A O no hydrogen 3.211 N/A TYR 179.A N LEU 175.A O no hydrogen 2.860 N/A ARG 180.A N SER 176.A O no hydrogen 3.070 N/A MET 182.A N MET 178.A O no hydrogen 2.926 N/A GLU 183.A N TYR 179.A O no hydrogen 2.864 N/A LYS 184.A N HIS 181.A O no hydrogen 3.107 N/A HIS 185.A N MET 182.A O no hydrogen 2.751 N/A HIS 185.A ND1 HIS 181.A O no hydrogen 3.035 N/A ASN 186.A N MET 182.A O no hydrogen 2.805 N/A TYR 187.A N THR 159.A O no hydrogen 2.929 N/A SER 189.A OG GLU 192.A OE1 no hydrogen 2.662 N/A GLU 192.A N SER 189.A OG no hydrogen 3.233 N/A ALA 193.A N SER 189.A O no hydrogen 3.161 N/A ILE 194.A N ALA 190.A O no hydrogen 2.861 N/A GLN 195.A N ALA 191.A O no hydrogen 3.023 N/A GLN 195.A NE2 ASP 199.A OD1 no hydrogen 3.235 N/A GLN 195.A NE2 ASP 199.A OD2 no hydrogen 3.123 N/A ALA 196.A N GLU 192.A O no hydrogen 2.931 N/A VAL 197.A N ALA 193.A O no hydrogen 3.081 N/A VAL 197.A N ILE 194.A O no hydrogen 3.160 N/A ARG 198.A N ILE 194.A O no hydrogen 3.179 N/A ARG 198.A NE ASP 221.A OD1 no hydrogen 3.220 N/A ARG 198.A NE ASP 221.A OD2 no hydrogen 3.047 N/A ARG 198.A NH2 ASP 221.A OD1 no hydrogen 2.909 N/A ASP 199.A N GLN 195.A O no hydrogen 2.869 N/A ASN 200.A N VAL 197.A O no hydrogen 3.103 N/A LYS 201.A N ALA 196.A O no hydrogen 2.781 N/A LEU 202.A N ALA 196.A O no hydrogen 3.085 N/A HIS 203.A N ILE 156.A O no hydrogen 2.928 N/A ALA 204.A N ILE 156.A O no hydrogen 3.131 N/A PHE 205.A N LEU 133.A O no hydrogen 2.947 N/A ILE 206.A N ALA 158.A O no hydrogen 2.989 N/A TRP 207.A N THR 131.A O no hydrogen 3.304 N/A SER 209.A N GLY 129.A O no hydrogen 2.921 N/A SER 209.A OG GLY 129.A O no hydrogen 3.278 N/A VAL 211.A N ASP 208.A OD1 no hydrogen 2.906 N/A LEU 212.A N ASP 208.A O no hydrogen 3.060 N/A GLU 213.A N SER 209.A O no hydrogen 2.944 N/A PHE 214.A N ALA 210.A O no hydrogen 2.922 N/A GLU 215.A N VAL 211.A O no hydrogen 2.939 N/A ALA 216.A N LEU 212.A O no hydrogen 2.870 N/A SER 217.A N GLU 213.A O no hydrogen 2.922 N/A SER 217.A OG GLU 213.A O no hydrogen 3.443 N/A SER 217.A OG PHE 214.A O no hydrogen 2.679 N/A SER 217.A OG VAL 269.A O no hydrogen 3.142 N/A GLN 218.A N GLU 215.A O no hydrogen 3.206 N/A LYS 219.A N GLU 215.A O no hydrogen 3.021 N/A LYS 219.A NZ GLU 215.A OE1 no hydrogen 2.831 N/A LEU 222.A N LYS 219.A O no hydrogen 2.999 N/A VAL 223.A N VAL 134.A O no hydrogen 3.073 N/A THR 225.A N ILE 132.A O no hydrogen 2.893 N/A THR 225.A OG1 ILE 140.A O no hydrogen 2.478 N/A PHE 229.A N LEU 130.A O no hydrogen 3.023 N/A SER 232.A N GLN 128.A O no hydrogen 2.911 N/A SER 232.A OG ILE 111.A O no hydrogen 2.783 N/A PHE 234.A N LYS 126.A O no hydrogen 2.828 N/A GLY 235.A N LEU 109.A O no hydrogen 3.236 N/A ILE 236.A N SER 122.A OG no hydrogen 2.960 N/A GLY 237.A N ILE 105.A O no hydrogen 3.020 N/A MET 238.A N GLU 120.A O no hydrogen 3.044 N/A ARG 239.A NH1 LEU 97.A O no hydrogen 2.864 N/A ARG 239.A NH1 ALA 102.A O no hydrogen 2.780 N/A ARG 239.A NH2 ASP 103.A OD1 no hydrogen 2.803 N/A LYS 240.A NZ ALA 116.A O no hydrogen 2.779 N/A LYS 240.A NZ ILE 119.A O no hydrogen 3.051 N/A SER 242.A N ARG 239.A O no hydrogen 3.123 N/A TRP 244.A N SER 242.A OG no hydrogen 3.264 N/A VAL 248.A N TRP 244.A O no hydrogen 2.810 N/A SER 249.A N LYS 245.A O no hydrogen 3.372 N/A LEU 250.A N GLN 246.A O no hydrogen 3.003 N/A SER 251.A N ASN 247.A O no hydrogen 3.149 N/A SER 251.A OG THR 61.A OG1 no hydrogen 3.382 N/A ILE 252.A N VAL 248.A O no hydrogen 3.040 N/A LEU 253.A N SER 249.A O no hydrogen 2.914 N/A LYS 254.A N LEU 250.A O no hydrogen 3.179 N/A SER 255.A N SER 251.A O no hydrogen 2.972 N/A SER 255.A OG SER 251.A O no hydrogen 3.240 N/A HIS 256.A N ILE 252.A O no hydrogen 3.003 N/A HIS 256.A N LEU 253.A O no hydrogen 3.158 N/A HIS 256.A NE2 PRO 124.A O no hydrogen 2.875 N/A GLU 257.A N LEU 253.A O no hydrogen 2.991 N/A ASN 258.A N LYS 254.A O no hydrogen 2.937 N/A GLY 259.A N HIS 256.A O no hydrogen 3.289 N/A MET 261.A N SER 255.A O no hydrogen 3.044 N/A ASP 263.A N GLY 259.A O no hydrogen 2.943 N/A LEU 264.A N PHE 260.A O no hydrogen 3.040 N/A ASP 265.A N MET 261.A O no hydrogen 3.197 N/A LYS 266.A N GLU 262.A O no hydrogen 2.972 N/A THR 267.A N ASP 263.A O no hydrogen 2.937 N/A THR 267.A OG1 ASP 263.A O no hydrogen 3.018 N/A TRP 268.A N LEU 264.A O no hydrogen 2.843 N/A TRP 268.A NE1 ASP 53.A OD2 no hydrogen 2.874 N/A VAL 269.A N ASP 265.A O no hydrogen 2.836 N/A ARG 270.A N ASP 265.A O no hydrogen 2.888 N/A ARG 270.A NE GLU 213.A OE1 no hydrogen 3.335 N/A ARG 270.A NH2 GLU 213.A OE1 no hydrogen 3.050 N/A ARG 270.A NH2 GLU 213.A OE2 no hydrogen 3.391 N/A TYR 271.A N VAL 269.A O no hydrogen 3.187 N/A