Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wta_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 PRO 5.A O no hydrogen 2.658 N/A ARG 4.A N LYS 33.A O no hydrogen 2.922 N/A ARG 4.A NH1 THR 3.A O no hydrogen 2.783 N/A ALA 10.A N LEU 84.A O no hydrogen 2.858 N/A HIS 11.A N LYS 54.A O no hydrogen 2.833 N/A HIS 11.A NE2 GLY 255.A O no hydrogen 2.783 N/A VAL 12.A N LYS 54.A O no hydrogen 3.038 N/A GLY 13.A N TRP 88.A O no hydrogen 2.776 N/A VAL 14.A N ALA 56.A O no hydrogen 2.839 N/A ILE 15.A N ILE 90.A O no hydrogen 2.888 N/A GLY 16.A N LEU 58.A O no hydrogen 3.349 N/A LEU 20.A N GLY 17.A O no hydrogen 3.137 N/A TYR 21.A N SER 18.A O no hydrogen 3.370 N/A GLY 24.A N ASP 22.A OD1 no hydrogen 2.910 N/A ILE 25.A N ASP 22.A O no hydrogen 3.013 N/A VAL 26.A N ASP 22.A O no hydrogen 3.028 N/A GLU 27.A N ASP 49.A O no hydrogen 2.853 N/A ASN 28.A ND2 ASP 49.A OD2 no hydrogen 2.866 N/A VAL 30.A N VAL 47.A O no hydrogen 2.838 N/A VAL 32.A N ILE 45.A O no hydrogen 2.798 N/A LYS 33.A N ARG 4.A O no hydrogen 2.861 N/A SER 35.A N ILE 2.A O no hydrogen 3.029 N/A THR 36.A OG1 GLY 39.A O no hydrogen 2.776 N/A TYR 38.A N THR 36.A OG1 no hydrogen 3.001 N/A SER 42.A N ASN 77.A OD1 no hydrogen 2.914 N/A SER 42.A OG ARG 60.A O no hydrogen 2.544 N/A PHE 44.A N ASP 43.A OD1 no hydrogen 2.793 N/A ILE 45.A N VAL 32.A O no hydrogen 3.390 N/A VAL 46.A N PHE 57.A O no hydrogen 3.020 N/A VAL 47.A N VAL 30.A O no hydrogen 2.840 N/A GLY 48.A N VAL 55.A O no hydrogen 3.062 N/A ASP 49.A N GLU 27.A O no hydrogen 2.830 N/A VAL 50.A N VAL 53.A O no hydrogen 2.876 N/A VAL 53.A N VAL 50.A O no hydrogen 2.924 N/A LYS 54.A NZ ASP 49.A OD1 no hydrogen 2.942 N/A VAL 55.A N GLY 48.A O no hydrogen 2.804 N/A ALA 56.A N VAL 12.A O no hydrogen 2.715 N/A PHE 57.A N VAL 46.A O no hydrogen 2.833 N/A LEU 58.A N VAL 14.A O no hydrogen 2.909 N/A ARG 60.A NE GLU 198.A OE1 no hydrogen 2.974 N/A ARG 60.A NH1 VAL 92.A O no hydrogen 3.090 N/A ARG 60.A NH2 SER 91.A OG no hydrogen 2.843 N/A ARG 60.A NH2 GLU 198.A OE1 no hydrogen 3.458 N/A ARG 60.A NH2 GLU 198.A OE2 no hydrogen 2.813 N/A HIS 61.A ND1 ILE 67.A O no hydrogen 2.683 N/A GLY 62.A N PRO 59.A O no hydrogen 2.942 N/A ARG 63.A N ASP 43.A OD2 no hydrogen 3.015 N/A HIS 65.A N GLY 62.A O no hydrogen 3.168 N/A ARG 66.A NE ARG 63.A O no hydrogen 2.904 N/A ARG 66.A NH2 ARG 63.A O no hydrogen 3.517 N/A ILE 67.A N HIS 61.A O no hydrogen 2.886 N/A ALA 71.A N PRO 68.A O no hydrogen 2.969 N/A ILE 72.A N PRO 69.A O no hydrogen 3.502 N/A ASN 73.A ND2 TYR 38.A O no hydrogen 2.781 N/A ASN 73.A ND2 ASN 40.A O no hydrogen 3.375 N/A TYR 74.A OH PRO 69.A O no hydrogen 2.675 N/A ALA 76.A N ASN 73.A OD1 no hydrogen 3.181 N/A ASN 77.A N ASN 73.A O no hydrogen 3.082 N/A ASN 77.A ND2 SER 42.A OG no hydrogen 3.073 N/A ILE 78.A N TYR 74.A O no hydrogen 3.089 N/A TRP 79.A N ARG 75.A O no hydrogen 2.921 N/A ALA 80.A N ALA 76.A O no hydrogen 2.949 N/A LEU 81.A N ASN 77.A O no hydrogen 3.163 N/A LYS 82.A N ILE 78.A O no hydrogen 2.954 N/A LYS 82.A NZ ALA 205.A O no hydrogen 2.669 N/A ALA 83.A N TRP 79.A O no hydrogen 2.832 N/A LEU 84.A N ALA 80.A O no hydrogen 3.191 N/A LEU 84.A N LEU 81.A O no hydrogen 3.183 N/A GLY 85.A N LYS 82.A O no hydrogen 2.986 N/A VAL 86.A N LEU 81.A O no hydrogen 3.415 N/A LYS 87.A N HIS 11.A O no hydrogen 2.885 N/A TRP 88.A N HIS 11.A O no hydrogen 3.352 N/A TRP 88.A NE1 GLY 255.A O no hydrogen 3.019 N/A VAL 89.A N CYS 208.A O no hydrogen 2.800 N/A ILE 90.A N GLY 13.A O no hydrogen 2.855 N/A SER 91.A N ALA 210.A O no hydrogen 2.943 N/A VAL 92.A N ILE 15.A O no hydrogen 2.880 N/A SER 93.A N LEU 212.A O no hydrogen 3.020 N/A VAL 95.A N MET 214.A O no hydrogen 3.097 N/A GLY 96.A N ILE 191.A O no hydrogen 2.853 N/A SER 97.A N ASP 217.A O no hydrogen 2.715 N/A SER 97.A OG ARG 99.A O no hydrogen 2.736 N/A SER 97.A OG TYR 102.A O no hydrogen 2.738 N/A LEU 98.A N ASP 189.A O no hydrogen 2.910 N/A ARG 99.A N SER 97.A OG no hydrogen 3.081 N/A ARG 99.A NE ASP 101.A OD1 no hydrogen 2.828 N/A ARG 99.A NH1 ASP 189.A OD1 no hydrogen 3.044 N/A ARG 99.A NH2 ASP 101.A OD2 no hydrogen 3.043 N/A TYR 102.A N ARG 99.A O no hydrogen 3.084 N/A TYR 102.A OH ARG 162.A O no hydrogen 2.637 N/A ARG 103.A N ASP 106.A OD2 no hydrogen 3.050 N/A ARG 103.A NE GLU 100.A OE2 no hydrogen 2.744 N/A ARG 103.A NH2 GLU 100.A OE2 no hydrogen 2.707 N/A GLY 105.A N VAL 215.A O no hydrogen 2.853 N/A ASP 106.A N ARG 103.A O no hydrogen 2.850 N/A PHE 107.A N THR 158.A O no hydrogen 3.092 N/A VAL 108.A N ALA 213.A O no hydrogen 2.809 N/A VAL 109.A N HIS 160.A O no hydrogen 2.957 N/A ASP 111.A N GLY 163.A O no hydrogen 3.018 N/A GLN 112.A N GLY 163.A O no hydrogen 3.214 N/A GLN 112.A NE2 ALA 137.A O no hydrogen 2.990 N/A ILE 114.A N TYR 165.A O no hydrogen 2.888 N/A MET 116.A N CYS 167.A O no hydrogen 2.781 N/A THR 117.A N ASP 115.A OD1 no hydrogen 2.969 N/A THR 117.A OG1 ASP 115.A OD1 no hydrogen 2.697 N/A THR 117.A OG1 TYR 123.A OH no hydrogen 2.810 N/A LYS 118.A N GLU 169.A OE1 no hydrogen 2.908 N/A ASN 119.A N GLU 169.A OE1 no hydrogen 2.844 N/A ARG 120.A N TYR 123.A OH no hydrogen 3.381 N/A ARG 120.A NE GLU 169.A OE1 no hydrogen 3.277 N/A ARG 120.A NE GLU 169.A OE2 no hydrogen 3.036 N/A ARG 120.A NH1 MET 193.A O no hydrogen 2.783 N/A ARG 120.A NH2 GLU 169.A O no hydrogen 2.856 N/A ARG 120.A NH2 MET 193.A O no hydrogen 2.900 N/A ARG 121.A NE ASN 119.A OD1 no hydrogen 3.158 N/A HIS 122.A N ARG 120.A O no hydrogen 2.794 N/A TYR 123.A OH THR 117.A OG1 no hydrogen 2.810 N/A THR 124.A OG1 GLU 204.A OE1 no hydrogen 3.087 N/A THR 124.A OG1 GLU 204.A OE2 no hydrogen 2.669 N/A PHE 125.A N GLU 204.A OE1 no hydrogen 2.846 N/A TYR 126.A N THR 124.A OG1 no hydrogen 2.905 N/A THR 131.A N ILE 273.A OXT no hydrogen 3.067 N/A HIS 133.A N ALA 271.A O no hydrogen 2.847 N/A CYS 141.A N TYR 209.A O no hydrogen 2.887 N/A CYS 141.A SG ARG 261.A O no hydrogen 3.724 N/A ASP 143.A N ARG 261.A O no hydrogen 2.969 N/A ARG 145.A N CYS 141.A O no hydrogen 2.938 N/A ARG 145.A NE PRO 110.A O no hydrogen 2.909 N/A ARG 145.A NH1 GLU 142.A OE1 no hydrogen 2.999 N/A ARG 145.A NH2 VAL 109.A O no hydrogen 2.818 N/A ARG 145.A NH2 GLU 161.A O no hydrogen 2.693 N/A GLN 146.A N GLU 142.A O no hydrogen 2.973 N/A ARG 147.A N ASP 143.A O no hydrogen 3.136 N/A ARG 147.A NE ASP 143.A OD1 no hydrogen 2.795 N/A LEU 148.A N LEU 144.A O no hydrogen 2.929 N/A ILE 149.A N ARG 145.A O no hydrogen 3.013 N/A ASP 150.A N GLN 146.A O no hydrogen 2.879 N/A SER 151.A N ARG 147.A O no hydrogen 3.050 N/A SER 151.A OG ARG 147.A O no hydrogen 3.514 N/A SER 151.A OG ASP 248.A OD2 no hydrogen 2.674 N/A GLY 152.A N LEU 148.A O no hydrogen 3.166 N/A ARG 153.A N ILE 149.A O no hydrogen 3.112 N/A ARG 153.A NH2 GLU 161.A OE2 no hydrogen 3.217 N/A ARG 154.A N ASP 150.A O no hydrogen 2.986 N/A ARG 154.A NE ASP 248.A OD2 no hydrogen 2.963 N/A ARG 154.A NH2 ASP 248.A OD2 no hydrogen 2.691 N/A LEU 155.A N SER 151.A O no hydrogen 2.971 N/A GLY 156.A N ARG 153.A O no hydrogen 3.241 N/A TYR 157.A N GLY 152.A O no hydrogen 2.899 N/A HIS 160.A N PHE 107.A O no hydrogen 2.910 N/A HIS 160.A NE2 ASP 106.A OD2 no hydrogen 2.812 N/A GLY 163.A N ASP 111.A OD1 no hydrogen 3.021 N/A THR 164.A N ASP 189.A OD2 no hydrogen 2.717 N/A TYR 165.A N GLN 112.A O no hydrogen 2.975 N/A VAL 166.A N ILE 190.A O no hydrogen 2.946 N/A CYS 167.A N ILE 114.A O no hydrogen 2.956 N/A CYS 167.A SG GLY 192.A O no hydrogen 3.871 N/A ILE 168.A N GLY 192.A O no hydrogen 2.926 N/A ARG 172.A NH1 PHE 173.A O no hydrogen 3.159 N/A ARG 172.A NH1 GLU 178.A OE1 no hydrogen 2.786 N/A ARG 172.A NH2 GLU 178.A OE1 no hydrogen 3.463 N/A ARG 172.A NH2 GLU 178.A OE2 no hydrogen 2.940 N/A THR 175.A N GLU 178.A OE1 no hydrogen 3.168 N/A ARG 176.A NH1 VAL 220.A O no hydrogen 2.935 N/A GLU 178.A N THR 175.A OG1 no hydrogen 3.120 N/A SER 179.A N THR 175.A O no hydrogen 2.984 N/A SER 179.A OG ASP 219.A OD2 no hydrogen 2.754 N/A ARG 180.A N ARG 176.A O no hydrogen 2.912 N/A VAL 181.A N ALA 177.A O no hydrogen 3.252 N/A TRP 182.A N GLU 178.A O no hydrogen 2.953 N/A TRP 182.A NE1 SER 174.A OG no hydrogen 3.096 N/A LYS 183.A N SER 179.A O no hydrogen 2.889 N/A LYS 183.A NZ ASP 184.A OD1 no hydrogen 2.761 N/A LYS 183.A NZ ASP 184.A OD2 no hydrogen 3.485 N/A ASP 184.A N ARG 180.A O no hydrogen 2.823 N/A VAL 185.A N VAL 181.A O no hydrogen 3.091 N/A PHE 186.A N VAL 181.A O no hydrogen 2.913 N/A LYS 187.A NZ ASP 184.A O no hydrogen 2.635 N/A ALA 188.A N TRP 182.A O no hydrogen 2.955 N/A ASP 189.A N THR 164.A O no hydrogen 2.924 N/A ILE 190.A N THR 164.A O no hydrogen 3.141 N/A ILE 191.A N GLY 96.A O no hydrogen 2.889 N/A GLY 192.A N VAL 166.A O no hydrogen 3.085 N/A THR 194.A N TYR 165.A OH no hydrogen 3.375 N/A ILE 199.A N LEU 195.A O no hydrogen 2.949 N/A ASN 200.A ND2 TYR 123.A O no hydrogen 3.235 N/A LEU 201.A N PRO 197.A O no hydrogen 3.052 N/A ALA 202.A N GLU 198.A O no hydrogen 3.026 N/A CYS 203.A N ILE 199.A O no hydrogen 2.954 N/A CYS 203.A SG.B PRO 139.A O no hydrogen 3.470 N/A GLU 204.A N ASN 200.A O no hydrogen 2.973 N/A ALA 205.A N LEU 201.A O no hydrogen 2.898 N/A GLN 206.A N CYS 203.A O no hydrogen 3.035 N/A LEU 207.A N ALA 202.A O no hydrogen 3.015 N/A CYS 208.A N LYS 87.A O no hydrogen 3.030 N/A TYR 209.A OH GLU 198.A OE2 no hydrogen 2.479 N/A ALA 210.A N VAL 89.A O no hydrogen 3.100 N/A LEU 212.A N SER 91.A O no hydrogen 2.745 N/A ALA 213.A N VAL 108.A O no hydrogen 2.850 N/A MET 214.A N SER 93.A O no hydrogen 2.779 N/A VAL 215.A N ASP 106.A O no hydrogen 2.905 N/A THR 216.A N VAL 95.A O no hydrogen 2.943 N/A THR 216.A OG1 VAL 95.A O no hydrogen 3.266 N/A THR 216.A OG1 ASP 217.A OD1 no hydrogen 2.764 N/A TYR 218.A OH GLU 100.A O no hydrogen 2.776 N/A ASP 219.A N ASP 217.A OD2 no hydrogen 2.814 N/A TRP 221.A N TYR 218.A O no hydrogen 2.901 N/A VAL 226.A N ASP 219.A O no hydrogen 2.950 N/A GLU 230.A N THR 227.A OG1 no hydrogen 3.256 N/A VAL 231.A N THR 227.A O no hydrogen 3.074 N/A GLU 232.A N ALA 228.A O no hydrogen 3.038 N/A ARG 233.A N GLU 229.A O no hydrogen 2.943 N/A VAL 234.A N GLU 230.A O no hydrogen 3.058 N/A MET 235.A N VAL 231.A O no hydrogen 3.002 N/A ILE 236.A N GLU 232.A O no hydrogen 3.012 N/A SER 237.A N ARG 233.A O no hydrogen 3.054 N/A SER 237.A OG ARG 233.A O no hydrogen 2.907 N/A ASN 238.A N MET 235.A O no hydrogen 3.090 N/A ASN 238.A ND2 VAL 234.A O no hydrogen 2.799 N/A ARG 241.A NE ASN 238.A OD1 no hydrogen 3.484 N/A ARG 241.A NH2 GLY 105.A O no hydrogen 2.495 N/A ARG 241.A NH2 ASN 238.A OD1 no hydrogen 2.965 N/A ALA 242.A N ASN 238.A O no hydrogen 3.148 N/A ARG 243.A N VAL 239.A O no hydrogen 2.826 N/A ARG 243.A NE GLU 240.A OE1 no hydrogen 3.342 N/A ARG 243.A NH1 GLY 19.A O no hydrogen 2.911 N/A ARG 243.A NH2 GLU 240.A OE1 no hydrogen 2.963 N/A ARG 244.A N GLU 240.A O no hydrogen 2.981 N/A ARG 244.A NE GLU 240.A OE2 no hydrogen 2.763 N/A ARG 244.A NH2 GLU 240.A OE2 no hydrogen 3.569 N/A MET 245.A N ARG 241.A O no hydrogen 3.079 N/A LEU 246.A N ALA 242.A O no hydrogen 2.959 N/A TYR 247.A N ARG 243.A O no hydrogen 2.839 N/A TYR 247.A OH LEU 20.A O no hydrogen 2.688 N/A ASP 248.A N ARG 244.A O no hydrogen 3.046 N/A ASP 248.A N MET 245.A O no hydrogen 3.125 N/A VAL 249.A N MET 245.A O no hydrogen 2.915 N/A VAL 249.A N LEU 246.A O no hydrogen 3.252 N/A ILE 250.A N LEU 246.A O no hydrogen 3.055 N/A LYS 252.A N VAL 249.A O no hydrogen 3.093 N/A LEU 253.A N ILE 250.A O no hydrogen 2.973 N/A GLU 258.A N ASP 143.A OD2 no hydrogen 2.908 N/A GLU 260.A N GLU 260.A OE1 no hydrogen 2.840 N/A ARG 261.A N GLU 258.A O no hydrogen 2.848 N/A ARG 261.A NH1 GLU 258.A OE1 no hydrogen 3.062 N/A CYS 262.A N LEU 259.A O no hydrogen 3.098 N/A SER 263.A OG ASP 138.A O no hydrogen 2.583 N/A SER 263.A OG PHE 140.A O no hydrogen 3.553 N/A CYS 265.A N CYS 262.A O no hydrogen 3.220 N/A ALA 267.A N CYS 264.A O no hydrogen 3.019 N/A ASP 269.A N ARG 266.A O no hydrogen 3.095 N/A ALA 271.A N LEU 268.A O no hydrogen 3.501 N/A ILE 273.A N THR 131.A O no hydrogen 2.799 N/A