Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4u3t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N PHE 201.A O no hydrogen 2.797 N/A SER 3.A OG ILE 40.A O no hydrogen 2.819 N/A SER 3.A OG SER 200.A O no hydrogen 3.272 N/A ASP 5.A N LEU 41.A O no hydrogen 2.799 N/A ARG 7.A NE ASP 5.A OD1 no hydrogen 3.270 N/A ARG 7.A NH2 ASP 5.A OD2 no hydrogen 2.923 N/A ILE 8.A N ASP 5.A OD1 no hydrogen 3.333 N/A GLN 9.A N ASP 5.A O no hydrogen 2.768 N/A GLN 9.A NE2 LEU 43.A O no hydrogen 2.938 N/A THR 10.A N GLN 6.A O no hydrogen 2.791 N/A THR 10.A OG1 GLN 6.A O no hydrogen 2.983 N/A LEU 11.A N ARG 7.A O no hydrogen 3.204 N/A ALA 12.A N ILE 8.A O no hydrogen 2.770 N/A TYR 13.A N GLN 9.A O no hydrogen 2.862 N/A GLU 14.A N THR 10.A O no hydrogen 2.983 N/A GLU 15.A N LEU 11.A O no hydrogen 3.073 N/A LEU 16.A N ALA 12.A O no hydrogen 3.051 N/A ASN 17.A N TYR 13.A O no hydrogen 3.024 N/A LYS 18.A N GLU 14.A O no hydrogen 2.943 N/A LYS 18.A NZ GLU 15.A OE1 no hydrogen 3.090 N/A LYS 18.A NZ GLU 15.A OE2 no hydrogen 2.754 N/A ALA 19.A N GLU 15.A O no hydrogen 2.972 N/A VAL 20.A N LEU 16.A O no hydrogen 2.933 N/A GLU 21.A N ASN 17.A O no hydrogen 2.886 N/A TYR 22.A N LYS 18.A O no hydrogen 3.024 N/A HIS 23.A N ALA 19.A O no hydrogen 3.020 N/A HIS 23.A ND1 ALA 292.A O no hydrogen 3.120 N/A GLN 24.A N GLU 21.A O no hydrogen 2.974 N/A ALA 25.A N VAL 20.A O no hydrogen 3.081 N/A LYS 26.A N ASP 288.A O no hydrogen 2.909 N/A GLY 28.A N THR 46.A OG1 no hydrogen 2.937 N/A THR 29.A N THR 286.A O no hydrogen 2.854 N/A THR 29.A OG1 ASN 45.A OD1 no hydrogen 2.885 N/A VAL 30.A N ALA 44.A O no hydrogen 2.803 N/A VAL 31.A N ALA 284.A O no hydrogen 2.960 N/A VAL 32.A N ALA 42.A O no hydrogen 2.970 N/A LEU 33.A N ILE 282.A O no hydrogen 2.887 N/A ASP 34.A N GLU 39.A O no hydrogen 2.872 N/A ALA 35.A N ARG 280.A O no hydrogen 3.053 N/A ARG 36.A N ASP 34.A OD2 no hydrogen 2.862 N/A ARG 36.A NE HIS 192.A ND1 no hydrogen 3.410 N/A ARG 36.A NH2 HIS 192.A ND1 no hydrogen 3.228 N/A THR 37.A N ASP 34.A OD2 no hydrogen 3.240 N/A THR 37.A OG1 GLU 39.A OE1 no hydrogen 2.477 N/A GLY 38.A N ASP 34.A O no hydrogen 2.853 N/A GLU 39.A N THR 37.A OG1 no hydrogen 3.148 N/A ILE 40.A N SER 200.A O no hydrogen 3.011 N/A LEU 41.A N VAL 32.A O no hydrogen 2.723 N/A ALA 42.A N VAL 32.A O no hydrogen 3.270 N/A LEU 43.A N GLN 9.A OE1 no hydrogen 2.833 N/A ALA 44.A N VAL 30.A O no hydrogen 2.964 N/A ASN 45.A ND2 ASN 50.A OD1 no hydrogen 2.854 N/A THR 46.A N GLY 28.A O no hydrogen 3.142 N/A THR 46.A OG1 GLY 28.A O no hydrogen 3.358 N/A ARG 49.A NE ASP 55.A OD1 no hydrogen 2.693 N/A ARG 49.A NH2 ASP 55.A OD1 no hydrogen 3.253 N/A ARG 49.A NH2 ASP 55.A OD2 no hydrogen 2.811 N/A ALA 52.A N ASN 45.A OD1 no hydrogen 3.239 N/A VAL 53.A N ASN 50.A O no hydrogen 2.980 N/A THR 54.A N ASN 50.A O no hydrogen 2.823 N/A THR 54.A OG1 ASN 50.A O no hydrogen 3.289 N/A THR 54.A OG1 ASP 55.A OD1 no hydrogen 2.677 N/A ASP 55.A N ARG 51.A O no hydrogen 3.142 N/A ILE 57.A N LEU 178.A O no hydrogen 2.979 N/A GLU 58.A N ARG 254.A O no hydrogen 2.879 N/A GLY 60.A N GLY 173.A O no hydrogen 2.985 N/A SER 61.A OG SER 114.A OG no hydrogen 2.964 N/A ILE 63.A N GLY 60.A O no hydrogen 3.254 N/A LYS 64.A N SER 61.A O no hydrogen 2.915 N/A LYS 64.A NZ SER 61.A OG no hydrogen 2.961 N/A LYS 64.A NZ SER 114.A O no hydrogen 2.958 N/A LYS 64.A NZ ASN 116.A OD1 no hydrogen 2.725 N/A PHE 66.A N ILE 63.A O no hydrogen 3.072 N/A ILE 68.A N LYS 64.A O no hydrogen 3.097 N/A ALA 69.A N PRO 65.A O no hydrogen 2.837 N/A LYS 70.A N PHE 66.A O no hydrogen 2.942 N/A ALA 71.A N VAL 67.A O no hydrogen 3.033 N/A LEU 72.A N ILE 68.A O no hydrogen 2.963 N/A ASP 73.A N ALA 69.A O no hydrogen 2.760 N/A ALA 74.A N LYS 70.A O no hydrogen 3.087 N/A GLY 75.A N LEU 72.A O no hydrogen 3.153 N/A LYS 76.A N ALA 71.A O no hydrogen 2.903 N/A LYS 76.A NZ ARG 125.A O no hydrogen 3.111 N/A THR 77.A N ALA 71.A O no hydrogen 3.370 N/A THR 77.A OG1 ASP 78.A O no hydrogen 3.473 N/A THR 77.A OG1 GLU 81.A OE2 no hydrogen 2.673 N/A ASN 80.A N ASP 78.A OD1 no hydrogen 2.854 N/A GLU 81.A N ASP 78.A OD1 no hydrogen 3.012 N/A LEU 83.A N LEU 105.A O no hydrogen 2.808 N/A THR 85.A N PRO 103.A O no hydrogen 2.801 N/A THR 85.A OG1 TYR 102.A O no hydrogen 2.555 N/A GLN 86.A N ASN 84.A OD1 no hydrogen 2.904 N/A TYR 88.A N VAL 95.A O no hydrogen 3.040 N/A TYR 88.A OH SER 120.A OG no hydrogen 2.726 N/A ILE 90.A N SER 93.A O no hydrogen 2.658 N/A SER 93.A N ILE 90.A O no hydrogen 2.984 N/A SER 93.A OG ILE 90.A O no hydrogen 3.178 N/A VAL 95.A N TYR 88.A O no hydrogen 2.642 N/A LEU 105.A N LEU 83.A O no hydrogen 3.066 N/A GLY 109.A N ASP 106.A OD1 no hydrogen 2.918 N/A ILE 110.A N ASP 106.A O no hydrogen 2.863 N/A MET 111.A N VAL 107.A O no hydrogen 2.998 N/A GLN 112.A N ARG 108.A O no hydrogen 2.764 N/A LYS 113.A N GLY 109.A O no hydrogen 2.847 N/A LYS 113.A NZ GLY 233.A O no hydrogen 2.765 N/A SER 114.A N MET 111.A O no hydrogen 2.956 N/A SER 114.A OG SER 61.A OG no hydrogen 2.964 N/A SER 115.A N ILE 110.A O no hydrogen 2.863 N/A SER 115.A OG ASP 97.A OD1 no hydrogen 2.963 N/A SER 115.A OG ASP 97.A OD2 no hydrogen 2.803 N/A ASN 116.A ND2 ARG 96.A O no hydrogen 3.007 N/A ASN 116.A ND2 ASP 98A.A OD2 no hydrogen 3.218 N/A VAL 117.A N ASP 97.A OD1 no hydrogen 2.937 N/A GLY 118.A N SER 115.A OG no hydrogen 3.062 N/A THR 119.A N SER 115.A O no hydrogen 3.143 N/A THR 119.A OG1 SER 115.A O no hydrogen 2.589 N/A SER 120.A N ASN 116.A O no hydrogen 2.971 N/A SER 120.A OG TYR 88.A OH no hydrogen 2.726 N/A SER 120.A OG ASN 116.A O no hydrogen 3.036 N/A SER 120.A OG VAL 117.A O no hydrogen 3.009 N/A LYS 121.A N VAL 117.A O no hydrogen 2.953 N/A LYS 121.A NZ ASN 84.A O no hydrogen 2.939 N/A LEU 122.A N GLY 118.A O no hydrogen 2.987 N/A SER 123.A N THR 119.A O no hydrogen 2.852 N/A ALA 124.A N SER 120.A O no hydrogen 2.864 N/A ARG 125.A N LEU 122.A O no hydrogen 3.251 N/A ARG 125.A NH1 LYS 76.A O no hydrogen 2.797 N/A ARG 125.A NH1 GLU 81.A OE1 no hydrogen 3.270 N/A ARG 125.A NH1 GLU 81.A OE2 no hydrogen 2.834 N/A ARG 125.A NH2 GLU 81.A OE1 no hydrogen 2.878 N/A PHE 126.A N SER 123.A O no hydrogen 2.963 N/A GLY 127.A N GLU 130.A OE1 no hydrogen 2.964 N/A MET 131.A N GLY 127.A O no hydrogen 3.129 N/A TYR 132.A N ALA 128.A O no hydrogen 2.831 N/A ASP 133.A N GLU 129.A O no hydrogen 2.933 N/A PHE 134.A N GLU 130.A O no hydrogen 2.934 N/A TYR 135.A N MET 131.A O no hydrogen 2.837 N/A HIS 136.A N TYR 132.A O no hydrogen 2.821 N/A GLU 137.A N ASP 133.A O no hydrogen 2.884 N/A LEU 138.A N PHE 134.A O no hydrogen 3.081 N/A GLY 139.A N HIS 136.A O no hydrogen 2.885 N/A ILE 140.A N TYR 135.A O no hydrogen 3.158 N/A VAL 142.A N GLY 139.A O no hydrogen 3.050 N/A ARG 143.A NE GLU 151.A OE1 no hydrogen 2.838 N/A ARG 143.A NH2 GLU 151.A OE1 no hydrogen 3.390 N/A SER 146.A N GLU 151.A OE2 no hydrogen 2.736 N/A SER 146.A OG GLU 151.A OE2 no hydrogen 2.673 N/A PHE 148.A N SER 146.A OG no hydrogen 3.214 N/A ALA 153.A N THR 152.A OG1 no hydrogen 2.797 N/A LEU 155.A N GLN 177.A O no hydrogen 3.124 N/A ARG 157.A NH1 ARG 161.A O no hydrogen 2.968 N/A ARG 157.A NH1 GLU 166.A OE1 no hydrogen 2.818 N/A ARG 157.A NH2 GLU 166.A OE1 no hydrogen 2.372 N/A ARG 160.A N ASN 158.A OD1 no hydrogen 2.968 N/A ARG 161.A N ASN 158.A O no hydrogen 3.057 N/A TRP 162.A N TRP 159.A O no hydrogen 3.109 N/A TRP 162.A NE1 ARG 157.A O no hydrogen 2.891 N/A GLN 167.A N ARG 163.A O no hydrogen 3.019 N/A GLN 167.A NE2 SER 123.A O no hydrogen 2.866 N/A GLN 167.A NE2 SER 123.A OG no hydrogen 3.277 N/A GLN 167.A NE2 PHE 126.A O no hydrogen 2.853 N/A ALA 168.A N PRO 164.A O no hydrogen 3.143 N/A THR 169.A N ILE 165.A O no hydrogen 2.957 N/A THR 169.A OG1 GLU 166.A O no hydrogen 3.496 N/A MET 170.A N GLU 166.A O no hydrogen 2.886 N/A SER 171.A N GLN 167.A O no hydrogen 3.061 N/A SER 171.A OG ALA 168.A O no hydrogen 2.674 N/A PHE 172.A N ALA 168.A O no hydrogen 3.328 N/A PHE 172.A N THR 169.A O no hydrogen 3.202 N/A GLY 173.A N MET 170.A O no hydrogen 2.980 N/A TYR 174.A N THR 169.A O no hydrogen 2.855 N/A TYR 174.A OH THR 252.A O no hydrogen 2.899 N/A GLY 175.A N GLU 58.A OE1 no hydrogen 2.837 N/A GLN 177.A N LEU 155.A O no hydrogen 2.982 N/A LEU 178.A N ILE 57.A O no hydrogen 2.832 N/A SER 179.A N GLN 182.A OE1 no hydrogen 2.912 N/A SER 179.A OG ALA 52.A O no hydrogen 3.568 N/A LEU 181.A N ALA 52.A O no hydrogen 3.384 N/A GLN 182.A N SER 179.A OG no hydrogen 3.215 N/A GLN 182.A NE2 VAL 142.A O no hydrogen 2.925 N/A GLN 182.A NE2 ALA 153.A O no hydrogen 3.097 N/A LEU 183.A N SER 179.A O no hydrogen 2.775 N/A ALA 184.A N LEU 180.A O no hydrogen 2.749 N/A ARG 185.A N LEU 181.A O no hydrogen 2.856 N/A ARG 185.A NE LEU 197.A O no hydrogen 2.739 N/A ARG 185.A NH2 LEU 197.A O no hydrogen 3.548 N/A ALA 186.A N GLN 182.A O no hydrogen 2.986 N/A TYR 187.A N LEU 183.A O no hydrogen 3.261 N/A TYR 187.A OH ALA 62.A O no hydrogen 2.623 N/A THR 188.A N ARG 185.A O no hydrogen 2.944 N/A THR 188.A OG1 ARG 185.A O no hydrogen 2.624 N/A ALA 189.A N ALA 186.A O no hydrogen 3.065 N/A LEU 190.A N TYR 187.A O no hydrogen 3.039 N/A THR 191.A N TYR 187.A O no hydrogen 3.133 N/A THR 191.A OG1 ALA 35.A O no hydrogen 2.696 N/A THR 191.A OG1 THR 188.A O no hydrogen 3.407 N/A HIS 192.A N THR 188.A O no hydrogen 2.724 N/A GLY 194.A N ALA 189.A O no hydrogen 2.886 N/A VAL 195.A N HIS 192.A O no hydrogen 3.080 N/A LEU 196.A N LYS 211.A O no hydrogen 2.916 N/A LEU 197.A N THR 188.A OG1 no hydrogen 3.076 N/A SER 200.A N GLY 38.A O no hydrogen 3.118 N/A SER 200.A OG GLU 202.A O no hydrogen 2.769 N/A LYS 203.A N ALA 1.A O no hydrogen 2.792 N/A LYS 203.A NZ LEU 2.A O no hydrogen 2.818 N/A GLN 204.A N GLU 39.A OE2 no hydrogen 2.813 N/A GLN 204.A NE2 LYS 203.A O no hydrogen 3.430 N/A LYS 211.A N LEU 196.A O no hydrogen 2.862 N/A LYS 211.A NZ GLU 137.A O no hydrogen 2.665 N/A ARG 212.A NE PHE 214.A O no hydrogen 3.103 N/A ARG 212.A NH2 PHE 214.A O no hydrogen 3.160 N/A ILE 213.A N GLY 194.A O no hydrogen 2.759 N/A PHE 214.A N GLY 194.A O no hydrogen 3.053 N/A LYS 215.A N ASP 73.A OD1 no hydrogen 3.033 N/A THR 218.A OG1 ASP 73.A OD1 no hydrogen 2.400 N/A ALA 219.A N LYS 215.A O no hydrogen 3.170 N/A ARG 220.A N GLU 216.A O no hydrogen 2.940 N/A GLU 221.A N SER 217.A O no hydrogen 2.974 N/A VAL 222.A N THR 218.A O no hydrogen 2.925 N/A ARG 223.A N ALA 219.A O no hydrogen 2.977 N/A ARG 223.A NE ALA 276.A O no hydrogen 2.986 N/A ARG 223.A NH1 LEU 190.A O no hydrogen 2.951 N/A ARG 223.A NH2 LYS 277.A O no hydrogen 3.084 N/A ASN 224.A N ARG 220.A O no hydrogen 3.302 N/A ASN 224.A ND2 GLU 221.A OE1 no hydrogen 3.534 N/A LEU 225.A N GLU 221.A O no hydrogen 3.020 N/A MET 226.A N VAL 222.A O no hydrogen 2.941 N/A MET 226.A N ARG 223.A O no hydrogen 3.246 N/A VAL 227.A N ARG 223.A O no hydrogen 3.338 N/A VAL 227.A N ASN 224.A O no hydrogen 3.224 N/A SER 228.A N LEU 225.A O no hydrogen 3.271 N/A SER 228.A OG LEU 225.A O no hydrogen 2.665 N/A VAL 229.A N MET 226.A O no hydrogen 3.053 N/A THR 230.A N VAL 227.A O no hydrogen 3.120 N/A THR 230.A OG1 VAL 227.A O no hydrogen 3.136 N/A THR 230.A OG1 VAL 246.A O no hydrogen 2.659 N/A GLU 231.A N VAL 227.A O no hydrogen 3.258 N/A GLY 234.A N GLU 231.A O no hydrogen 2.922 N/A THR 235.A N GLN 112.A O no hydrogen 3.280 N/A GLY 236.A N VAL 229.A O no hydrogen 2.766 N/A GLY 239.A N GLY 236.A O no hydrogen 2.764 N/A ALA 240.A N THR 237.A O no hydrogen 3.299 N/A PHE 244.A N VAL 241.A O no hydrogen 3.147 N/A GLY 247.A N PHE 273.A O no hydrogen 3.073 N/A LYS 249.A N ILE 271.A O no hydrogen 2.822 N/A LYS 249.A NZ MET 111.A O no hydrogen 3.173 N/A THR 250.A OG1 THR 269.A O no hydrogen 2.918 N/A GLY 251.A N THR 269.A O no hydrogen 3.207 N/A THR 252.A OG1 HIS 266.A ND1 no hydrogen 3.318 N/A ALA 253.A N VAL 267.A O no hydrogen 2.608 N/A ARG 254.A N GLU 58.A O no hydrogen 3.039 N/A LYS 255.A N LYS 265.A O no hydrogen 2.887 N/A LYS 255.A NZ ASP 55.A OD2 no hydrogen 3.196 N/A LYS 255.A NZ ASP 288.A OD1 no hydrogen 2.666 N/A VAL 257.A N ASP 263.A O no hydrogen 3.159 N/A ASP 263.A N VAL 257.A O no hydrogen 2.880 N/A LYS 265.A N LYS 255.A O no hydrogen 2.863 N/A LYS 265.A NZ GLU 289.A OE2 no hydrogen 3.476 N/A HIS 266.A ND1 THR 252.A OG1 no hydrogen 3.318 N/A VAL 267.A N ALA 253.A O no hydrogen 2.911 N/A GLY 268.A N ILE 287.A O no hydrogen 2.894 N/A THR 269.A N GLY 251.A O no hydrogen 3.009 N/A THR 269.A OG1 VAL 267.A O no hydrogen 3.420 N/A PHE 270.A N VAL 285.A O no hydrogen 2.964 N/A ILE 271.A N LYS 249.A O no hydrogen 2.957 N/A GLY 272.A N VAL 283.A O no hydrogen 2.881 N/A PHE 273.A N GLY 247.A O no hydrogen 2.865 N/A ALA 274.A N VAL 281.A O no hydrogen 3.243 N/A ALA 276.A N ASP 245.A O no hydrogen 2.984 N/A ARG 280.A N ALA 274.A O no hydrogen 2.974 N/A VAL 281.A N ALA 274.A O no hydrogen 3.256 N/A ILE 282.A N LEU 33.A O no hydrogen 3.027 N/A VAL 283.A N GLY 272.A O no hydrogen 2.813 N/A ALA 284.A N VAL 31.A O no hydrogen 2.922 N/A VAL 285.A N PHE 270.A O no hydrogen 2.752 N/A THR 286.A N THR 29.A O no hydrogen 2.893 N/A ILE 287.A N GLY 268.A O no hydrogen 2.832 N/A ASP 288.A N ALA 27.A O no hydrogen 2.790 N/A GLU 289.A N HIS 266.A O no hydrogen 2.902 N/A THR 291.A N HIS 23.A O no hydrogen 2.842 N/A ALA 292.A N HIS 23.A O no hydrogen 3.049 N/A SER 299.A N VAL 295.A O no hydrogen 3.138 N/A SER 299.A OG.B VAL 295.A O no hydrogen 3.043 N/A PHE 301.A N ALA 297.A O no hydrogen 3.098 N/A LYS 302.A N GLY 298.A O no hydrogen 2.763 N/A LYS 302.A NZ ALA 240.A O no hydrogen 3.255 N/A LYS 303.A N SER 299.A O no hydrogen 2.857 N/A LYS 303.A NZ SER 299.A OG.A no hydrogen 2.676 N/A ILE 304.A N PRO 300.A O no hydrogen 2.707 N/A MET 305.A N PHE 301.A O no hydrogen 2.865 N/A GLY 306.A N LYS 302.A O no hydrogen 2.990 N/A GLY 307.A N LYS 303.A O no hydrogen 2.929 N/A SER 308.A N ILE 304.A O no hydrogen 2.829 N/A SER 308.A OG ILE 304.A O no hydrogen 2.748 N/A LEU 309.A N MET 305.A O no hydrogen 3.062 N/A ASN 310.A N GLY 306.A O no hydrogen 3.234 N/A ILE 311.A N GLY 307.A O no hydrogen 2.994 N/A LEU 312.A N SER 308.A O no hydrogen 3.059 N/A GLY 313.A N ASN 310.A O no hydrogen 2.963 N/A ILE 314.A N LEU 309.A O no hydrogen 2.899 N/A THR 317.A N GLY 243.A O no hydrogen 2.776 N/A THR 317.A OG1 GLY 243.A O no hydrogen 3.545 N/A LYS 318.A N GLY 243.A O no hydrogen 3.028 N/A