Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uxd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N GLU 140.A OE2 no hydrogen 2.603 N/A ARG 2.A N ILE 135.A O no hydrogen 3.108 N/A ARG 2.A NE VAL 133.A O no hydrogen 3.393 N/A ARG 2.A NH2 VAL 133.A O no hydrogen 3.325 N/A LYS 9.A N LYS 5.A O no hydrogen 3.161 N/A ASP 10.A N GLY 6.A O no hydrogen 3.060 N/A VAL 11.A N ALA 7.A O no hydrogen 2.836 N/A VAL 12.A N LEU 8.A O no hydrogen 3.056 N/A GLN 13.A N LYS 9.A O no hydrogen 3.019 N/A LEU 14.A N ASP 10.A O no hydrogen 3.004 N/A SER 15.A N VAL 11.A O no hydrogen 2.781 N/A SER 15.A OG VAL 11.A O no hydrogen 3.059 N/A SER 15.A OG PHE 111.A O no hydrogen 3.209 N/A LEU 16.A N VAL 12.A O no hydrogen 2.946 N/A ARG 17.A N LEU 14.A O no hydrogen 3.149 N/A ARG 18.A N SER 15.A O no hydrogen 3.063 N/A ARG 18.A NH1 THR 83.A O no hydrogen 3.081 N/A ARG 18.A NH1 ASP 110.A OD2 no hydrogen 2.843 N/A ARG 18.A NH2 THR 83.A O no hydrogen 2.899 N/A LEU 21.A N ASP 120.A OD1 no hydrogen 2.840 N/A ARG 22.A NH2 SER 20.A OG no hydrogen 2.883 N/A ARG 22.A NH2 LEU 21.A O no hydrogen 3.014 N/A ARG 25.A NE ARG 27.A O no hydrogen 2.741 N/A ARG 25.A NH1 TYR 122.A O no hydrogen 2.803 N/A ARG 25.A NH1 ALA 126.A O no hydrogen 2.698 N/A ARG 25.A NH2 PRO 28.A O no hydrogen 2.920 N/A ARG 25.A NH2 ALA 126.A O no hydrogen 3.211 N/A ARG 27.A NE ASP 127.A OD1 no hydrogen 3.389 N/A ARG 27.A NH1 VAL 102.A O no hydrogen 2.982 N/A ARG 27.A NH2 ASP 127.A OD2 no hydrogen 3.224 N/A ILE 30.A N ASP 127.A OD1 no hydrogen 2.918 N/A ARG 33.A NE ARG 174.A O no hydrogen 2.986 N/A ARG 33.A NH2 ASN 203.A O no hydrogen 3.077 N/A GLU 34.A N SER 31.A OG no hydrogen 2.806 N/A ARG 35.A N SER 31.A O no hydrogen 3.176 N/A ARG 35.A NH1 ALA 76.A O no hydrogen 3.069 N/A ARG 35.A NH1 VAL 77.A O no hydrogen 2.908 N/A ILE 36.A N LEU 32.A O no hydrogen 2.971 N/A LEU 37.A N ARG 33.A O no hydrogen 3.067 N/A GLU 38.A N GLU 34.A O no hydrogen 3.007 N/A PHE 39.A N ARG 35.A O no hydrogen 2.869 N/A ASN 40.A N ILE 36.A O no hydrogen 2.883 N/A LYS 41.A N LEU 37.A O no hydrogen 2.935 N/A ARG 42.A N GLU 38.A O no hydrogen 3.011 N/A ASN 43.A N ASN 40.A O no hydrogen 3.112 N/A ILE 44.A N PHE 39.A O no hydrogen 2.995 N/A ILE 48.A N PHE 229.A O no hydrogen 2.845 N/A ALA 49.A N GLY 78.A O no hydrogen 3.223 N/A VAL 50.A N ILE 231.A O no hydrogen 2.895 N/A TYR 51.A N VAL 80.A O no hydrogen 2.800 N/A TYR 51.A OH ARG 63.A O no hydrogen 2.753 N/A ARG 53.A NH1 ASP 94.A OD1 no hydrogen 2.765 N/A ARG 53.A NH2 ASN 89.A O no hydrogen 3.100 N/A ARG 53.A NH2 ASP 94.A OD1 no hydrogen 3.342 N/A ARG 53.A NH2 ASP 94.A OD2 no hydrogen 2.462 N/A LYS 54.A N PHE 88.A O no hydrogen 3.204 N/A SER 55.A OG SER 57.A OG no hydrogen 3.313 N/A SER 57.A N SER 55.A OG no hydrogen 3.045 N/A SER 57.A OG SER 55.A OG no hydrogen 3.313 N/A VAL 61.A N ARG 53.A O no hydrogen 2.717 N/A ARG 63.A NE MET 236.A O no hydrogen 2.983 N/A ARG 63.A NH2 MET 236.A O no hydrogen 2.787 N/A GLU 67.A N ASP 64.A OD2 no hydrogen 2.873 N/A TYR 68.A N ASP 64.A O no hydrogen 3.032 N/A TYR 68.A OH VAL 50.A O no hydrogen 2.811 N/A ALA 69.A N PRO 65.A O no hydrogen 2.901 N/A LYS 70.A N ILE 66.A O no hydrogen 2.820 N/A PHE 71.A N GLU 67.A O no hydrogen 3.054 N/A MET 72.A N TYR 68.A O no hydrogen 2.965 N/A GLU 73.A N ALA 69.A O no hydrogen 2.813 N/A ARG 74.A N PHE 71.A O no hydrogen 3.398 N/A TYR 75.A N MET 72.A O no hydrogen 3.038 N/A ALA 76.A N MET 72.A O no hydrogen 2.872 N/A VAL 77.A N ILE 47.A O no hydrogen 2.758 N/A LEU 79.A N PRO 105.A O no hydrogen 2.879 N/A VAL 80.A N ALA 49.A O no hydrogen 2.869 N/A ILE 81.A N LEU 107.A O no hydrogen 2.899 N/A LEU 82.A N TYR 51.A O no hydrogen 3.113 N/A THR 83.A N TRP 109.A O no hydrogen 2.963 N/A THR 83.A OG1 ASP 110.A OD2 no hydrogen 2.818 N/A LYS 86.A N GLU 84.A OE2 no hydrogen 2.977 N/A LYS 86.A NZ ASP 10.A OD2 no hydrogen 2.649 N/A TYR 87.A N GLU 84.A OE1 no hydrogen 2.797 N/A TYR 87.A OH ASP 10.A OD2 no hydrogen 2.533 N/A PHE 88.A N GLU 84.A OE1 no hydrogen 3.243 N/A GLY 90.A N GLU 84.A O no hydrogen 2.837 N/A TYR 92.A OH ASP 120.A OD2 no hydrogen 2.685 N/A ASP 94.A N SER 91.A OG no hydrogen 3.248 N/A ARG 96.A N TYR 92.A O no hydrogen 2.964 N/A LYS 97.A N GLU 93.A O no hydrogen 2.959 N/A ILE 98.A N ASP 94.A O no hydrogen 2.960 N/A ALA 99.A N LEU 95.A O no hydrogen 2.875 N/A SER 100.A N ARG 96.A O no hydrogen 3.021 N/A SER 100.A OG ARG 96.A O no hydrogen 3.048 N/A SER 101.A N ILE 98.A O no hydrogen 2.854 N/A SER 101.A OG LYS 97.A O no hydrogen 2.946 N/A VAL 102.A N ILE 98.A O no hydrogen 3.058 N/A SER 103.A N GLU 73.A OE2 no hydrogen 2.873 N/A SER 103.A OG GLU 73.A OE2 no hydrogen 2.675 N/A ILE 106.A N ASP 127.A OD2 no hydrogen 2.699 N/A LEU 107.A N LEU 79.A O no hydrogen 2.773 N/A MET 108.A N THR 128.A O no hydrogen 2.848 N/A TRP 109.A N ILE 81.A O no hydrogen 2.971 N/A PHE 111.A N ASP 110.A OD1 no hydrogen 2.648 N/A LYS 114.A NZ LEU 16.A O no hydrogen 3.006 N/A LYS 114.A NZ ARG 18.A O no hydrogen 2.741 N/A GLN 117.A N LYS 114.A O no hydrogen 3.165 N/A GLN 117.A NE2 PHE 111.A O no hydrogen 3.660 N/A ILE 118.A N GLU 115.A O no hydrogen 2.960 N/A ASP 119.A N GLU 115.A O no hydrogen 3.058 N/A ASP 120.A N SER 116.A O no hydrogen 2.823 N/A ALA 121.A N GLN 117.A O no hydrogen 3.101 N/A TYR 122.A N ILE 118.A O no hydrogen 2.911 N/A ASN 123.A N ASP 119.A O no hydrogen 2.851 N/A LEU 124.A N ASP 120.A O no hydrogen 3.068 N/A LEU 124.A N ALA 121.A O no hydrogen 3.316 N/A GLY 125.A N TYR 122.A O no hydrogen 3.251 N/A ALA 126.A N ALA 121.A O no hydrogen 2.967 N/A ASP 127.A N ILE 106.A O no hydrogen 2.860 N/A THR 128.A N ILE 106.A O no hydrogen 3.169 N/A THR 128.A OG1 VAL 129.A O no hydrogen 3.409 N/A THR 128.A OG1 GLU 154.A O no hydrogen 2.826 N/A GLY 130.A N MET 108.A O no hydrogen 3.320 N/A LEU 131.A N ALA 156.A O no hydrogen 2.916 N/A VAL 133.A N VAL 158.A O no hydrogen 3.194 N/A ILE 135.A N ILE 132.A O no hydrogen 3.194 N/A LEU 136.A N VAL 133.A O no hydrogen 3.332 N/A THR 137.A N GLU 140.A OE1 no hydrogen 2.839 N/A GLU 140.A N THR 137.A OG1 no hydrogen 3.032 N/A LEU 141.A N THR 137.A O no hydrogen 2.874 N/A GLU 142.A N GLU 138.A O no hydrogen 2.996 N/A SER 143.A N ARG 139.A O no hydrogen 2.947 N/A LEU 144.A N GLU 140.A O no hydrogen 2.758 N/A LEU 145.A N LEU 141.A O no hydrogen 2.892 N/A GLU 146.A N GLU 142.A O no hydrogen 3.060 N/A TYR 147.A N SER 143.A O no hydrogen 2.824 N/A TYR 147.A OH ASP 119.A OD1 no hydrogen 2.669 N/A ALA 148.A N LEU 144.A O no hydrogen 2.833 N/A ARG 149.A N LEU 145.A O no hydrogen 2.973 N/A ARG 149.A NE GLU 154.A OE1 no hydrogen 2.873 N/A ARG 149.A NE GLU 154.A OE2 no hydrogen 3.238 N/A ARG 149.A NH1 GLU 146.A OE2 no hydrogen 3.158 N/A ARG 149.A NH2 GLU 154.A OE2 no hydrogen 2.848 N/A ARG 149.A NH2 GLY 172.A O no hydrogen 3.143 N/A SER 150.A N GLU 146.A O no hydrogen 3.041 N/A SER 150.A N TYR 147.A O no hydrogen 3.106 N/A SER 150.A OG TYR 147.A O no hydrogen 2.744 N/A TYR 151.A N ALA 148.A O no hydrogen 3.092 N/A TYR 151.A OH ASP 119.A OD1 no hydrogen 2.668 N/A GLY 152.A N ARG 149.A O no hydrogen 2.807 N/A MET 153.A N ALA 148.A O no hydrogen 3.092 N/A ALA 156.A N VAL 129.A O no hydrogen 2.928 N/A ILE 157.A N ILE 175.A O no hydrogen 3.012 N/A VAL 158.A N LEU 131.A O no hydrogen 2.772 N/A ILE 159.A N ILE 177.A O no hydrogen 2.960 N/A ASN 160.A N ASP 164.A OD2 no hydrogen 3.197 N/A ASN 160.A ND2 ASP 182.A OD1 no hydrogen 3.278 N/A ASP 164.A N ASP 161.A OD1 no hydrogen 2.799 N/A LEU 165.A N ASP 161.A O no hydrogen 2.967 N/A ASP 166.A N GLU 162.A O no hydrogen 2.925 N/A ILE 167.A N GLU 163.A O no hydrogen 3.098 N/A ALA 168.A N ASP 164.A O no hydrogen 2.883 N/A LEU 169.A N LEU 165.A O no hydrogen 2.974 N/A ARG 170.A N ASP 166.A O no hydrogen 2.918 N/A ARG 170.A NH1 GLU 138.A OE1 no hydrogen 2.917 N/A ARG 170.A NH2 ASP 166.A OD1 no hydrogen 2.987 N/A ILE 171.A N ILE 167.A O no hydrogen 2.957 N/A GLY 172.A N LEU 169.A O no hydrogen 3.021 N/A ALA 173.A N ALA 168.A O no hydrogen 2.996 N/A ILE 176.A N VAL 205.A O no hydrogen 2.852 N/A ILE 177.A N ILE 157.A O no hydrogen 2.893 N/A ILE 178.A N VAL 207.A O no hydrogen 2.816 N/A SER 179.A N ILE 159.A O no hydrogen 2.997 N/A SER 179.A OG ARG 181.A O no hydrogen 3.401 N/A SER 179.A OG SER 210.A OG no hydrogen 3.098 N/A SER 180.A N ALA 209.A O no hydrogen 2.925 N/A SER 180.A OG ALA 209.A O no hydrogen 3.488 N/A SER 180.A OG SER 210.A O no hydrogen 3.040 N/A ARG 181.A N SER 179.A OG no hydrogen 3.171 N/A ASP 182.A N GLU 187.A O no hydrogen 3.008 N/A GLU 184.A N ASP 182.A OD2 no hydrogen 2.794 N/A THR 185.A N ASP 182.A OD2 no hydrogen 3.185 N/A LEU 186.A N ASP 182.A O no hydrogen 2.859 N/A GLU 187.A N THR 185.A OG1 no hydrogen 3.188 N/A ASN 189.A N SER 180.A O no hydrogen 2.994 N/A LYS 190.A NZ GLY 211.A O no hydrogen 2.940 N/A LYS 190.A NZ GLU 217.A OE1 no hydrogen 3.052 N/A ASN 192.A ND2 ASN 160.A O no hydrogen 2.930 N/A GLN 193.A N ASN 189.A O no hydrogen 3.142 N/A ARG 194.A N LYS 190.A O no hydrogen 2.927 N/A LYS 195.A N GLU 191.A O no hydrogen 2.990 N/A LYS 195.A NZ GLU 162.A OE2 no hydrogen 2.745 N/A LEU 196.A N ASN 192.A O no hydrogen 2.953 N/A ILE 197.A N GLN 193.A O no hydrogen 2.917 N/A SER 198.A N ARG 194.A O no hydrogen 3.087 N/A SER 198.A OG LYS 195.A O no hydrogen 2.594 N/A MET 199.A N LEU 196.A O no hydrogen 3.049 N/A ILE 200.A N ILE 197.A O no hydrogen 3.189 N/A VAL 204.A N PRO 201.A O no hydrogen 3.206 N/A VAL 205.A N ARG 174.A O no hydrogen 3.032 N/A LYS 206.A N ASN 227.A OD1 no hydrogen 2.821 N/A LYS 206.A NZ PRO 201.A O no hydrogen 3.478 N/A LYS 206.A NZ VAL 204.A O no hydrogen 2.852 N/A VAL 207.A N ILE 176.A O no hydrogen 2.905 N/A ALA 208.A N ALA 228.A O no hydrogen 2.928 N/A ALA 209.A N ILE 178.A O no hydrogen 3.026 N/A SER 210.A OG SER 179.A OG no hydrogen 3.098 N/A SER 213.A N GLU 217.A OE2 no hydrogen 2.649 N/A SER 213.A OG GLU 217.A OE2 no hydrogen 3.483 N/A GLU 214.A N GLU 217.A OE2 no hydrogen 3.011 N/A GLU 217.A N GLU 214.A O no hydrogen 3.076 N/A ILE 218.A N GLU 214.A O no hydrogen 3.389 N/A GLU 219.A N ARG 215.A O no hydrogen 2.916 N/A GLU 220.A N ASN 216.A O no hydrogen 3.031 N/A LEU 221.A N GLU 217.A O no hydrogen 2.986 N/A ARG 222.A N ILE 218.A O no hydrogen 2.819 N/A ARG 222.A NH1 VAL 226.A O no hydrogen 2.913 N/A LYS 223.A N GLU 219.A O no hydrogen 3.140 N/A LEU 224.A N GLU 220.A O no hydrogen 3.205 N/A GLY 225.A N ARG 222.A O no hydrogen 2.866 N/A VAL 226.A N LEU 221.A O no hydrogen 3.115 N/A ASN 227.A N LYS 206.A O no hydrogen 2.805 N/A ALA 228.A N LYS 206.A O no hydrogen 3.296 N/A PHE 229.A N ALA 46.A O no hydrogen 2.928 N/A GLU 230.A N ALA 208.A O no hydrogen 2.799 N/A ILE 231.A N ILE 48.A O no hydrogen 2.956 N/A MET 236.A N GLY 232.A O no hydrogen 2.968 N/A ARG 237.A N SER 233.A O no hydrogen 3.104 N/A ASN 238.A N SER 234.A O no hydrogen 3.026 N/A ASN 238.A ND2 SER 234.A O no hydrogen 3.404 N/A LYS 241.A N ASN 238.A O no hydrogen 2.945 N/A LYS 241.A NZ SER 213.A O no hydrogen 3.074 N/A ILE 242.A N PRO 239.A O no hydrogen 3.199 N/A LYS 243.A N GLU 240.A O no hydrogen 3.079 N/A LYS 243.A NZ TYR 75.A OH no hydrogen 3.510 N/A LYS 243.A NZ GLU 240.A OE1 no hydrogen 3.443 N/A LEU 245.A N LYS 241.A O no hydrogen 3.277 N/A ILE 246.A N ILE 242.A O no hydrogen 3.133 N/A LEU 247.A N GLU 244.A O no hydrogen 3.349 N/A