Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5nj2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N LEU 1.A O no hydrogen 2.907 N/A ALA 6.A N ALA 2.A O no hydrogen 2.918 N/A GLU 7.A N ASP 3.A O no hydrogen 3.114 N/A LEU 8.A N ARG 4.A O no hydrogen 3.152 N/A GLU 9.A N PHE 5.A O no hydrogen 3.042 N/A ARG 10.A N ALA 6.A O no hydrogen 3.066 N/A ARG 11.A N GLU 7.A O no hydrogen 2.910 N/A ARG 11.A NE GLU 7.A OE1 no hydrogen 2.825 N/A ARG 11.A NH1 GLU 254.A OE1 no hydrogen 2.925 N/A ARG 11.A NH1 GLU 254.A OE2 no hydrogen 3.395 N/A ARG 11.A NH2 GLU 7.A OE2 no hydrogen 2.861 N/A ARG 11.A NH2 GLU 254.A OE2 no hydrogen 2.765 N/A TYR 12.A N LEU 8.A O no hydrogen 3.005 N/A TYR 12.A OH GLU 254.A OE1 no hydrogen 2.647 N/A ASP 13.A N ARG 10.A O no hydrogen 3.280 N/A ALA 14.A N GLU 9.A O no hydrogen 3.013 N/A ARG 15.A N ASP 237.A O no hydrogen 2.895 N/A ARG 15.A NE ASP 237.A OD1 no hydrogen 3.116 N/A ARG 15.A NH1 ARG 36.A O no hydrogen 2.905 N/A ARG 15.A NH1 ASP 237.A OD2 no hydrogen 2.801 N/A ARG 15.A NH2 GLU 35.A OE2 no hydrogen 3.045 N/A ARG 15.A NH2 ARG 36.A O no hydrogen 2.962 N/A LEU 16.A N GLU 9.A OE1 no hydrogen 2.861 N/A GLY 17.A N MET 235.A O no hydrogen 2.773 N/A VAL 18.A N TYR 31.A O no hydrogen 2.831 N/A TYR 19.A N ALA 233.A O no hydrogen 2.947 N/A VAL 20.A N ILE 29.A O no hydrogen 2.854 N/A THR 23.A N THR 26.A O no hydrogen 2.899 N/A THR 23.A OG1 THR 26.A OG1 no hydrogen 2.589 N/A THR 25.A N THR 23.A OG1 no hydrogen 3.286 N/A THR 26.A N THR 23.A O no hydrogen 3.312 N/A THR 26.A OG1 THR 23.A OG1 no hydrogen 2.589 N/A ILE 29.A N VAL 20.A O no hydrogen 2.939 N/A TYR 31.A N VAL 18.A O no hydrogen 2.951 N/A TYR 31.A OH GLU 9.A OE2 no hydrogen 2.664 N/A ARG 32.A NE GLU 9.A OE1 no hydrogen 2.731 N/A ARG 32.A NH1 GLU 35.A OE1 no hydrogen 2.974 N/A ARG 32.A NH2 GLU 9.A OE1 no hydrogen 3.541 N/A ARG 32.A NH2 GLU 9.A OE2 no hydrogen 3.044 N/A GLU 35.A N ARG 32.A O no hydrogen 3.104 N/A ARG 36.A NH1 VAL 132.A O no hydrogen 2.908 N/A ARG 36.A NH1 THR 153.A OG1 no hydrogen 2.870 N/A ARG 36.A NH2 VAL 132.A O no hydrogen 3.007 N/A PHE 37.A N THR 154.A O no hydrogen 2.912 N/A PHE 39.A N ASP 152.A O no hydrogen 2.985 N/A SER 41.A OG SER 99.A OG no hydrogen 3.061 N/A SER 41.A OG GLU 139.A OE1 no hydrogen 3.565 N/A THR 42.A N PHE 39.A O no hydrogen 3.134 N/A THR 42.A OG1 PHE 39.A O no hydrogen 2.753 N/A LYS 44.A N SER 41.A O no hydrogen 2.990 N/A LYS 44.A NZ SER 41.A OG no hydrogen 2.750 N/A LYS 44.A NZ SER 99.A O no hydrogen 2.744 N/A LYS 44.A NZ SER 99.A OG no hydrogen 3.310 N/A LYS 44.A NZ GLU 139.A OE1 no hydrogen 3.285 N/A ALA 45.A N THR 42.A O no hydrogen 3.416 N/A LEU 47.A N PHE 43.A O no hydrogen 2.935 N/A VAL 48.A N LYS 44.A O no hydrogen 3.061 N/A ALA 49.A N ALA 45.A O no hydrogen 3.156 N/A ALA 50.A N PRO 46.A O no hydrogen 2.887 N/A VAL 51.A N LEU 47.A O no hydrogen 3.114 N/A LEU 52.A N VAL 48.A O no hydrogen 2.827 N/A HIS 53.A N ALA 49.A O no hydrogen 2.803 N/A GLN 54.A N ALA 50.A O no hydrogen 3.199 N/A ASN 55.A N LEU 52.A O no hydrogen 3.403 N/A ASN 55.A ND2 VAL 51.A O no hydrogen 2.879 N/A HIS 59.A N PRO 56.A O no hydrogen 2.948 N/A LEU 60.A N LEU 57.A O no hydrogen 3.010 N/A ASP 61.A N THR 58.A O no hydrogen 3.029 N/A LYS 62.A N HIS 59.A O no hydrogen 3.054 N/A ILE 64.A N MET 86.A O no hydrogen 2.778 N/A TYR 66.A OH ALA 78.A O no hydrogen 2.719 N/A THR 67.A N ASP 70.A OD2 no hydrogen 2.857 N/A THR 67.A OG1 ASP 70.A OD2 no hydrogen 3.537 N/A ASP 70.A N THR 67.A O no hydrogen 2.963 N/A ILE 71.A N SER 68.A O no hydrogen 3.073 N/A ARG 72.A NH1 GLU 141.A OE1 no hydrogen 3.207 N/A ARG 72.A NH2 GLU 141.A OE1 no hydrogen 3.516 N/A ARG 72.A NH2 GLU 141.A OE2 no hydrogen 2.585 N/A SER 75.A OG SER 73.A O no hydrogen 2.682 N/A SER 75.A OG THR 102.A OG1 no hydrogen 2.668 N/A VAL 77.A N ASP 100.A OD2 no hydrogen 2.871 N/A ALA 78.A N ASP 100.A OD2 no hydrogen 2.775 N/A GLN 79.A N SER 75.A O no hydrogen 3.042 N/A HIS 81.A N VAL 77.A O no hydrogen 3.240 N/A HIS 81.A N ALA 78.A O no hydrogen 3.174 N/A HIS 81.A ND1 VAL 77.A O no hydrogen 3.082 N/A THR 84.A N HIS 81.A O no hydrogen 3.225 N/A GLY 85.A N HIS 81.A O no hydrogen 2.877 N/A MET 86.A N ILE 64.A O no hydrogen 2.978 N/A THR 87.A OG1 LEU 60.A O no hydrogen 3.382 N/A ILE 88.A N LYS 62.A O no hydrogen 2.887 N/A GLY 89.A N LEU 60.A O no hydrogen 2.853 N/A GLN 90.A N THR 87.A OG1 no hydrogen 2.999 N/A LEU 91.A N THR 87.A O no hydrogen 2.813 N/A CYS 92.A N ILE 88.A O no hydrogen 2.917 N/A CYS 92.A SG ILE 88.A O no hydrogen 3.427 N/A ASP 93.A N GLY 89.A O no hydrogen 2.984 N/A ALA 94.A N GLN 90.A O no hydrogen 2.978 N/A ALA 95.A N LEU 91.A O no hydrogen 2.832 N/A ILE 96.A N CYS 92.A O no hydrogen 3.092 N/A ARG 97.A N ASP 93.A O no hydrogen 2.751 N/A ARG 97.A NE ASP 93.A OD1 no hydrogen 3.016 N/A ARG 97.A NH1 ARG 186.A O no hydrogen 3.166 N/A ARG 97.A NH2 ASP 93.A OD1 no hydrogen 3.502 N/A TYR 98.A N ALA 94.A O no hydrogen 3.059 N/A ASP 100.A N ALA 94.A O no hydrogen 3.030 N/A GLY 101.A N ILE 74.A O no hydrogen 2.935 N/A THR 102.A N SER 75.A OG no hydrogen 3.071 N/A THR 102.A OG1 ASP 70.A O no hydrogen 3.488 N/A THR 102.A OG1 SER 75.A OG no hydrogen 2.668 N/A ALA 103.A N ASP 100.A OD1 no hydrogen 2.827 N/A ALA 104.A N ASP 100.A O no hydrogen 3.117 N/A ASN 105.A N GLY 101.A O no hydrogen 2.927 N/A ASN 105.A ND2 GLU 139.A O no hydrogen 2.926 N/A LEU 106.A N THR 102.A O no hydrogen 2.841 N/A LEU 107.A N ALA 103.A O no hydrogen 2.951 N/A LEU 108.A N ALA 104.A O no hydrogen 2.874 N/A ALA 109.A N ASN 105.A O no hydrogen 3.041 N/A ASP 110.A N LEU 106.A O no hydrogen 2.880 N/A LEU 111.A N LEU 107.A O no hydrogen 2.920 N/A GLY 112.A N LEU 108.A O no hydrogen 2.945 N/A GLY 113.A N ALA 109.A O no hydrogen 2.762 N/A GLY 116.A N GLY 113.A O no hydrogen 3.146 N/A ALA 120.A N GLY 116.A O no hydrogen 3.001 N/A PHE 121.A N GLY 117.A O no hydrogen 2.823 N/A THR 122.A N THR 118.A O no hydrogen 3.009 N/A THR 122.A OG1 THR 118.A O no hydrogen 2.939 N/A THR 122.A OG1 LEU 135.A O no hydrogen 3.150 N/A GLY 123.A N ALA 119.A O no hydrogen 2.852 N/A TYR 124.A N ALA 120.A O no hydrogen 2.964 N/A LEU 125.A N PHE 121.A O no hydrogen 3.193 N/A ARG 126.A N THR 122.A O no hydrogen 2.916 N/A ARG 126.A NH1 ASP 130.A O no hydrogen 2.805 N/A ARG 126.A NH1 SER 133.A O no hydrogen 2.812 N/A ARG 126.A NH2 SER 133.A O no hydrogen 3.007 N/A SER 127.A N GLY 123.A O no hydrogen 2.878 N/A SER 127.A OG TYR 124.A O no hydrogen 2.702 N/A LEU 128.A N TYR 124.A O no hydrogen 3.212 N/A LEU 128.A N LEU 125.A O no hydrogen 3.026 N/A GLY 129.A N ARG 126.A O no hydrogen 2.909 N/A ASP 130.A N LEU 125.A O no hydrogen 3.033 N/A VAL 132.A N ASP 130.A OD1 no hydrogen 2.849 N/A SER 133.A N ASP 130.A OD1 no hydrogen 3.024 N/A SER 133.A OG ASP 130.A OD1 no hydrogen 3.440 N/A SER 133.A OG ASP 130.A OD2 no hydrogen 2.563 N/A SER 133.A OG THR 154.A OG1 no hydrogen 2.701 N/A ARG 134.A N THR 153.A O no hydrogen 2.890 N/A ARG 134.A NE ASP 136.A OD1 no hydrogen 2.940 N/A ARG 134.A NH1 ASP 136.A OD2 no hydrogen 2.831 N/A LEU 135.A N THR 122.A OG1 no hydrogen 2.950 N/A ASP 136.A N ASP 152.A OD1 no hydrogen 2.684 N/A ALA 137.A N ASP 152.A OD1 no hydrogen 2.974 N/A GLU 139.A N ASN 105.A OD1 no hydrogen 2.910 N/A GLU 141.A N GLU 141.A OE1 no hydrogen 2.912 N/A LEU 142.A N GLU 138.A O no hydrogen 2.976 N/A ASN 143.A N PRO 140.A O no hydrogen 3.021 N/A ASN 143.A ND2 GLU 139.A OE2 no hydrogen 2.812 N/A ASN 143.A ND2 PRO 140.A O no hydrogen 2.951 N/A ARG 144.A N GLU 141.A O no hydrogen 3.047 N/A ASP 149.A N PRO 146.A O no hydrogen 3.102 N/A ARG 151.A N ASP 149.A OD1 no hydrogen 2.921 N/A ARG 151.A NE ASP 149.A OD1 no hydrogen 3.274 N/A ARG 151.A NE ASP 149.A OD2 no hydrogen 3.207 N/A ARG 151.A NH2 ASP 149.A OD2 no hydrogen 2.899 N/A ASP 152.A N ASP 136.A OD1 no hydrogen 3.065 N/A THR 153.A OG1 GLU 150.A O no hydrogen 2.638 N/A THR 154.A N PHE 37.A O no hydrogen 2.956 N/A THR 154.A OG1 SER 133.A OG no hydrogen 2.701 N/A THR 154.A OG1 THR 155.A O no hydrogen 3.498 N/A THR 155.A OG1 ALA 33.A O no hydrogen 3.534 N/A HIS 157.A N ALA 33.A O no hydrogen 2.881 N/A HIS 157.A ND1.A ASP 34.A OD1 no hydrogen 2.770 N/A HIS 157.A ND1.B ASP 34.A OD1 no hydrogen 2.416 N/A HIS 157.A NE2.B GLU 30.A OE2 no hydrogen 2.687 N/A ALA 158.A N THR 155.A OG1 no hydrogen 2.949 N/A ILE 159.A N THR 155.A O no hydrogen 2.981 N/A ALA 160.A N PRO 156.A O no hydrogen 3.068 N/A LEU 161.A N HIS 157.A O no hydrogen 2.996 N/A VAL 162.A N ALA 158.A O no hydrogen 2.996 N/A LEU 163.A N ILE 159.A O no hydrogen 2.865 N/A GLN 164.A N ALA 160.A O no hydrogen 2.847 N/A GLN 165.A N LEU 161.A O no hydrogen 3.140 N/A LEU 166.A N VAL 162.A O no hydrogen 3.006 N/A VAL 167.A N LEU 163.A O no hydrogen 2.917 N/A LEU 168.A N GLN 164.A O no hydrogen 2.808 N/A GLY 169.A N GLN 164.A O no hydrogen 2.920 N/A GLY 169.A N GLN 165.A O no hydrogen 3.231 N/A ALA 171.A N GLN 165.A O no hydrogen 3.387 N/A LYS 176.A NZ LEU 52.A O no hydrogen 2.888 N/A LYS 176.A NZ HIS 53.A O no hydrogen 3.495 N/A LYS 176.A NZ ASN 55.A O no hydrogen 2.752 N/A ARG 177.A N PRO 173.A O no hydrogen 2.868 N/A ARG 177.A NE LEU 172.A O no hydrogen 3.356 N/A ARG 177.A NH2 LEU 172.A O no hydrogen 2.866 N/A ALA 178.A N PRO 174.A O no hydrogen 2.922 N/A LEU 179.A N ASP 175.A O no hydrogen 3.268 N/A LEU 180.A N LYS 176.A O no hydrogen 3.109 N/A THR 181.A N ARG 177.A O no hydrogen 2.908 N/A THR 181.A OG1 ARG 177.A O no hydrogen 2.818 N/A ASP 182.A N ALA 178.A O no hydrogen 2.950 N/A TRP 183.A N LEU 179.A O no hydrogen 3.031 N/A MET 184.A N LEU 180.A O no hydrogen 3.042 N/A ALA 185.A N THR 181.A O no hydrogen 2.821 N/A ARG 186.A N ASP 182.A O no hydrogen 3.050 N/A ARG 186.A NE ASP 182.A OD1 no hydrogen 3.058 N/A ARG 186.A NE ASP 182.A OD2 no hydrogen 3.295 N/A ARG 186.A NH1 ASP 182.A OD2 no hydrogen 2.888 N/A ASN 187.A N MET 184.A O no hydrogen 3.233 N/A ASN 187.A ND2 THR 189.A OG1 no hydrogen 3.095 N/A ASN 187.A ND2 ASP 206.A OD1 no hydrogen 2.948 N/A ASN 187.A ND2 ASP 206.A OD2 no hydrogen 3.271 N/A THR 188.A N ARG 97.A O no hydrogen 3.040 N/A THR 188.A OG1 ARG 97.A O no hydrogen 2.798 N/A THR 189.A N ASN 187.A OD1 no hydrogen 3.132 N/A THR 189.A OG1 ASN 187.A OD1 no hydrogen 3.210 N/A THR 189.A OG1 THR 208.A OG1 no hydrogen 2.693 N/A ARG 193.A N GLY 190.A O no hydrogen 3.196 N/A ARG 193.A NE GLU 249.A OE2 no hydrogen 2.753 N/A ARG 193.A NH1 THR 210.A OG1 no hydrogen 2.812 N/A ARG 193.A NH1 GLU 249.A OE2 no hydrogen 3.356 N/A ARG 193.A NH2 GLY 209.A O no hydrogen 2.870 N/A ARG 193.A NH2 THR 210.A OG1 no hydrogen 3.157 N/A ARG 193.A NH2 ASN 217.A O no hydrogen 2.918 N/A ILE 194.A N ASP 218.A OD2 no hydrogen 2.927 N/A ARG 195.A NE.A ARG 195.A O no hydrogen 2.842 N/A ARG 195.A NE.B ASP 206.A OD1 no hydrogen 3.086 N/A ARG 195.A NH1.A TRP 202.A O no hydrogen 2.921 N/A ARG 195.A NH1.B VAL 204.A O no hydrogen 2.857 N/A ARG 195.A NH2.A PHE 198.A O no hydrogen 3.141 N/A ARG 195.A NH2.A TRP 202.A O no hydrogen 3.104 N/A ARG 195.A NH2.B ALA 185.A O no hydrogen 3.408 N/A ARG 195.A NH2.B ASP 206.A OD1 no hydrogen 2.945 N/A ALA 196.A N ARG 193.A O no hydrogen 3.031 N/A GLY 197.A N ILE 194.A O no hydrogen 2.888 N/A PHE 198.A N ARG 195.A O no hydrogen 3.329 N/A TRP 202.A N PRO 199.A O no hydrogen 2.962 N/A LYS 203.A N TRP 223.A O no hydrogen 3.088 N/A ILE 205.A N VAL 221.A O no hydrogen 2.944 N/A ASP 206.A N MET 184.A O no hydrogen 3.186 N/A LYS 207.A N ILE 219.A O no hydrogen 2.871 N/A LYS 207.A NZ SER 99.A OG no hydrogen 2.841 N/A LYS 207.A NZ THR 208.A O no hydrogen 2.854 N/A THR 208.A OG1 THR 189.A OG1 no hydrogen 2.693 N/A GLY 209.A N ASN 217.A O no hydrogen 2.993 N/A GLY 211.A N ARG 215.A O no hydrogen 3.030 N/A ASP 212.A N ASN 143.A O no hydrogen 3.283 N/A TYR 213.A N TYR 243.A O no hydrogen 2.883 N/A ARG 215.A N GLY 211.A O no hydrogen 3.347 N/A ARG 215.A N ASP 212.A O no hydrogen 3.187 N/A ARG 215.A NH1 ASN 143.A O no hydrogen 2.975 N/A ARG 215.A NH1 ASP 145.A O no hydrogen 2.866 N/A ARG 215.A NH2 ASP 145.A O no hydrogen 2.914 N/A ALA 216.A N SER 236.A O no hydrogen 3.008 N/A ASN 217.A N GLY 209.A O no hydrogen 2.703 N/A ASN 217.A ND2 ALA 38.A O no hydrogen 2.829 N/A ASN 217.A ND2 PHE 39.A O no hydrogen 3.014 N/A ASP 218.A N VAL 234.A O no hydrogen 2.840 N/A ILE 219.A N LYS 207.A O no hydrogen 3.022 N/A ALA 220.A N VAL 232.A O no hydrogen 2.813 N/A VAL 221.A N ILE 205.A O no hydrogen 3.050 N/A VAL 222.A N TYR 230.A O no hydrogen 2.843 N/A TRP 223.A N LYS 203.A O no hydrogen 2.904 N/A SER 224.A N VAL 228.A O no hydrogen 2.854 N/A SER 224.A OG THR 226.A OG1 no hydrogen 3.226 N/A THR 226.A N SER 224.A OG no hydrogen 3.190 N/A THR 226.A OG1 SER 224.A OG no hydrogen 3.226 N/A GLY 227.A N SER 224.A O no hydrogen 2.881 N/A VAL 228.A N SER 224.A OG no hydrogen 3.116 N/A TYR 230.A N VAL 222.A O no hydrogen 2.877 N/A VAL 232.A N ALA 220.A O no hydrogen 2.921 N/A ALA 233.A N TYR 19.A O no hydrogen 2.953 N/A VAL 234.A N ASP 218.A O no hydrogen 2.945 N/A MET 235.A N GLY 17.A O no hydrogen 2.851 N/A SER 236.A N ASN 217.A OD1 no hydrogen 3.262 N/A SER 236.A OG ALA 216.A O no hydrogen 2.763 N/A ASP 237.A N ARG 15.A O no hydrogen 3.020 N/A ARG 238.A N TYR 213.A O no hydrogen 2.914 N/A ARG 238.A NE TYR 12.A O no hydrogen 2.875 N/A ARG 238.A NE ASP 13.A O no hydrogen 3.279 N/A ARG 238.A NH1 ASP 13.A OD2 no hydrogen 3.159 N/A ARG 238.A NH2 GLU 246.A O no hydrogen 2.926 N/A GLY 241.A N ARG 238.A O no hydrogen 3.172 N/A GLY 242.A N ALA 239.A O no hydrogen 2.933 N/A ALA 245.A N GLY 242.A O no hydrogen 2.985 N/A ARG 248.A NH2 GLU 246.A OE1 no hydrogen 3.049 N/A LEU 251.A N ARG 248.A O no hydrogen 3.102 N/A ALA 253.A N GLU 249.A O no hydrogen 3.072 N/A GLU 254.A N ALA 250.A O no hydrogen 2.883 N/A ALA 255.A N LEU 251.A O no hydrogen 2.912 N/A ALA 256.A N LEU 252.A O no hydrogen 2.866 N/A THR 257.A N ALA 253.A O no hydrogen 2.870 N/A THR 257.A OG1 ALA 253.A O no hydrogen 2.824 N/A CYS 258.A N GLU 254.A O no hydrogen 2.999 N/A CYS 258.A SG GLU 254.A O no hydrogen 3.343 N/A VAL 259.A N ALA 255.A O no hydrogen 3.083 N/A ALA 260.A N ALA 256.A O no hydrogen 2.808 N/A GLY 261.A N THR 257.A O no hydrogen 2.900 N/A VAL 262.A N CYS 258.A O no hydrogen 3.322 N/A LEU 263.A N VAL 259.A O no hydrogen 2.983 N/A ALA 264.A N ALA 260.A O no hydrogen 2.888 N/A LEU 265.A N VAL 262.A O no hydrogen 3.422 N/A