Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5fbd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 1.A N HIS 6.A NE2 no hydrogen 3.371 N/A TRP 1.A N ASP 119.A OD1 no hydrogen 3.021 N/A TRP 1.A N ASP 152.A OD1 no hydrogen 3.004 N/A TRP 1.A NE1 GLY 118.A O no hydrogen 2.709 N/A GLY 2.A N ASP 152.A O no hydrogen 2.816 N/A HIS 6.A N GLY 2.A O no hydrogen 3.117 N/A GLU 7.A N ASN 3.A O no hydrogen 2.988 N/A THR 8.A N LEU 4.A O no hydrogen 2.878 N/A THR 8.A OG1 LEU 4.A O no hydrogen 2.702 N/A VAL 9.A N GLY 5.A O no hydrogen 2.969 N/A ALA 10.A N HIS 6.A O no hydrogen 2.990 N/A TYR 11.A N GLU 7.A O no hydrogen 2.873 N/A TYR 11.A OH SER 35.A OG no hydrogen 2.656 N/A ILE 12.A N THR 8.A O no hydrogen 2.975 N/A ALA 13.A N VAL 9.A O no hydrogen 3.034 N/A GLN 14.A N ALA 10.A O no hydrogen 2.960 N/A GLN 14.A NE2 THR 34.A O no hydrogen 3.066 N/A SER 15.A N TYR 11.A O no hydrogen 3.102 N/A SER 15.A N ILE 12.A O no hydrogen 3.046 N/A SER 15.A OG TYR 11.A O no hydrogen 3.289 N/A PHE 16.A N ALA 13.A O no hydrogen 2.986 N/A VAL 17.A N ALA 13.A O no hydrogen 3.044 N/A ALA 18.A N ASP 260.A OD1 no hydrogen 2.905 N/A THR 21.A OG1 ASP 260.A OD1 no hydrogen 2.495 N/A GLU 22.A N ALA 18.A O no hydrogen 2.942 N/A SER 23.A N SER 19.A O no hydrogen 3.083 N/A SER 23.A OG.A SER 19.A O no hydrogen 3.349 N/A PHE 24.A N SER 20.A O no hydrogen 3.016 N/A CYS 25.A N THR 21.A O no hydrogen 2.907 N/A CYS 25.A SG THR 21.A O no hydrogen 3.364 N/A GLN 26.A N GLU 22.A O no hydrogen 2.842 N/A GLN 26.A NE2 SER 33.A O no hydrogen 3.360 N/A ASN 27.A N SER 23.A O no hydrogen 3.038 N/A ILE 28.A N PHE 24.A O no hydrogen 3.250 N/A LEU 29.A N CYS 25.A O no hydrogen 2.950 N/A GLY 30.A N ASN 27.A O no hydrogen 3.300 N/A ASP 31.A N GLN 26.A O no hydrogen 3.198 N/A SER 33.A N ASP 31.A OD1 no hydrogen 2.854 N/A SER 33.A OG ASP 31.A OD1 no hydrogen 2.626 N/A SER 35.A N SER 33.A OG no hydrogen 3.078 N/A SER 35.A OG TYR 11.A OH no hydrogen 2.656 N/A LEU 37.A N GLN 14.A OE1 no hydrogen 2.888 N/A ALA 38.A N GLN 14.A OE1 no hydrogen 3.259 N/A ASN 39.A N SER 35.A O no hydrogen 2.754 N/A ASN 39.A ND2 ASP 31.A OD2 no hydrogen 2.961 N/A VAL 40.A N LEU 37.A O no hydrogen 3.287 N/A ALA 41.A N ALA 38.A O no hydrogen 3.233 N/A TRP 43.A N VAL 40.A O no hydrogen 3.371 N/A ASP 45.A N THR 42.A O no hydrogen 2.970 N/A THR 46.A N TRP 43.A O no hydrogen 3.140 N/A THR 46.A OG1 TRP 43.A O no hydrogen 3.259 N/A TYR 47.A N TRP 43.A O no hydrogen 2.880 N/A LYS 48.A N ALA 44.A O no hydrogen 3.146 N/A LYS 48.A NZ ASP 45.A OD1 no hydrogen 2.917 N/A TYR 49.A N THR 46.A O no hydrogen 3.078 N/A THR 50.A N TYR 47.A O no hydrogen 3.036 N/A THR 50.A OG1 TYR 47.A O no hydrogen 2.714 N/A GLY 53.A N THR 50.A O no hydrogen 3.291 N/A GLY 53.A N THR 50.A OG1 no hydrogen 3.077 N/A SER 56.A N GLY 53.A O no hydrogen 2.908 N/A SER 56.A OG GLY 53.A O no hydrogen 2.713 N/A LYS 57.A N GLU 54.A O no hydrogen 3.207 N/A TYR 59.A N SER 56.A O no hydrogen 3.055 N/A HIS 60.A ND1 ASP 119.A OD2 no hydrogen 3.070 N/A ILE 62.A N HIS 125.A O no hydrogen 2.850 N/A ALA 64.A N ILE 62.A O no hydrogen 2.902 N/A GLN 65.A N ASP 79.A OD1 no hydrogen 3.069 N/A ASN 67.A N SER 71.A O no hydrogen 2.903 N/A SER 71.A N ASN 67.A O no hydrogen 2.767 N/A CYS 72.A SG ASN 212.A O no hydrogen 3.662 N/A GLY 73.A N ASP 66.A OD2 no hydrogen 2.893 N/A ASP 75.A N ASP 79.A OD2 no hydrogen 2.806 N/A ARG 78.A N ASP 75.A OD1 no hydrogen 2.910 N/A ARG 78.A NE ASP 79.A OD1 no hydrogen 2.757 N/A ARG 78.A NH2 GLY 73.A O no hydrogen 3.204 N/A ARG 78.A NH2 ASP 79.A OD1 no hydrogen 3.460 N/A ARG 78.A NH2 ASP 79.A OD2 no hydrogen 2.954 N/A ASP 79.A N ASP 75.A O no hydrogen 2.837 N/A CYS 80.A N TYR 76.A O no hydrogen 2.846 N/A CYS 80.A SG GLY 81.A O no hydrogen 4.045 N/A CYS 80.A SG SER 88.A OG no hydrogen 3.731 N/A GLY 84.A N GLY 81.A O no hydrogen 3.183 N/A CYS 85.A N SER 88.A OG no hydrogen 2.848 N/A SER 86.A N PHE 61.A O no hydrogen 2.932 N/A SER 88.A OG CYS 85.A O no hydrogen 3.089 N/A ALA 89.A N CYS 85.A O no hydrogen 2.977 N/A ILE 90.A N SER 86.A O no hydrogen 2.966 N/A GLN 91.A N ILE 87.A O no hydrogen 3.050 N/A ASN 92.A N SER 88.A O no hydrogen 2.921 N/A TYR 93.A N ALA 89.A O no hydrogen 2.893 N/A THR 94.A N ILE 90.A O no hydrogen 2.944 N/A THR 94.A OG1 ILE 90.A O no hydrogen 2.685 N/A ASN 95.A N GLN 91.A O no hydrogen 3.041 N/A ILE 96.A N ASN 92.A O no hydrogen 2.985 N/A LEU 97.A N TYR 93.A O no hydrogen 3.098 N/A LEU 98.A N THR 94.A O no hydrogen 2.923 N/A GLU 99.A N ASN 95.A O no hydrogen 2.959 N/A SER 100.A N ILE 96.A O no hydrogen 2.787 N/A GLY 103.A N SER 100.A O no hydrogen 3.145 N/A ALA 106.A N GLY 103.A O no hydrogen 3.311 N/A ALA 109.A N GLU 105.A O no hydrogen 3.014 N/A LEU 110.A N ALA 106.A O no hydrogen 2.934 N/A LYS 111.A N LEU 107.A O no hydrogen 3.120 N/A PHE 112.A N ASN 108.A O no hydrogen 2.774 N/A VAL 113.A N ALA 109.A O no hydrogen 2.909 N/A VAL 114.A N LEU 110.A O no hydrogen 3.010 N/A HIS 115.A N LYS 111.A O no hydrogen 3.151 N/A HIS 115.A ND1 ALA 41.A O no hydrogen 2.733 N/A ILE 116.A N PHE 112.A O no hydrogen 2.830 N/A ILE 117.A N VAL 113.A O no hydrogen 3.024 N/A ASP 119.A N HIS 115.A O no hydrogen 3.018 N/A ILE 120.A N ILE 116.A O no hydrogen 2.922 N/A HIS 121.A N GLY 118.A O no hydrogen 3.051 N/A HIS 121.A ND1 ILE 117.A O no hydrogen 2.854 N/A GLN 122.A N ASP 119.A O no hydrogen 3.014 N/A GLN 122.A NE2 ASP 152.A OD1 no hydrogen 2.878 N/A LEU 124.A N GLN 122.A OE1 no hydrogen 2.838 N/A HIS 125.A N GLN 122.A O no hydrogen 2.839 N/A HIS 125.A ND1 HIS 60.A O no hydrogen 2.619 N/A ASP 126.A N PRO 123.A O no hydrogen 2.913 N/A ASN 128.A N ALA 64.A O no hydrogen 2.940 N/A LEU 129.A N GLU 127.A OE2 no hydrogen 2.923 N/A GLY 132.A N ASN 128.A O no hydrogen 3.330 N/A GLY 133.A N LEU 129.A O no hydrogen 2.834 N/A ASN 134.A N ALA 131.A O no hydrogen 3.307 N/A ASN 134.A ND2 ALA 131.A O no hydrogen 2.874 N/A GLY 135.A N GLU 130.A O no hydrogen 2.895 N/A ILE 136.A N GLY 133.A O no hydrogen 3.249 N/A VAL 138.A N THR 145.A O no hydrogen 2.948 N/A TYR 140.A N GLU 143.A O no hydrogen 2.909 N/A TYR 140.A OH GLU 158.A OE2 no hydrogen 2.751 N/A ASP 141.A N ASP 231.A OD1 no hydrogen 2.916 N/A GLY 142.A N ASP 231.A OD2 no hydrogen 2.958 N/A GLU 143.A N TYR 140.A O no hydrogen 3.088 N/A THR 145.A N VAL 138.A O no hydrogen 2.759 N/A ASN 146.A N THR 145.A OG1 no hydrogen 2.776 N/A LEU 147.A N ILE 136.A O no hydrogen 2.904 N/A HIS 148.A N GLY 133.A O no hydrogen 3.290 N/A HIS 148.A ND1 GLY 132.A O no hydrogen 2.701 N/A HIS 149.A N ASN 146.A OD1 no hydrogen 2.792 N/A HIS 149.A ND1 ASN 154.A OD1 no hydrogen 2.626 N/A ILE 150.A N ASN 146.A O no hydrogen 3.176 N/A TRP 151.A N LEU 147.A O no hydrogen 3.368 N/A TRP 151.A NE1 TYR 236.A OH no hydrogen 2.953 N/A ASP 152.A N HIS 148.A O no hydrogen 2.839 N/A THR 153.A N HIS 149.A O no hydrogen 2.698 N/A ASN 154.A N HIS 149.A O no hydrogen 3.231 N/A MET 155.A N ILE 150.A O no hydrogen 2.839 N/A GLU 157.A N THR 153.A O no hydrogen 3.011 N/A GLU 158.A N ASN 154.A O no hydrogen 3.113 N/A ALA 159.A N MET 155.A O no hydrogen 3.011 N/A ALA 160.A N PRO 156.A O no hydrogen 2.869 N/A GLY 161.A N GLU 158.A O no hydrogen 3.353 N/A GLY 162.A N GLU 157.A O no hydrogen 2.950 N/A SER 164.A OG SER 166.A OG.B no hydrogen 2.961 N/A SER 166.A OG.B SER 164.A OG no hydrogen 2.961 N/A VAL 167.A N SER 164.A OG no hydrogen 3.045 N/A ALA 168.A N SER 164.A O no hydrogen 2.920 N/A LYS 169.A N LEU 165.A O no hydrogen 2.860 N/A LYS 169.A NZ.A ASP 173.A OD2.A no hydrogen 3.000 N/A THR 170.A N SER 166.A O no hydrogen 3.116 N/A THR 170.A OG1 SER 166.A O no hydrogen 3.111 N/A TYR 171.A N VAL 167.A O no hydrogen 3.014 N/A TYR 171.A OH GLU 245.A OE1 no hydrogen 2.947 N/A ALA 172.A N ALA 168.A O no hydrogen 2.839 N/A ASP 173.A N LYS 169.A O no hydrogen 2.863 N/A LEU 174.A N THR 170.A O no hydrogen 2.966 N/A LEU 175.A N TYR 171.A O no hydrogen 2.992 N/A THR 176.A N ALA 172.A O no hydrogen 2.770 N/A THR 176.A OG1 ALA 172.A O no hydrogen 3.077 N/A GLU 177.A N ASP 173.A O no hydrogen 3.025 N/A ARG 178.A N LEU 174.A O no hydrogen 3.221 N/A ARG 178.A NH1 TYR 184.A OH no hydrogen 3.107 N/A ARG 178.A NH1 GLU 245.A OE2 no hydrogen 2.672 N/A ARG 178.A NH2 GLU 245.A OE2 no hydrogen 3.136 N/A ILE 179.A N LEU 175.A O no hydrogen 2.963 N/A LYS 180.A N THR 176.A O no hydrogen 2.935 N/A THR 181.A N GLU 177.A O no hydrogen 2.900 N/A THR 181.A OG1 GLU 177.A O no hydrogen 3.435 N/A THR 181.A OG1 GLU 177.A OE2.A no hydrogen 2.510 N/A GLY 182.A N GLU 177.A O no hydrogen 3.014 N/A TYR 184.A N ARG 178.A O no hydrogen 2.960 N/A SER 185.A N GLY 182.A O no hydrogen 3.047 N/A SER 185.A OG GLY 182.A O no hydrogen 2.740 N/A LYS 187.A N TYR 184.A O no hydrogen 3.109 N/A LYS 188.A N TYR 184.A O no hydrogen 2.981 N/A LYS 188.A NZ SER 185.A O no hydrogen 2.865 N/A SER 190.A N LYS 187.A O no hydrogen 3.117 N/A SER 190.A OG LYS 187.A O no hydrogen 2.600 N/A TRP 191.A N LYS 188.A O no hydrogen 3.032 N/A ASP 193.A N SER 190.A O no hydrogen 3.149 N/A ILE 195.A N THR 192.A O no hydrogen 3.148 N/A ASP 196.A N THR 203.A OG1 no hydrogen 2.938 N/A LYS 198.A N ASP 196.A OD1 no hydrogen 2.955 N/A LYS 198.A NZ SER 267.A O no hydrogen 2.906 N/A ASP 199.A N ASP 196.A O no hydrogen 2.882 N/A SER 202.A N ASP 199.A OD1 no hydrogen 3.065 N/A SER 202.A OG.B ASP 199.A OD1 no hydrogen 3.093 N/A SER 202.A OG.B ASP 199.A OD2 no hydrogen 2.820 N/A THR 203.A N ASP 199.A O no hydrogen 3.093 N/A THR 203.A OG1 ASP 196.A O no hydrogen 3.095 N/A THR 203.A OG1 ASP 199.A O no hydrogen 2.950 N/A SER 204.A N PRO 200.A O no hydrogen 2.892 N/A SER 204.A OG PRO 200.A O no hydrogen 2.784 N/A SER 204.A OG VAL 201.A O no hydrogen 3.513 N/A MET 205.A N VAL 201.A O no hydrogen 2.896 N/A ILE 206.A N SER 202.A O no hydrogen 3.061 N/A TRP 207.A N THR 203.A O no hydrogen 3.347 N/A ALA 208.A N SER 204.A O no hydrogen 2.928 N/A ALA 209.A N MET 205.A O no hydrogen 2.795 N/A ASP 210.A N ILE 206.A O no hydrogen 2.924 N/A ALA 211.A N TRP 207.A O no hydrogen 2.991 N/A ASN 212.A N ALA 208.A O no hydrogen 2.829 N/A ASN 212.A ND2 ASP 66.A OD2 no hydrogen 2.956 N/A ASN 212.A ND2 ASP 126.A O no hydrogen 2.910 N/A THR 213.A N ALA 209.A O no hydrogen 3.147 N/A THR 213.A OG1 ASP 210.A O no hydrogen 2.715 N/A TYR 214.A N ALA 211.A O no hydrogen 3.050 N/A VAL 215.A N ASN 212.A O no hydrogen 2.851 N/A CYS 216.A N THR 213.A O no hydrogen 3.145 N/A CYS 216.A SG PRO 69.A O no hydrogen 3.079 N/A SER 217.A N THR 213.A O no hydrogen 3.129 N/A SER 217.A OG THR 218.A OG1 no hydrogen 3.002 N/A THR 218.A N TYR 214.A O no hydrogen 2.953 N/A THR 218.A OG1 SER 217.A OG no hydrogen 3.002 N/A VAL 219.A N TYR 214.A O no hydrogen 2.884 N/A LEU 220.A N VAL 215.A O no hydrogen 2.947 N/A GLY 223.A N LEU 220.A O no hydrogen 3.022 N/A TYR 226.A OH GLU 235.A OE1.A no hydrogen 2.676 N/A TYR 226.A OH GLU 235.A OE2.B no hydrogen 3.031 N/A ILE 227.A N GLY 223.A O no hydrogen 3.206 N/A ASN 228.A N LEU 224.A O no hydrogen 2.874 N/A SER 229.A N TYR 226.A O no hydrogen 3.279 N/A SER 229.A OG ALA 225.A O no hydrogen 3.089 N/A THR 230.A OG1 TYR 226.A O no hydrogen 2.815 N/A LEU 232.A N THR 139.A O no hydrogen 3.024 N/A SER 233.A N ASP 231.A OD1 no hydrogen 3.056 N/A SER 233.A OG ASP 231.A OD1 no hydrogen 2.664 N/A TYR 236.A OH VAL 219.A O no hydrogen 2.645 N/A TYR 237.A N LEU 232.A O no hydrogen 2.976 N/A ASP 238.A N GLY 234.A O no hydrogen 3.063 N/A LYS 239.A N GLU 235.A O no hydrogen 3.054 N/A LYS 239.A NZ THR 218.A O no hydrogen 2.833 N/A LYS 239.A NZ ASP 222.A OD2 no hydrogen 2.869 N/A SER 240.A N TYR 236.A O no hydrogen 2.957 N/A SER 240.A OG TYR 236.A O no hydrogen 2.725 N/A GLN 241.A N TYR 237.A O no hydrogen 2.974 N/A GLN 241.A NE2 GLU 245.A OE1 no hydrogen 2.895 N/A PHE 244.A N SER 240.A O no hydrogen 2.884 N/A GLU 245.A N GLN 241.A O no hydrogen 2.984 N/A GLU 246.A N PRO 242.A O no hydrogen 3.018 N/A LEU 247.A N VAL 243.A O no hydrogen 3.019 N/A ILE 248.A N PHE 244.A O no hydrogen 2.920 N/A ALA 249.A N GLU 245.A O no hydrogen 2.992 N/A LYS 250.A N GLU 246.A O no hydrogen 2.875 N/A LYS 250.A NZ ASP 210.A OD1 no hydrogen 3.423 N/A LYS 250.A NZ ASP 210.A OD2 no hydrogen 2.712 N/A ALA 251.A N LEU 247.A O no hydrogen 2.835 N/A GLY 252.A N ILE 248.A O no hydrogen 3.001 N/A TYR 253.A N ALA 249.A O no hydrogen 2.906 N/A ARG 254.A N LYS 250.A O no hydrogen 2.907 N/A ARG 254.A NE TRP 191.A O no hydrogen 2.799 N/A ARG 254.A NH1 HIS 121.A NE2 no hydrogen 2.955 N/A ARG 254.A NH1 ASP 210.A OD2 no hydrogen 3.016 N/A ARG 254.A NH2 TRP 191.A O no hydrogen 3.566 N/A ARG 254.A NH2 ASP 210.A OD2 no hydrogen 3.031 N/A LEU 255.A N ALA 251.A O no hydrogen 2.845 N/A ALA 256.A N GLY 252.A O no hydrogen 3.072 N/A ALA 257.A N TYR 253.A O no hydrogen 3.036 N/A TRP 258.A N ARG 254.A O no hydrogen 2.919 N/A TRP 258.A NE1 THR 94.A OG1 no hydrogen 2.887 N/A LEU 259.A N LEU 255.A O no hydrogen 2.808 N/A ASP 260.A N ALA 256.A O no hydrogen 2.886 N/A LEU 261.A N ALA 257.A O no hydrogen 3.092 N/A ILE 262.A N TRP 258.A O no hydrogen 2.990 N/A ALA 263.A N LEU 259.A O no hydrogen 2.889 N/A SER 264.A N ASP 260.A O no hydrogen 3.019 N/A SER 264.A OG.A LEU 261.A O no hydrogen 2.519 N/A SER 264.A OG.B ASP 260.A O no hydrogen 3.297 N/A GLN 265.A N ILE 262.A O no hydrogen 3.044 N/A GLN 265.A NE2 LEU 97.A O no hydrogen 3.012 N/A GLN 265.A NE2 ILE 262.A O no hydrogen 2.993 N/A