Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6gr9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 6.A N VAL 3.A O no hydrogen 3.323 N/A GLU 7.A N ARG 24.A O no hydrogen 2.979 N/A GLY 9.A N LEU 22.A O no hydrogen 2.746 N/A ARG 10.A N LEU 22.A O no hydrogen 3.460 N/A LEU 12.A N VAL 20.A O no hydrogen 2.804 N/A LYS 16.A N GLY 13.A O no hydrogen 3.231 N/A GLY 18.A N GLY 15.A O no hydrogen 2.955 N/A ASN 19.A ND2 VAL 36.A O no hydrogen 3.635 N/A TYR 21.A N LEU 34.A O no hydrogen 2.782 N/A LEU 22.A N ARG 10.A O no hydrogen 2.989 N/A ALA 23.A N VAL 32.A O no hydrogen 2.940 N/A ARG 24.A N GLU 7.A O no hydrogen 3.227 N/A ARG 24.A NE GLU 7.A OE1 no hydrogen 3.429 N/A ARG 24.A NH2 GLU 7.A OE1 no hydrogen 3.264 N/A LEU 25.A N PHE 30.A O no hydrogen 3.032 N/A LYS 26.A N ASP 5.A O no hydrogen 2.939 N/A LYS 26.A NZ ASP 4.A O no hydrogen 2.736 N/A HIS 29.A N LEU 25.A O no hydrogen 2.967 N/A PHE 30.A N SER 28.A OG no hydrogen 3.348 N/A VAL 32.A N ALA 23.A O no hydrogen 2.789 N/A ALA 33.A N LEU 83.A O no hydrogen 2.917 N/A LEU 34.A N TYR 21.A O no hydrogen 2.761 N/A LYS 35.A N LEU 81.A O no hydrogen 2.985 N/A VAL 36.A N ASN 19.A O no hydrogen 2.788 N/A LEU 37.A N VAL 79.A O no hydrogen 2.655 N/A LYS 39.A N ARG 77.A O no hydrogen 3.297 N/A LYS 39.A NZ ASP 75.A O no hydrogen 2.904 N/A GLN 41.A N PHE 38.A O no hydrogen 2.979 N/A ILE 42.A N PHE 38.A O no hydrogen 3.047 N/A GLU 43.A N LYS 39.A O no hydrogen 2.861 N/A LYS 44.A N SER 40.A O no hydrogen 2.883 N/A GLU 45.A N GLN 41.A O no hydrogen 3.285 N/A GLU 45.A N ILE 42.A O no hydrogen 3.231 N/A GLY 46.A N GLU 43.A O no hydrogen 3.072 N/A LEU 47.A N ILE 42.A O no hydrogen 2.969 N/A GLU 48.A N GLU 48.A OE1 no hydrogen 2.809 N/A LEU 51.A N LEU 47.A O no hydrogen 2.975 N/A ARG 52.A N GLU 48.A O no hydrogen 3.303 N/A ARG 53.A N HIS 49.A O no hydrogen 3.026 N/A GLU 54.A N GLN 50.A O no hydrogen 2.959 N/A ILE 55.A N LEU 51.A O no hydrogen 2.986 N/A GLU 56.A N ARG 52.A O no hydrogen 2.923 N/A ILE 57.A N ARG 53.A O no hydrogen 2.942 N/A GLN 58.A N GLU 54.A O no hydrogen 2.964 N/A ALA 59.A N ILE 55.A O no hydrogen 2.898 N/A HIS 60.A N GLU 56.A O no hydrogen 3.230 N/A HIS 60.A N ILE 57.A O no hydrogen 3.040 N/A HIS 60.A ND1 GLU 56.A O no hydrogen 3.298 N/A LEU 61.A N GLN 58.A O no hydrogen 3.266 N/A GLN 62.A N TYR 119.A OH no hydrogen 2.872 N/A HIS 63.A NE2 ASP 115.A OD1 no hydrogen 2.880 N/A ASN 65.A N HIS 63.A ND1 no hydrogen 3.043 N/A ASN 65.A ND2 VAL 143.A O no hydrogen 3.121 N/A ILE 66.A N HIS 63.A O no hydrogen 3.179 N/A LEU 67.A N ILE 145.A O no hydrogen 2.954 N/A ARG 68.A N GLU 84.A OE1 no hydrogen 3.122 N/A TYR 70.A N ILE 82.A O no hydrogen 2.722 N/A TYR 72.A N ASN 71.A OD1 no hydrogen 2.976 N/A PHE 73.A N TYR 80.A O no hydrogen 3.068 N/A ASP 75.A N ARG 78.A O no hydrogen 3.049 N/A ARG 77.A N ASP 75.A OD1 no hydrogen 3.117 N/A ARG 78.A NH2 ASP 75.A OD2 no hydrogen 3.441 N/A VAL 79.A N LEU 37.A O no hydrogen 2.654 N/A TYR 80.A N PHE 73.A O no hydrogen 2.881 N/A TYR 80.A OH ASP 75.A OD2 no hydrogen 2.801 N/A LEU 81.A N LYS 35.A O no hydrogen 2.816 N/A ILE 82.A N ASN 71.A O no hydrogen 2.763 N/A LEU 83.A N ALA 33.A O no hydrogen 2.815 N/A GLU 84.A N ARG 68.A O no hydrogen 2.931 N/A ARG 88.A N LEU 137.A O no hydrogen 3.145 N/A ARG 88.A NE PHE 139.A O no hydrogen 3.121 N/A ARG 88.A NH2 PHE 139.A O no hydrogen 3.400 N/A GLY 89.A N ALA 86.A O no hydrogen 3.122 N/A LEU 91.A N LEU 135.A O no hydrogen 3.298 N/A GLU 94.A N GLU 90.A O no hydrogen 3.232 N/A LEU 95.A N LEU 91.A O no hydrogen 2.730 N/A GLN 96.A N TYR 92.A O no hydrogen 2.909 N/A LYS 97.A N LYS 93.A O no hydrogen 3.157 N/A LYS 97.A N GLU 94.A O no hydrogen 3.308 N/A LYS 97.A NZ GLU 94.A OE1 no hydrogen 3.131 N/A SER 98.A OG LYS 100.A O no hydrogen 3.199 N/A LEU 101.A N LEU 194.A O no hydrogen 2.785 N/A GLN 104.A N ASP 102.A OD2 no hydrogen 3.116 N/A ARG 105.A N ASP 102.A OD2 no hydrogen 3.192 N/A ARG 105.A NH2 GLU 94.A OE2 no hydrogen 2.261 N/A THR 106.A N ASP 102.A O no hydrogen 2.955 N/A THR 106.A OG1 ASP 102.A O no hydrogen 3.101 N/A ALA 107.A N GLU 103.A O no hydrogen 2.834 N/A THR 108.A N GLN 104.A O no hydrogen 3.149 N/A THR 108.A OG1 GLN 104.A O no hydrogen 2.567 N/A ILE 109.A N ARG 105.A O no hydrogen 3.155 N/A ILE 110.A N THR 106.A O no hydrogen 2.869 N/A GLU 111.A N ALA 107.A O no hydrogen 2.992 N/A GLU 112.A N THR 108.A O no hydrogen 3.129 N/A LEU 113.A N ILE 109.A O no hydrogen 2.881 N/A ALA 114.A N ILE 110.A O no hydrogen 2.896 N/A ASP 115.A N GLU 111.A O no hydrogen 3.056 N/A ALA 116.A N GLU 112.A O no hydrogen 3.000 N/A LEU 117.A N LEU 113.A O no hydrogen 2.875 N/A THR 118.A N ALA 114.A O no hydrogen 3.012 N/A THR 118.A OG1 ALA 114.A O no hydrogen 2.671 N/A TYR 119.A N ASP 115.A O no hydrogen 3.154 N/A CYS 120.A N ALA 116.A O no hydrogen 2.900 N/A CYS 120.A SG ALA 116.A O no hydrogen 3.389 N/A HIS 121.A N LEU 117.A O no hydrogen 2.815 N/A HIS 121.A NE2 ASP 183.A OD2 no hydrogen 2.695 N/A ASP 122.A N THR 118.A O no hydrogen 3.065 N/A LYS 123.A N CYS 120.A O no hydrogen 2.954 N/A LYS 123.A NZ HIS 60.A O no hydrogen 2.642 N/A LYS 123.A NZ TYR 119.A OH no hydrogen 3.224 N/A LYS 124.A N HIS 121.A O no hydrogen 2.977 N/A VAL 125.A N CYS 120.A O no hydrogen 2.888 N/A ILE 126.A N VAL 152.A O no hydrogen 3.021 N/A HIS 127.A N ASP 183.A OD2 no hydrogen 3.011 N/A HIS 127.A NE2 ASP 147.A O no hydrogen 2.730 N/A ARG 128.A N ASP 183.A OD1 no hydrogen 3.000 N/A ARG 128.A NE TRP 150.A O no hydrogen 2.811 N/A ARG 128.A NH1 TRP 150.A O no hydrogen 3.153 N/A ARG 128.A NH2 TYR 178.A OH no hydrogen 2.730 N/A ASP 129.A N HIS 127.A ND1 no hydrogen 3.079 N/A LYS 131.A NZ THR 164.A OG1 no hydrogen 2.794 N/A ASN 134.A N LYS 131.A O no hydrogen 2.943 N/A ASN 134.A ND2 ASP 129.A O no hydrogen 2.662 N/A ASN 134.A ND2 ASP 129.A OD2 no hydrogen 2.853 N/A LEU 135.A N PRO 132.A O no hydrogen 3.193 N/A LEU 136.A N LYS 144.A O no hydrogen 2.782 N/A LEU 137.A N GLY 89.A O no hydrogen 2.735 N/A GLY 138.A N GLU 142.A O no hydrogen 2.791 N/A ARG 140.A N GLU 142.A OE1 no hydrogen 2.739 N/A GLY 141.A N GLY 138.A O no hydrogen 2.955 N/A GLU 142.A N GLU 142.A OE1 no hydrogen 2.746 N/A VAL 143.A N GLU 112.A OE1 no hydrogen 3.304 N/A LYS 144.A N LEU 136.A O no hydrogen 2.763 N/A LYS 144.A NZ PRO 64.A O no hydrogen 2.755 N/A LYS 144.A NZ GLU 84.A OE2 no hydrogen 2.741 N/A ILE 145.A N ASN 65.A O no hydrogen 2.851 N/A ALA 146.A N ASN 134.A O no hydrogen 2.848 N/A GLY 149.A N ASP 147.A OD1 no hydrogen 2.895 N/A SER 151.A N PHE 148.A O no hydrogen 3.218 N/A SER 151.A OG HIS 127.A O no hydrogen 3.271 N/A VAL 152.A N ILE 126.A O no hydrogen 3.037 N/A THR 154.A N LYS 124.A O no hydrogen 2.873 N/A SER 156.A OG THR 154.A OG1 no hydrogen 3.340 N/A LEU 157.A N THR 154.A O no hydrogen 2.986 N/A ARG 159.A N TYR 178.A O no hydrogen 2.978 N/A CYS 162.A SG TYR 178.A OH no hydrogen 3.715 N/A THR 164.A OG1 ASP 129.A OD1 no hydrogen 2.825 N/A TYR 167.A N THR 164.A O no hydrogen 2.768 N/A TYR 167.A OH GLU 193.A OE1 no hydrogen 2.349 N/A LEU 168.A N LEU 165.A O no hydrogen 3.330 N/A GLU 171.A N GLU 171.A OE1 no hydrogen 2.967 N/A MET 172.A N PRO 169.A O no hydrogen 3.187 N/A ILE 173.A N PRO 169.A O no hydrogen 3.405 N/A GLU 174.A N PRO 170.A O no hydrogen 2.977 N/A GLY 175.A N MET 172.A O no hydrogen 3.045 N/A ARG 176.A N GLU 171.A O no hydrogen 3.012 N/A ARG 176.A NE GLU 174.A OE1 no hydrogen 2.781 N/A ARG 176.A NH2 GLU 174.A OE1 no hydrogen 3.371 N/A TYR 178.A N ARG 159.A O no hydrogen 2.907 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.933 N/A LYS 181.A N ASP 179.A OD1 no hydrogen 3.073 N/A LYS 181.A NZ ASP 179.A OD2 no hydrogen 2.869 N/A LYS 181.A NZ GLU 180.A OE2 no hydrogen 2.842 N/A VAL 182.A N ASP 179.A O no hydrogen 3.396 N/A ASP 183.A N GLU 180.A O no hydrogen 3.023 N/A LEU 184.A N LYS 181.A O no hydrogen 3.212 N/A TRP 185.A N LYS 181.A O no hydrogen 3.400 N/A CYS 186.A N VAL 182.A O no hydrogen 3.339 N/A CYS 186.A SG TYR 167.A O no hydrogen 3.198 N/A CYS 186.A SG VAL 182.A O no hydrogen 3.591 N/A ILE 187.A N ASP 183.A O no hydrogen 3.112 N/A GLY 188.A N LEU 184.A O no hydrogen 3.279 N/A VAL 189.A N TRP 185.A O no hydrogen 3.127 N/A LEU 190.A N CYS 186.A O no hydrogen 2.867 N/A CYS 191.A N ILE 187.A O no hydrogen 2.943 N/A TYR 192.A N GLY 188.A O no hydrogen 3.203 N/A TYR 192.A OH ARG 219.A O no hydrogen 2.628 N/A GLU 193.A N VAL 189.A O no hydrogen 2.997 N/A LEU 194.A N LEU 190.A O no hydrogen 2.975 N/A LEU 195.A N CYS 191.A O no hydrogen 3.346 N/A VAL 196.A N TYR 192.A O no hydrogen 2.902 N/A GLY 197.A N GLU 193.A O no hydrogen 2.856 N/A SER 203.A OG THR 209.A OG1 no hydrogen 2.869 N/A SER 205.A N SER 203.A OG no hydrogen 3.420 N/A GLU 208.A N SER 205.A OG no hydrogen 3.301 N/A THR 209.A N SER 205.A O no hydrogen 3.141 N/A THR 209.A OG1 PHE 201.A O no hydrogen 3.293 N/A THR 209.A OG1 SER 203.A OG no hydrogen 2.869 N/A THR 209.A OG1 SER 205.A O no hydrogen 3.196 N/A TYR 210.A N HIS 206.A O no hydrogen 2.935 N/A ARG 211.A N SER 207.A O no hydrogen 3.328 N/A ARG 211.A NE GLU 208.A OE1 no hydrogen 2.976 N/A ARG 211.A NH2 GLU 208.A OE1 no hydrogen 3.370 N/A ARG 212.A N GLU 208.A O no hydrogen 3.020 N/A ARG 212.A NE ASP 217.A OD2 no hydrogen 2.674 N/A ARG 212.A NH1 GLU 202.A O no hydrogen 2.875 N/A ARG 212.A NH2 ASP 217.A O no hydrogen 2.906 N/A ARG 212.A NH2 ASP 217.A OD2 no hydrogen 3.355 N/A ILE 213.A N THR 209.A O no hydrogen 2.961 N/A LEU 214.A N TYR 210.A O no hydrogen 3.053 N/A LYS 215.A N ARG 211.A O no hydrogen 3.161 N/A VAL 216.A N ILE 213.A O no hydrogen 3.002 N/A ASP 217.A N ARG 212.A O no hydrogen 2.923 N/A VAL 218.A N VAL 216.A O no hydrogen 2.888 N/A MET 224.A N PRO 221.A O no hydrogen 3.077 N/A ARG 229.A N PRO 225.A O no hydrogen 3.101 N/A ASP 230.A N LEU 226.A O no hydrogen 3.132 N/A LEU 231.A N GLY 227.A O no hydrogen 3.076 N/A ILE 232.A N ALA 228.A O no hydrogen 2.912 N/A SER 233.A N ARG 229.A O no hydrogen 3.021 N/A SER 233.A OG.A ARG 229.A O no hydrogen 2.735 N/A SER 233.A OG.B ARG 229.A O no hydrogen 2.871 N/A SER 233.A OG.B ASP 230.A O no hydrogen 2.751 N/A ARG 234.A N ASP 230.A O no hydrogen 3.130 N/A ARG 234.A N LEU 231.A O no hydrogen 3.159 N/A ARG 234.A NH1 ASP 230.A OD2 no hydrogen 3.052 N/A LEU 235.A N LEU 231.A O no hydrogen 3.079 N/A LEU 235.A N ILE 232.A O no hydrogen 3.024 N/A LEU 236.A N ILE 232.A O no hydrogen 2.785 N/A ARG 237.A N LEU 235.A O no hydrogen 2.916 N/A TYR 238.A OH GLU 174.A OE2 no hydrogen 2.555 N/A GLU 242.A N GLN 239.A O no hydrogen 2.981 N/A ARG 243.A N PRO 240.A O no hydrogen 3.223 N/A ARG 243.A NE ARG 237.A O no hydrogen 2.815 N/A ARG 243.A NH1 GLU 171.A OE1 no hydrogen 3.214 N/A ARG 243.A NH1 GLU 171.A OE2 no hydrogen 2.790 N/A ARG 243.A NH1 LYS 181.A O no hydrogen 3.035 N/A ARG 243.A NH2 GLU 171.A OE1 no hydrogen 2.725 N/A ARG 243.A NH2 ARG 237.A O no hydrogen 2.928 N/A LEU 244.A N ARG 234.A O no hydrogen 2.902 N/A GLN 248.A N PRO 245.A O no hydrogen 2.973 N/A ILE 249.A N PRO 245.A O no hydrogen 2.928 N/A LEU 250.A N LEU 246.A O no hydrogen 3.118 N/A HIS 252.A N ILE 249.A O no hydrogen 3.031 N/A HIS 252.A NE2 ASP 230.A OD2 no hydrogen 2.763 N/A TRP 254.A N HIS 252.A ND1 no hydrogen 3.166 N/A TRP 254.A NE1 GLU 103.A OE1 no hydrogen 2.904 N/A GLN 256.A N HIS 252.A O no hydrogen 2.919 N/A ALA 257.A N PRO 253.A O no hydrogen 2.935 N/A HIS 258.A N TRP 254.A O no hydrogen 3.181 N/A SER 259.A N VAL 255.A O no hydrogen 2.947 N/A SER 259.A OG GLU 111.A OE1 no hydrogen 2.479 N/A ARG 260.A N THR 108.A OG1 no hydrogen 2.975 N/A ARG 260.A NH1 ALA 257.A O no hydrogen 3.016 N/A ARG 260.A NH1 SER 259.A O no hydrogen 2.975 N/A ARG 260.A NH2 ALA 257.A O no hydrogen 3.439 N/A ARG 261.A NH1 ASP 115.A OD2 no hydrogen 3.093 N/A ARG 261.A NH2 ASN 65.A OD1 no hydrogen 2.955 N/A