Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1p6d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 1.A N HIS 14.A NE2 no hydrogen 3.500 N/A TRP 1.A N ASP 122.A OD1 no hydrogen 3.123 N/A TRP 1.A N GLU 146.A OE2 no hydrogen 2.861 N/A TRP 1.A NE1 GLY 121.A O no hydrogen 2.852 N/A SER 2.A OG VAL 11.A O no hydrogen 3.421 N/A SER 2.A OG SER 13.A OG no hydrogen 3.365 N/A SER 2.A OG ASP 150.A OD1 no hydrogen 3.107 N/A SER 2.A OG ASP 150.A OD2 no hydrogen 2.535 N/A ALA 3.A N GLU 4.A OE1 no hydrogen 3.315 N/A GLU 4.A N VAL 11.A O no hydrogen 2.969 N/A HIS 7.A N ASP 5.A OD1 no hydrogen 2.935 N/A HIS 7.A ND1 GLU 48.A OE1 no hydrogen 2.385 N/A LYS 8.A N ASP 5.A OD1 no hydrogen 3.255 N/A LYS 8.A NZ ASP 5.A OD2 no hydrogen 2.933 N/A ASN 12.A N GLU 9.A O no hydrogen 3.112 N/A ASN 12.A ND2 ASP 5.A O no hydrogen 2.629 N/A SER 13.A N SER 2.A OG no hydrogen 2.968 N/A SER 13.A OG SER 2.A OG no hydrogen 3.365 N/A SER 13.A OG ASP 150.A OD1 no hydrogen 2.697 N/A HIS 14.A N SER 2.A O no hydrogen 3.079 N/A LEU 15.A N ASN 12.A OD1 no hydrogen 2.765 N/A TRP 16.A N ASN 12.A O no hydrogen 3.092 N/A TRP 16.A NE1 ASP 154.A OD1 no hydrogen 3.040 N/A ILE 17.A N SER 13.A O no hydrogen 2.897 N/A VAL 18.A N HIS 14.A O no hydrogen 3.197 N/A ASN 19.A N LEU 15.A O no hydrogen 2.860 N/A ARG 20.A N TRP 16.A O no hydrogen 2.907 N/A ARG 20.A NE ASP 23.A OD2 no hydrogen 3.044 N/A ARG 20.A NH1 GLU 9.A OE1 no hydrogen 3.378 N/A ARG 20.A NH1 GLU 9.A OE2 no hydrogen 2.857 N/A ARG 20.A NH2 ASP 23.A OD2 no hydrogen 2.770 N/A ALA 21.A N ILE 17.A O no hydrogen 2.979 N/A ILE 22.A N VAL 18.A O no hydrogen 2.895 N/A ASP 23.A N ASN 19.A O no hydrogen 2.958 N/A ILE 24.A N ARG 20.A O no hydrogen 2.990 N/A MET 25.A N ALA 21.A O no hydrogen 3.075 N/A SER 26.A N ILE 22.A O no hydrogen 2.860 N/A SER 26.A OG ILE 22.A O no hydrogen 3.256 N/A ARG 27.A N ASP 23.A O no hydrogen 2.847 N/A ASN 28.A N ILE 24.A O no hydrogen 3.076 N/A ASN 28.A N MET 25.A O no hydrogen 3.193 N/A ASN 28.A ND2 GLY 161.A O no hydrogen 2.935 N/A THR 30.A N ASN 28.A OD1 no hydrogen 3.163 N/A THR 30.A OG1 ASN 28.A OD1 no hydrogen 3.563 N/A LEU 31.A N ASN 28.A OD1 no hydrogen 2.690 N/A VAL 32.A N ASN 28.A OD1 no hydrogen 3.173 N/A ARG 36.A N LYS 33.A O no hydrogen 2.968 N/A ARG 36.A NH1 ASP 240.A OD1 no hydrogen 2.766 N/A ARG 36.A NH2 ASP 240.A OD1 no hydrogen 2.877 N/A VAL 37.A N GLN 34.A O no hydrogen 2.965 N/A ALA 38.A N GLN 34.A O no hydrogen 3.097 N/A GLN 39.A N ASP 35.A O no hydrogen 3.014 N/A GLN 39.A NE2 TYR 101.A OH no hydrogen 2.483 N/A LEU 40.A N ARG 36.A O no hydrogen 3.199 N/A ASN 41.A N VAL 37.A O no hydrogen 3.090 N/A GLU 42.A N ALA 38.A O no hydrogen 2.886 N/A TRP 43.A N GLN 39.A O no hydrogen 3.032 N/A ARG 44.A N ASN 41.A O no hydrogen 3.454 N/A ARG 44.A NH1 GLU 48.A OE2 no hydrogen 3.033 N/A LEU 47.A N TRP 43.A O no hydrogen 3.039 N/A GLU 48.A N ARG 44.A O no hydrogen 2.774 N/A ASN 49.A N THR 45.A O no hydrogen 2.989 N/A GLY 50.A N GLU 46.A O no hydrogen 3.028 N/A ILE 51.A N LEU 47.A O no hydrogen 3.045 N/A TYR 52.A N GLU 48.A O no hydrogen 3.023 N/A ALA 53.A N ASN 49.A O no hydrogen 2.819 N/A ASN 55.A N TYR 52.A O no hydrogen 3.166 N/A TYR 56.A N ALA 53.A O no hydrogen 3.029 N/A TYR 56.A OH ALA 3.A O no hydrogen 3.269 N/A GLU 57.A N ALA 53.A O no hydrogen 3.302 N/A TYR 61.A N GLU 57.A O no hydrogen 3.000 N/A ASP 62.A N PRO 59.A O no hydrogen 3.097 N/A ASN 63.A ND2 ASN 58.A OD1 no hydrogen 2.686 N/A THR 65.A N TYR 61.A O no hydrogen 3.149 N/A THR 65.A N ASP 62.A O no hydrogen 3.103 N/A THR 65.A OG1 ASP 62.A O no hydrogen 2.733 N/A PHE 66.A N TYR 61.A O no hydrogen 2.938 N/A ALA 67.A N THR 65.A OG1 no hydrogen 3.408 N/A SER 68.A N ASP 62.A OD2 no hydrogen 2.896 N/A SER 68.A OG ASP 62.A OD2 no hydrogen 2.616 N/A SER 68.A OG TYR 119.A OH no hydrogen 3.395 N/A HIS 69.A N PHE 66.A O no hydrogen 2.978 N/A HIS 69.A ND1 ASP 122.A OD2 no hydrogen 3.090 N/A HIS 69.A NE2 TYR 60.A O no hydrogen 2.826 N/A PHE 70.A N ALA 67.A O no hydrogen 3.367 N/A TYR 71.A N HIS 128.A O no hydrogen 3.055 N/A TYR 71.A OH HIS 177.A ND1 no hydrogen 2.702 N/A ASP 72.A N LYS 77.A O no hydrogen 2.920 N/A ASP 74.A N ASP 72.A OD1 no hydrogen 2.896 N/A ASN 75.A N ASP 72.A O no hydrogen 3.264 N/A GLY 76.A N ASP 72.A O no hydrogen 2.668 N/A LYS 77.A N ASN 75.A OD1 no hydrogen 3.049 N/A THR 78.A OG1 ALA 67.A O no hydrogen 2.524 N/A TYR 79.A N THR 78.A OG1 no hydrogen 2.618 N/A TYR 79.A OH THR 65.A O no hydrogen 2.557 N/A ALA 83.A N ILE 80.A O no hydrogen 3.186 N/A GLN 85.A N GLU 88.A OE2 no hydrogen 2.855 N/A GLN 85.A NE2 GLY 76.A O no hydrogen 3.508 N/A ALA 86.A N PHE 70.A O no hydrogen 2.972 N/A LYS 87.A NZ GLU 173.A OE2 no hydrogen 3.022 N/A GLU 88.A N GLN 85.A OE1 no hydrogen 2.824 N/A THR 89.A N GLN 85.A O no hydrogen 3.103 N/A THR 89.A OG1 GLN 85.A O no hydrogen 2.812 N/A GLY 90.A N ALA 86.A O no hydrogen 2.783 N/A ALA 91.A N LYS 87.A O no hydrogen 3.142 N/A LYS 92.A N GLU 88.A O no hydrogen 2.999 N/A TYR 93.A N THR 89.A O no hydrogen 3.259 N/A PHE 94.A N GLY 90.A O no hydrogen 3.150 N/A LYS 95.A N ALA 91.A O no hydrogen 3.081 N/A LEU 96.A N LYS 92.A O no hydrogen 3.006 N/A ALA 97.A N TYR 93.A O no hydrogen 2.951 N/A GLY 98.A N PHE 94.A O no hydrogen 3.149 N/A GLU 99.A N LYS 95.A O no hydrogen 2.998 N/A SER 100.A N LEU 96.A O no hydrogen 3.120 N/A SER 100.A OG LEU 96.A O no hydrogen 3.386 N/A TYR 101.A N ALA 97.A O no hydrogen 2.930 N/A LYS 102.A N GLY 98.A O no hydrogen 2.944 N/A ASN 103.A N GLU 99.A O no hydrogen 3.109 N/A ASN 103.A N SER 100.A O no hydrogen 3.083 N/A LYS 104.A N TYR 101.A O no hydrogen 2.900 N/A ASP 105.A N SER 100.A O no hydrogen 2.905 N/A LYS 107.A NZ GLU 46.A OE2 no hydrogen 3.188 N/A GLN 108.A N ASP 105.A OD1 no hydrogen 3.217 N/A ALA 109.A N ASP 105.A O no hydrogen 2.933 N/A PHE 110.A N MET 106.A O no hydrogen 2.989 N/A PHE 111.A N LYS 107.A O no hydrogen 3.240 N/A TYR 112.A N GLN 108.A O no hydrogen 3.106 N/A LEU 113.A N ALA 109.A O no hydrogen 2.970 N/A GLY 114.A N PHE 110.A O no hydrogen 3.010 N/A LEU 115.A N PHE 111.A O no hydrogen 3.143 N/A SER 116.A N TYR 112.A O no hydrogen 2.980 N/A SER 116.A OG GLY 90.A O no hydrogen 2.775 N/A SER 116.A OG TYR 234.A OH no hydrogen 2.838 N/A LEU 117.A N LEU 113.A O no hydrogen 2.805 N/A HIS 118.A N GLY 114.A O no hydrogen 3.045 N/A HIS 118.A ND1 ILE 51.A O no hydrogen 2.822 N/A TYR 119.A N LEU 115.A O no hydrogen 3.246 N/A TYR 119.A OH TYR 60.A O no hydrogen 2.860 N/A TYR 119.A OH SER 68.A OG no hydrogen 3.395 N/A LEU 120.A N SER 116.A O no hydrogen 3.065 N/A GLY 121.A N LEU 117.A O no hydrogen 2.830 N/A ASP 122.A N HIS 118.A O no hydrogen 2.896 N/A VAL 123.A N TYR 119.A O no hydrogen 3.322 N/A ASN 124.A N GLY 121.A O no hydrogen 3.071 N/A GLN 125.A N ASP 122.A O no hydrogen 2.881 N/A HIS 128.A N GLN 125.A O no hydrogen 2.867 N/A HIS 128.A ND1 HIS 69.A O no hydrogen 2.734 N/A ALA 129.A N GLN 125.A O no hydrogen 3.342 N/A ALA 129.A N PRO 126.A O no hydrogen 2.997 N/A ALA 130.A N MET 127.A O no hydrogen 3.227 N/A PHE 132.A N MET 127.A O no hydrogen 2.886 N/A THR 133.A N SER 136.A OG no hydrogen 2.949 N/A ASN 134.A ND2 SER 143.A OG no hydrogen 3.253 N/A LEU 135.A N THR 133.A OG1 no hydrogen 2.982 N/A SER 136.A N THR 133.A O no hydrogen 3.050 N/A GLY 140.A N ASN 134.A O no hydrogen 2.908 N/A PHE 141.A N PRO 138.A O no hydrogen 3.129 N/A HIS 142.A ND1 PHE 132.A O no hydrogen 2.781 N/A SER 143.A OG GLY 140.A O no hydrogen 3.405 N/A LYS 144.A N GLY 140.A O no hydrogen 3.224 N/A TYR 145.A N PHE 141.A O no hydrogen 2.918 N/A TYR 145.A OH THR 220.A OG1 no hydrogen 2.785 N/A GLU 146.A N HIS 142.A O no hydrogen 3.175 N/A ASN 147.A N SER 143.A O no hydrogen 2.970 N/A PHE 148.A N LYS 144.A O no hydrogen 2.974 N/A VAL 149.A N TYR 145.A O no hydrogen 2.999 N/A ASP 150.A N ASN 147.A O no hydrogen 3.290 N/A THR 151.A N PHE 148.A O no hydrogen 2.936 N/A THR 151.A OG1 PHE 148.A O no hydrogen 2.592 N/A ILE 152.A N VAL 149.A O no hydrogen 3.126 N/A LYS 153.A N VAL 149.A O no hydrogen 2.885 N/A LYS 153.A NZ GLU 9.A O no hydrogen 2.859 N/A LYS 153.A NZ GLY 10.A O no hydrogen 3.188 N/A LYS 153.A NZ ASP 150.A O no hydrogen 3.220 N/A LYS 153.A NZ ASP 150.A OD1 no hydrogen 2.747 N/A ASN 155.A N ILE 152.A O no hydrogen 3.053 N/A ASN 155.A ND2 ILE 152.A O no hydrogen 3.386 N/A TYR 156.A N LYS 153.A O no hydrogen 2.858 N/A ASN 162.A N ASP 160.A OD1 no hydrogen 2.820 N/A TYR 164.A N ARG 229.A O no hydrogen 2.978 N/A TYR 164.A OH ASP 226.A OD1 no hydrogen 3.206 N/A TRP 167.A N TYR 164.A O no hydrogen 3.250 N/A GLU 174.A N ASN 171.A O no hydrogen 2.914 N/A TRP 175.A N PRO 172.A O no hydrogen 3.008 N/A TRP 175.A NE1 GLY 169.A O no hydrogen 2.789 N/A ILE 176.A N PRO 172.A O no hydrogen 3.149 N/A HIS 177.A N GLU 173.A O no hydrogen 2.944 N/A HIS 177.A ND1 TYR 71.A OH no hydrogen 2.702 N/A GLY 178.A N GLU 174.A O no hydrogen 2.877 N/A ALA 179.A N TRP 175.A O no hydrogen 2.988 N/A ALA 180.A N ILE 176.A O no hydrogen 3.058 N/A VAL 181.A N HIS 177.A O no hydrogen 2.946 N/A VAL 182.A N GLY 178.A O no hydrogen 3.341 N/A ALA 183.A N ALA 179.A O no hydrogen 2.964 N/A LYS 184.A N ALA 180.A O no hydrogen 2.811 N/A LYS 184.A NZ ASP 72.A OD1 no hydrogen 2.751 N/A LYS 184.A NZ ASP 72.A OD2 no hydrogen 3.048 N/A LYS 184.A NZ ASP 74.A OD2 no hydrogen 2.470 N/A GLN 185.A N VAL 181.A O no hydrogen 3.315 N/A ASP 186.A N ALA 183.A O no hydrogen 3.070 N/A TYR 187.A N LYS 184.A O no hydrogen 3.077 N/A GLY 189.A N ASP 186.A O no hydrogen 3.082 N/A ILE 190.A N TYR 187.A O no hydrogen 2.974 N/A VAL 191.A N TYR 187.A O no hydrogen 2.898 N/A ASN 192.A N THR 195.A OG1 no hydrogen 3.094 N/A THR 195.A OG1 ILE 190.A O no hydrogen 2.833 N/A THR 195.A OG1 ASN 192.A O no hydrogen 3.214 N/A LYS 196.A N ASN 192.A O no hydrogen 2.932 N/A ASP 197.A N ASP 193.A O no hydrogen 2.902 N/A TRP 198.A N ASN 194.A O no hydrogen 2.882 N/A PHE 199.A N THR 195.A O no hydrogen 2.927 N/A VAL 200.A N LYS 196.A O no hydrogen 3.200 N/A LYS 201.A N ASP 197.A O no hydrogen 3.097 N/A LYS 201.A NZ ASP 197.A OD2 no hydrogen 3.153 N/A ALA 203.A N VAL 200.A O no hydrogen 3.242 N/A VAL 204.A N LYS 201.A O no hydrogen 3.215 N/A SER 205.A N LYS 201.A O no hydrogen 2.977 N/A TYR 208.A N SER 205.A O no hydrogen 2.845 N/A ALA 209.A N SER 205.A O no hydrogen 3.207 N/A ASP 210.A N GLN 206.A O no hydrogen 3.124 N/A LYS 211.A N GLU 207.A O no hydrogen 3.365 N/A TRP 212.A N TYR 208.A O no hydrogen 3.216 N/A ARG 213.A N ALA 209.A O no hydrogen 3.427 N/A ARG 213.A NH1 ALA 209.A O no hydrogen 2.886 N/A ALA 214.A N ASP 210.A O no hydrogen 3.046 N/A GLU 215.A N LYS 211.A O no hydrogen 2.991 N/A VAL 216.A N TRP 212.A O no hydrogen 3.090 N/A THR 217.A N ALA 214.A O no hydrogen 3.226 N/A THR 217.A OG1 ARG 213.A O no hydrogen 2.727 N/A THR 220.A N VAL 216.A O no hydrogen 3.068 N/A THR 220.A OG1 TYR 145.A OH no hydrogen 2.785 N/A THR 220.A OG1 VAL 216.A O no hydrogen 2.664 N/A GLY 221.A N THR 217.A O no hydrogen 2.886 N/A LYS 222.A N PRO 218.A O no hydrogen 3.180 N/A LYS 222.A NZ ASP 186.A OD2 no hydrogen 3.186 N/A LYS 222.A NZ ASP 226.A OD2 no hydrogen 2.982 N/A ARG 223.A N MET 219.A O no hydrogen 2.894 N/A ARG 223.A NE ASP 186.A OD2 no hydrogen 2.931 N/A ARG 223.A NH1 ASN 124.A O no hydrogen 3.067 N/A LEU 224.A N THR 220.A O no hydrogen 2.863 N/A MET 225.A N GLY 221.A O no hydrogen 3.056 N/A ASP 226.A N LYS 222.A O no hydrogen 3.023 N/A ALA 227.A N ARG 223.A O no hydrogen 2.882 N/A GLN 228.A N LEU 224.A O no hydrogen 3.091 N/A ARG 229.A N MET 225.A O no hydrogen 3.179 N/A ARG 229.A NH1 ASP 160.A OD1 no hydrogen 2.939 N/A ARG 229.A NH1 ASP 160.A OD2 no hydrogen 3.508 N/A ARG 229.A NH1 ASN 162.A O no hydrogen 2.761 N/A ARG 229.A NH2 ASP 160.A OD2 no hydrogen 3.315 N/A VAL 230.A N ASP 226.A O no hydrogen 2.889 N/A THR 231.A N ALA 227.A O no hydrogen 3.017 N/A THR 231.A OG1 ALA 227.A O no hydrogen 2.759 N/A ALA 232.A N GLN 228.A O no hydrogen 3.035 N/A GLY 233.A N ARG 229.A O no hydrogen 3.231 N/A TYR 234.A N VAL 230.A O no hydrogen 2.916 N/A TYR 234.A OH SER 116.A OG no hydrogen 2.838 N/A ILE 235.A N THR 231.A O no hydrogen 2.975 N/A GLN 236.A N ALA 232.A O no hydrogen 3.047 N/A LEU 237.A N GLY 233.A O no hydrogen 2.910 N/A TRP 238.A N TYR 234.A O no hydrogen 3.002 N/A PHE 239.A N ILE 235.A O no hydrogen 3.110 N/A ASP 240.A N GLN 236.A O no hydrogen 2.962 N/A THR 241.A N LEU 237.A O no hydrogen 2.865 N/A THR 241.A OG1 LEU 237.A O no hydrogen 2.801 N/A TYR 242.A N TRP 238.A O no hydrogen 2.922 N/A GLY 243.A N PHE 239.A O no hydrogen 2.595 N/A