Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1up3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A ND2 ASP 254.A O no hydrogen 2.887 N/A LEU 4.A N ASN 2.A OD1 no hydrogen 2.942 N/A ALA 5.A N ASN 2.A O no hydrogen 3.385 N/A TYR 10.A N MET 69.A O no hydrogen 2.909 N/A ALA 14.A N ASP 12.A OD1 no hydrogen 2.924 N/A MET 18.A N SER 15.A OG no hydrogen 2.951 N/A VAL 19.A N SER 15.A O no hydrogen 2.986 N/A ALA 20.A N ALA 16.A O no hydrogen 2.873 N/A ALA 21.A N ALA 17.A O no hydrogen 2.877 N/A ARG 22.A N MET 18.A O no hydrogen 2.946 N/A ASN 23.A N VAL 19.A O no hydrogen 3.053 N/A ASN 23.A N ALA 20.A O no hydrogen 3.239 N/A ALA 24.A N ALA 20.A O no hydrogen 2.982 N/A LEU 31.A N ASN 28.A OD1 no hydrogen 2.884 N/A THR 32.A N ASN 28.A O no hydrogen 3.006 N/A THR 32.A OG1 ASN 28.A O no hydrogen 3.175 N/A SER 33.A N ALA 29.A O no hydrogen 3.000 N/A VAL 34.A N GLU 30.A O no hydrogen 3.166 N/A ALA 35.A N LEU 31.A O no hydrogen 2.864 N/A ASN 36.A N THR 32.A O no hydrogen 3.110 N/A THR 37.A N VAL 34.A O no hydrogen 3.131 N/A THR 37.A OG1 SER 33.A O no hydrogen 2.815 N/A GLN 39.A NE2 THR 37.A O no hydrogen 3.089 N/A SER 40.A N.B TRP 258.A O no hydrogen 3.135 N/A SER 40.A OG THR 73.A OG1 no hydrogen 2.827 N/A SER 40.A OG ILE 259.A O no hydrogen 2.742 N/A TYR 41.A N VAL 71.A O no hydrogen 2.875 N/A TRP 42.A NE1 ILE 259.A O no hydrogen 2.866 N/A LEU 43.A N THR 73.A O no hydrogen 2.845 N/A ALA 46.A N ASP 44.A OD1 no hydrogen 3.104 N/A PHE 47.A N ASP 44.A O no hydrogen 3.001 N/A THR 51.A N PRO 48.A O no hydrogen 3.035 N/A VAL 52.A N PRO 48.A O no hydrogen 2.919 N/A THR 55.A N THR 51.A O no hydrogen 3.344 N/A THR 55.A OG1 THR 51.A O no hydrogen 3.558 N/A VAL 56.A N VAL 52.A O no hydrogen 2.865 N/A ALA 57.A N GLY 53.A O no hydrogen 2.869 N/A ARG 58.A N GLY 54.A O no hydrogen 2.980 N/A TYR 59.A N THR 55.A O no hydrogen 3.075 N/A THR 60.A N VAL 56.A O no hydrogen 2.920 N/A THR 60.A OG1 VAL 56.A O no hydrogen 3.104 N/A THR 60.A OG1 ALA 57.A O no hydrogen 3.460 N/A THR 60.A OG1 SER 110.A OG.B no hydrogen 3.207 N/A GLY 61.A N ALA 57.A O no hydrogen 2.896 N/A ALA 62.A N ARG 58.A O no hydrogen 2.897 N/A ALA 63.A N TYR 59.A O no hydrogen 2.978 N/A GLN 64.A N THR 60.A O no hydrogen 2.976 N/A ALA 65.A N GLY 61.A O no hydrogen 2.956 N/A ALA 66.A N ALA 62.A O no hydrogen 3.082 N/A ALA 66.A N ALA 63.A O no hydrogen 2.975 N/A GLY 67.A N GLN 64.A O no hydrogen 3.039 N/A ALA 68.A N ALA 63.A O no hydrogen 2.983 N/A MET 69.A N PRO 8.A O no hydrogen 2.834 N/A LEU 72.A N THR 113.A O no hydrogen 2.841 N/A THR 73.A N TYR 41.A O no hydrogen 2.864 N/A THR 73.A OG1 SER 40.A OG no hydrogen 2.827 N/A LEU 74.A N ILE 115.A O no hydrogen 2.865 N/A TYR 75.A N LEU 43.A O no hydrogen 2.838 N/A GLY 76.A N GLU 117.A OE2 no hydrogen 2.870 N/A ILE 77.A N GLU 117.A OE1 no hydrogen 3.087 N/A ARG 80.A NE ALA 86.A O no hydrogen 2.844 N/A ARG 80.A NH1 ASP 44.A OD2 no hydrogen 2.954 N/A ARG 80.A NH1 TYR 75.A O no hydrogen 2.840 N/A ARG 80.A NH2 ALA 86.A O no hydrogen 3.161 N/A ARG 80.A NH2 SER 87.A O no hydrogen 3.181 N/A CYS 82.A N HIS 79.A O no hydrogen 2.934 N/A CYS 82.A SG MET 123.A O no hydrogen 3.697 N/A GLY 83.A N ARG 80.A O no hydrogen 3.336 N/A SER 84.A N ASP 81.A O no hydrogen 3.034 N/A TYR 85.A N SER 84.A OG no hydrogen 2.725 N/A ALA 86.A N ASP 81.A OD2 no hydrogen 2.898 N/A SER 87.A N SER 84.A O no hydrogen 2.903 N/A GLY 89.A N GLN 45.A OE1 no hydrogen 2.807 N/A PHE 90.A N GLY 76.A O no hydrogen 2.940 N/A THR 92.A OG1 ASP 95.A OD2 no hydrogen 3.023 N/A ASP 95.A N THR 92.A OG1 no hydrogen 3.248 N/A TYR 96.A N THR 92.A O no hydrogen 3.037 N/A TYR 96.A OH GLU 117.A OE2 no hydrogen 2.636 N/A ARG 97.A N GLY 93.A O no hydrogen 2.852 N/A GLY 98.A N THR 94.A O no hydrogen 3.120 N/A TRP 99.A N ASP 95.A O no hydrogen 2.998 N/A TRP 99.A NE1 PHE 47.A O no hydrogen 2.837 N/A ILE 100.A N TYR 96.A O no hydrogen 2.907 N/A ASP 101.A N ARG 97.A O no hydrogen 3.001 N/A ALA 102.A N GLY 98.A O no hydrogen 3.036 N/A VAL 103.A N TRP 99.A O no hydrogen 2.896 N/A ALA 104.A N ILE 100.A O no hydrogen 2.965 N/A SER 105.A N ASP 101.A O no hydrogen 2.963 N/A SER 105.A OG.A ASP 101.A O no hydrogen 2.970 N/A SER 105.A OG.B ALA 102.A O no hydrogen 2.640 N/A GLY 106.A N ALA 102.A O no hydrogen 3.054 N/A LEU 107.A N VAL 103.A O no hydrogen 2.971 N/A GLY 108.A N ALA 104.A O no hydrogen 3.219 N/A SER 110.A N LEU 107.A O no hydrogen 2.898 N/A SER 110.A OG.A LEU 107.A O no hydrogen 3.305 N/A SER 110.A OG.B THR 60.A OG1 no hydrogen 3.207 N/A SER 110.A OG.B LEU 107.A O no hydrogen 2.547 N/A ALA 112.A N ALA 151.A O no hydrogen 3.202 N/A THR 113.A N PRO 70.A O no hydrogen 2.908 N/A ILE 114.A N ALA 153.A O no hydrogen 2.905 N/A ILE 115.A N LEU 72.A O no hydrogen 2.843 N/A VAL 116.A N TYR 155.A O no hydrogen 2.868 N/A GLU 117.A N LEU 74.A O no hydrogen 2.873 N/A ASP 119.A N ASP 157.A OD2 no hydrogen 2.961 N/A ALA 120.A N GLU 117.A O no hydrogen 3.047 N/A MET 123.A N ASP 119.A O no hydrogen 2.822 N/A CYS 126.A N MET 123.A O no hydrogen 3.109 N/A CYS 126.A SG MET 123.A O no hydrogen 3.516 N/A LEU 127.A N ALA 124.A O no hydrogen 3.004 N/A SER 128.A N GLN 131.A OE1 no hydrogen 3.079 N/A SER 128.A OG GLN 131.A OE1 no hydrogen 3.268 N/A GLN 131.A N SER 128.A OG no hydrogen 3.136 N/A ARG 132.A N SER 128.A O no hydrogen 2.794 N/A ARG 132.A NE.A LEU 127.A O no hydrogen 3.078 N/A ARG 132.A NE.B ASP 125.A OD1 no hydrogen 3.313 N/A ARG 132.A NH2.A ASP 125.A O no hydrogen 2.981 N/A GLN 133.A N PRO 129.A O no hydrogen 3.035 N/A GLN 133.A NE2 ASP 137.A OD1 no hydrogen 3.060 N/A GLU 134.A N ASP 130.A O no hydrogen 3.046 N/A ARG 135.A N GLN 131.A O no hydrogen 2.940 N/A ARG 135.A NH1 ALA 120.A O no hydrogen 3.026 N/A ARG 135.A NH2 PRO 78.A O no hydrogen 3.085 N/A ARG 135.A NH2 HIS 79.A O no hydrogen 3.043 N/A PHE 136.A N ARG 132.A O no hydrogen 2.968 N/A ASP 137.A N GLN 133.A O no hydrogen 2.914 N/A LEU 138.A N GLU 134.A O no hydrogen 2.919 N/A VAL 139.A N ARG 135.A O no hydrogen 2.987 N/A ARG 140.A N PHE 136.A O no hydrogen 2.883 N/A ARG 140.A NE ASP 175.A O no hydrogen 3.149 N/A ARG 140.A NH1 ASP 137.A OD1 no hydrogen 3.078 N/A ARG 140.A NH2 ASP 137.A OD1 no hydrogen 2.822 N/A ARG 140.A NH2 ASP 175.A OD2 no hydrogen 3.416 N/A TYR 141.A N ASP 137.A O no hydrogen 2.882 N/A TYR 141.A OH ASP 101.A OD1 no hydrogen 2.521 N/A TYR 141.A OH ASP 101.A OD2 no hydrogen 3.276 N/A ALA 142.A N LEU 138.A O no hydrogen 2.996 N/A VAL 143.A N VAL 139.A O no hydrogen 3.076 N/A ASP 144.A N ARG 140.A O no hydrogen 2.864 N/A THR 145.A N TYR 141.A O no hydrogen 2.938 N/A THR 145.A OG1 TYR 141.A O no hydrogen 2.785 N/A LEU 146.A N ALA 142.A O no hydrogen 2.892 N/A THR 147.A N VAL 143.A O no hydrogen 3.215 N/A THR 147.A OG1 VAL 143.A O no hydrogen 2.672 N/A ARG 148.A N THR 145.A O no hydrogen 3.350 N/A ASP 149.A N LEU 146.A O no hydrogen 3.153 N/A ALA 151.A N ASP 149.A OD1 no hydrogen 2.957 N/A ALA 152.A N ASP 149.A O no hydrogen 3.034 N/A ALA 153.A N ALA 112.A O no hydrogen 2.792 N/A TYR 155.A N ILE 114.A O no hydrogen 2.851 N/A TYR 155.A OH ASP 254.A OD2 no hydrogen 2.621 N/A VAL 156.A N GLY 183.A O no hydrogen 2.857 N/A ASP 157.A N VAL 116.A O no hydrogen 2.951 N/A ALA 158.A N SER 185.A O no hydrogen 2.850 N/A GLY 159.A N ASP 157.A OD2 no hydrogen 3.148 N/A SER 161.A N GLU 197.A OE1 no hydrogen 3.068 N/A SER 161.A OG GLU 196.A OE2 no hydrogen 2.553 N/A SER 161.A OG GLU 197.A OE1 no hydrogen 3.444 N/A SER 161.A OG GLU 197.A OE2 no hydrogen 2.474 N/A ARG 162.A N HIS 160.A ND1 no hydrogen 3.010 N/A ARG 162.A NE GLU 196.A OE2 no hydrogen 2.876 N/A ARG 162.A NH2 GLU 196.A OE1 no hydrogen 2.831 N/A TRP 163.A N HIS 160.A O no hydrogen 3.114 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.833 N/A ALA 168.A N SER 165.A OG no hydrogen 2.970 N/A MET 169.A N SER 165.A O no hydrogen 2.895 N/A ALA 170.A N ALA 166.A O no hydrogen 2.830 N/A ALA 171.A N GLU 167.A O no hydrogen 3.057 N/A ARG 172.A N ALA 168.A O no hydrogen 3.292 N/A ARG 172.A NH1 LEU 121.A O no hydrogen 2.810 N/A ARG 172.A NH2 ASP 125.A OD1 no hydrogen 2.972 N/A ARG 172.A NH2 ASP 125.A OD2 no hydrogen 3.253 N/A LEU 173.A N MET 169.A O no hydrogen 2.847 N/A ASN 174.A N ALA 170.A O no hydrogen 2.860 N/A ASN 174.A ND2 LEU 207.A O no hydrogen 3.057 N/A ASP 175.A N ALA 171.A O no hydrogen 3.019 N/A VAL 176.A N ARG 172.A O no hydrogen 3.141 N/A VAL 176.A N LEU 173.A O no hydrogen 3.221 N/A GLY 177.A N ASN 174.A O no hydrogen 3.220 N/A VAL 178.A N LEU 173.A O no hydrogen 2.988 N/A ARG 180.A N GLY 177.A O no hydrogen 2.903 N/A ARG 180.A NE ASP 144.A OD1 no hydrogen 3.360 N/A ALA 181.A N VAL 178.A O no hydrogen 2.962 N/A ARG 182.A N VAL 154.A O no hydrogen 2.935 N/A ARG 182.A NE ASP 254.A OD2 no hydrogen 2.767 N/A ARG 182.A NH2 ASP 254.A OD1 no hydrogen 2.938 N/A ARG 182.A NH2 ASP 254.A OD2 no hydrogen 3.525 N/A GLY 183.A N VAL 154.A O no hydrogen 3.233 N/A PHE 184.A N HIS 212.A O no hydrogen 2.986 N/A SER 185.A N VAL 156.A O no hydrogen 2.993 N/A SER 185.A OG ASP 157.A OD1 no hydrogen 2.856 N/A LEU 186.A N VAL 214.A O no hydrogen 2.933 N/A ASN 187.A N GLY 159.A O no hydrogen 3.007 N/A ASN 187.A ND2 TYR 192.A O no hydrogen 2.975 N/A ASN 187.A ND2 ASP 216.A O no hydrogen 3.025 N/A SER 189.A N ASP 216.A OD2 no hydrogen 3.069 N/A ASN 190.A N ASN 187.A O no hydrogen 2.861 N/A PHE 191.A N ASN 190.A OD1 no hydrogen 2.727 N/A TYR 192.A N ASN 187.A OD1 no hydrogen 3.125 N/A GLU 196.A N THR 193.A OG1 no hydrogen 3.252 N/A GLU 197.A N THR 193.A O no hydrogen 3.033 N/A ILE 198.A N THR 194.A O no hydrogen 2.851 N/A GLY 199.A N ASP 195.A O no hydrogen 3.165 N/A TYR 200.A N GLU 196.A O no hydrogen 3.160 N/A TYR 200.A OH LEU 164.A O no hydrogen 2.643 N/A GLY 201.A N GLU 197.A O no hydrogen 2.770 N/A GLU 202.A N ILE 198.A O no hydrogen 2.823 N/A ALA 203.A N GLY 199.A O no hydrogen 3.227 N/A ILE 204.A N TYR 200.A O no hydrogen 2.954 N/A SER 205.A N GLY 201.A O no hydrogen 2.797 N/A SER 205.A OG SER 211.A O no hydrogen 2.678 N/A GLY 206.A N GLU 202.A O no hydrogen 3.073 N/A LEU 207.A N ALA 203.A O no hydrogen 3.254 N/A LEU 207.A N ILE 204.A O no hydrogen 2.983 N/A THR 208.A N SER 205.A O no hydrogen 3.179 N/A THR 208.A OG1 ILE 204.A O no hydrogen 2.786 N/A THR 208.A OG1 SER 205.A O no hydrogen 3.277 N/A THR 208.A OG1 SER 211.A OG.A no hydrogen 2.646 N/A GLY 210.A N SER 205.A O no hydrogen 2.868 N/A SER 211.A OG.A THR 208.A OG1 no hydrogen 2.646 N/A SER 211.A OG.B THR 208.A O no hydrogen 3.126 N/A SER 211.A OG.B THR 208.A OG1 no hydrogen 3.422 N/A HIS 212.A N ARG 182.A O no hydrogen 3.189 N/A TYR 213.A N HIS 252.A O no hydrogen 2.959 N/A TYR 213.A OH GLU 202.A OE2 no hydrogen 2.643 N/A VAL 214.A N PHE 184.A O no hydrogen 3.076 N/A ILE 215.A N ALA 255.A O no hydrogen 3.152 N/A ASP 216.A N LEU 186.A O no hydrogen 2.990 N/A THR 217.A N LEU 257.A O no hydrogen 2.860 N/A THR 217.A OG1 ALA 242.A O no hydrogen 2.757 N/A THR 217.A OG1 LEU 257.A O no hydrogen 3.500 N/A SER 218.A N ASP 216.A OD1 no hydrogen 3.090 N/A SER 218.A OG ASP 216.A OD1 no hydrogen 2.746 N/A SER 218.A OG ASP 216.A OD2 no hydrogen 3.534 N/A ARG 219.A NH1 ASP 266.A OD1 no hydrogen 3.423 N/A ARG 219.A NH1 ASP 266.A OD2 no hydrogen 3.052 N/A ARG 219.A NH2 SER 189.A O no hydrogen 2.870 N/A ARG 219.A NH2 ASP 266.A OD1 no hydrogen 2.911 N/A ARG 219.A NH2 ASP 266.A OD2 no hydrogen 3.445 N/A ASN 220.A ND2 TYR 192.A O no hydrogen 2.937 N/A ASN 220.A ND2 THR 194.A OG1 no hydrogen 3.038 N/A GLY 221.A N ALA 239.A O no hydrogen 2.949 N/A GLY 223.A N ASN 220.A O no hydrogen 3.154 N/A ASN 231.A N ALA 228.A O no hydrogen 3.039 N/A ASN 231.A ND2 ALA 225.A O no hydrogen 3.258 N/A ASN 231.A ND2 PRO 226.A O no hydrogen 3.494 N/A CYS 233.A N LEU 230.A O no hydrogen 2.976 N/A ASN 234.A N ASP 266.A OD2 no hydrogen 2.859 N/A ASN 234.A ND2 SER 265.A OG no hydrogen 2.992 N/A ASN 234.A ND2 GLU 273.A OE1 no hydrogen 3.022 N/A ARG 238.A NE SER 236.A O no hydrogen 2.933 N/A ARG 238.A NH1 GLY 223.A O no hydrogen 3.012 N/A ARG 238.A NH2 SER 236.A O no hydrogen 3.254 N/A LEU 240.A N LEU 287.A O no hydrogen 3.150 N/A THR 245.A N TYR 256.A O no hydrogen 2.990 N/A ALA 247.A N THR 245.A OG1 no hydrogen 3.004 N/A THR 248.A N THR 246.A O no hydrogen 2.984 N/A THR 248.A OG1 GLY 250.A O no hydrogen 3.487 N/A THR 248.A OG1 ALA 253.A O no hydrogen 2.731 N/A ALA 249.A N TYR 256.A OH no hydrogen 2.982 N/A HIS 252.A N GLU 202.A OE2 no hydrogen 2.882 N/A HIS 252.A ND1 GLU 202.A OE1 no hydrogen 2.765 N/A ALA 253.A N GLY 250.A O no hydrogen 3.121 N/A ASP 254.A N TYR 213.A O no hydrogen 2.837 N/A TYR 256.A N THR 245.A O no hydrogen 2.912 N/A LEU 257.A N ILE 215.A O no hydrogen 2.870 N/A TRP 258.A NE1 ALA 242.A O no hydrogen 2.949 N/A ILE 259.A N ASP 216.A OD1 no hydrogen 3.042 N/A LYS 260.A N ASP 216.A OD2 no hydrogen 2.900 N/A LYS 260.A NZ GLU 264.A O no hydrogen 3.023 N/A LYS 260.A NZ SER 265.A O no hydrogen 3.475 N/A LYS 260.A NZ ASP 266.A OD1 no hydrogen 3.063 N/A ARG 261.A NE SER 40.A O no hydrogen 2.676 N/A ARG 261.A NH1 ASP 12.A OD2 no hydrogen 2.989 N/A ARG 261.A NH2 ASP 12.A OD2 no hydrogen 3.002 N/A ARG 261.A NH2 SER 40.A O no hydrogen 3.212 N/A GLU 264.A N ARG 261.A O no hydrogen 3.045 N/A SER 265.A N ARG 278.A O no hydrogen 2.836 N/A SER 265.A OG PRO 274.A O no hydrogen 2.706 N/A ASP 266.A N ASN 234.A OD1 no hydrogen 2.833 N/A GLY 267.A N SER 265.A OG no hydrogen 3.045 N/A CYS 269.A SG GLY 267.A O no hydrogen 3.270 N/A ARG 271.A N THR 268.A O no hydrogen 3.014 N/A ARG 271.A NE GLU 273.A OE2 no hydrogen 2.936 N/A ARG 271.A NH2 CYS 233.A O no hydrogen 3.036 N/A ARG 271.A NH2 GLU 273.A OE1 no hydrogen 2.858 N/A ARG 271.A NH2 GLU 273.A OE2 no hydrogen 3.441 N/A GLU 273.A N THR 268.A O no hydrogen 3.106 N/A GLY 277.A N SER 265.A O no hydrogen 2.902 N/A ARG 278.A N GLN 275.A O no hydrogen 3.106 N/A VAL 280.A N GLY 263.A O no hydrogen 2.809 N/A GLN 282.A NE2 GLN 282.A O no hydrogen 3.481 N/A GLN 282.A NE2 ASP 286.A OD1 no hydrogen 2.671 N/A GLN 282.A NE2 ASP 286.A OD2 no hydrogen 3.509 N/A ALA 284.A N VAL 280.A O no hydrogen 3.257 N/A ILE 285.A N SER 281.A O no hydrogen 2.874 N/A ASP 286.A N GLN 282.A O no hydrogen 2.885 N/A LEU 287.A N TYR 283.A O no hydrogen 3.026 N/A ALA 288.A N ALA 284.A O no hydrogen 3.012 N/A HIS 289.A N ILE 285.A O no hydrogen 2.751 N/A ASN 290.A N ASP 286.A O no hydrogen 2.863 N/A ASN 290.A ND2 ARG 238.A O no hydrogen 2.871 N/A ALA 291.A N LEU 287.A O no hydrogen 3.281 N/A ALA 291.A N ALA 288.A O no hydrogen 2.982 N/A GLY 292.A N HIS 289.A O no hydrogen 2.895 N/A GLN 293.A N ALA 288.A O no hydrogen 2.941 N/A GLN 293.A NE2 SER 33.A OG no hydrogen 2.616 N/A