Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4io0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N SER 18.A O no hydrogen 2.830 N/A SER 3.A OG SER 18.A O no hydrogen 3.561 N/A GLN 5.A N TYR 16.A O no hydrogen 3.045 N/A TYR 6.A OH LEU 61.A O no hydrogen 2.982 N/A ILE 7.A N LEU 14.A O no hydrogen 2.960 N/A VAL 9.A N VAL 12.A O no hydrogen 3.106 N/A ASN 10.A N GLN 82.A OE1 no hydrogen 2.764 N/A ASN 10.A ND2 ASP 79.A OD1 no hydrogen 2.712 N/A VAL 12.A N VAL 9.A O no hydrogen 3.236 N/A ASN 13.A ND2 GLU 63.A OE1 no hydrogen 3.225 N/A LEU 14.A N ILE 7.A O no hydrogen 2.989 N/A HIS 15.A N SER 62.A OG no hydrogen 2.848 N/A HIS 15.A ND1 ASP 55.A OD2 no hydrogen 2.858 N/A TYR 16.A N GLN 5.A O no hydrogen 2.695 N/A ILE 17.A N ALA 53.A O no hydrogen 2.767 N/A SER 18.A N SER 3.A O no hydrogen 2.678 N/A SER 18.A OG HIS 50.A NE2 no hydrogen 2.852 N/A LYS 19.A N THR 51.A O no hydrogen 2.974 N/A LYS 19.A NZ ASP 43.A OD1 no hydrogen 3.002 N/A MET 25.A N HIS 50.A O no hydrogen 2.853 N/A LEU 26.A N THR 93.A O no hydrogen 2.910 N/A PHE 27.A N VAL 52.A O no hydrogen 2.864 N/A LEU 28.A N VAL 95.A O no hydrogen 2.788 N/A HIS 29.A ND1 GLY 30.A O no hydrogen 2.983 N/A PHE 31.A N ASP 98.A OD2 no hydrogen 2.976 N/A ASP 33.A N GLY 30.A O no hydrogen 2.752 N/A SER 35.A N ASP 55.A OD1 no hydrogen 2.956 N/A SER 35.A OG ASP 55.A OD1 no hydrogen 2.847 N/A HIS 36.A NE2 ASP 184.A OD1 no hydrogen 3.150 N/A ILE 37.A N PHE 34.A O no hydrogen 2.892 N/A TRP 38.A N SER 35.A O no hydrogen 3.118 N/A ARG 39.A N HIS 36.A O no hydrogen 2.872 N/A ARG 39.A NH1 HIS 272.A ND1 no hydrogen 3.411 N/A ARG 39.A NH2 HIS 36.A O no hydrogen 3.501 N/A ARG 39.A NH2 HIS 272.A ND1 no hydrogen 3.112 N/A GLN 41.A NE2 GLN 271.A O no hydrogen 3.542 N/A GLN 41.A NE2 ASN 279.A OD1 no hydrogen 2.778 N/A ILE 42.A N TRP 38.A O no hydrogen 2.997 N/A ASP 43.A N ARG 39.A O no hydrogen 3.046 N/A GLU 44.A N GLN 41.A O no hydrogen 3.197 N/A PHE 45.A N GLN 41.A O no hydrogen 2.967 N/A SER 46.A OG ILE 42.A O no hydrogen 2.464 N/A ASP 48.A N PHE 45.A O no hydrogen 2.954 N/A PHE 49.A N PHE 45.A O no hydrogen 2.719 N/A HIS 50.A N GLU 23.A O no hydrogen 2.666 N/A HIS 50.A ND1 TYR 89.A OH no hydrogen 3.010 N/A HIS 50.A NE2 SER 18.A OG no hydrogen 2.852 N/A THR 51.A N LYS 19.A O no hydrogen 2.727 N/A THR 51.A OG1 LYS 19.A O no hydrogen 3.000 N/A VAL 52.A N MET 25.A O no hydrogen 2.752 N/A ALA 53.A N ILE 17.A O no hydrogen 2.894 N/A LEU 54.A N PHE 27.A O no hydrogen 3.308 N/A ASP 55.A N HIS 15.A O no hydrogen 2.897 N/A LEU 56.A N HIS 29.A NE2 no hydrogen 2.997 N/A ARG 57.A NE ASP 79.A OD2 no hydrogen 2.848 N/A ARG 57.A NH1 SER 70.A O no hydrogen 2.891 N/A ARG 57.A NH2 ASP 79.A OD1 no hydrogen 2.876 N/A ARG 57.A NH2 ASP 79.A OD2 no hydrogen 3.360 N/A GLY 58.A N GLU 63.A O no hydrogen 2.968 N/A TYR 59.A N LEU 56.A O no hydrogen 2.832 N/A ASN 60.A ND2 ASP 55.A OD2 no hydrogen 3.036 N/A SER 62.A N TYR 59.A O no hydrogen 2.878 N/A SER 62.A OG ASP 55.A O no hydrogen 2.590 N/A GLU 63.A N ASN 13.A O no hydrogen 2.925 N/A LYS 64.A NZ ASN 60.A O no hydrogen 2.731 N/A LYS 64.A NZ SER 62.A O no hydrogen 2.627 N/A GLU 69.A N GLU 69.A OE2 no hydrogen 2.729 N/A SER 70.A N GLY 67.A O no hydrogen 2.847 N/A SER 70.A OG SER 66.A O no hydrogen 2.515 N/A SER 70.A OG GLY 67.A O no hydrogen 2.948 N/A TYR 71.A N LEU 68.A O no hydrogen 2.939 N/A TYR 71.A OH PRO 65.A O no hydrogen 2.774 N/A LEU 76.A N GLU 72.A O no hydrogen 2.982 N/A VAL 77.A N ILE 73.A O no hydrogen 2.747 N/A GLU 78.A N ASP 74.A O no hydrogen 3.097 N/A ASP 79.A N VAL 75.A O no hydrogen 2.952 N/A ILE 80.A N LEU 76.A O no hydrogen 3.127 N/A ARG 81.A N VAL 77.A O no hydrogen 3.041 N/A ARG 81.A NE GLU 78.A OE1 no hydrogen 3.158 N/A ARG 81.A NE GLU 78.A OE2 no hydrogen 3.351 N/A ARG 81.A NH1 TYR 114.A OH no hydrogen 3.201 N/A ARG 81.A NH2 GLU 78.A OE2 no hydrogen 2.914 N/A GLN 82.A N GLU 78.A O no hydrogen 2.767 N/A GLN 82.A NE2 GLU 78.A OE2 no hydrogen 3.286 N/A VAL 83.A N ASP 79.A O no hydrogen 3.082 N/A ILE 84.A N ILE 80.A O no hydrogen 3.209 N/A GLU 85.A N ARG 81.A O no hydrogen 3.303 N/A GLY 86.A N GLN 82.A O no hydrogen 2.814 N/A LEU 87.A N VAL 83.A O no hydrogen 2.959 N/A GLY 88.A N GLU 85.A O no hydrogen 2.787 N/A TYR 89.A N ILE 84.A O no hydrogen 2.965 N/A TYR 89.A N GLU 85.A O no hydrogen 3.368 N/A TYR 89.A OH GLY 22.A O no hydrogen 2.632 N/A TYR 89.A OH HIS 50.A ND1 no hydrogen 3.010 N/A CYS 92.A N TYR 114.A O no hydrogen 2.874 N/A CYS 92.A SG TYR 114.A O no hydrogen 3.947 N/A THR 93.A N LEU 24.A O no hydrogen 2.924 N/A LEU 94.A N LYS 117.A O no hydrogen 2.967 N/A VAL 95.A N LEU 26.A O no hydrogen 2.783 N/A VAL 96.A N ILE 119.A O no hydrogen 2.830 N/A HIS 97.A N LEU 28.A O no hydrogen 3.059 N/A HIS 97.A NE2 HIS 268.A O no hydrogen 3.000 N/A ASP 98.A N ASN 122.A O no hydrogen 2.896 N/A TRP 99.A N ASP 98.A OD2 no hydrogen 2.748 N/A GLY 100.A N HIS 97.A O no hydrogen 2.838 N/A ALA 101.A N ASP 98.A O no hydrogen 2.812 N/A GLY 102.A N ASP 98.A O no hydrogen 3.116 N/A ILE 103.A N TRP 99.A O no hydrogen 3.040 N/A GLY 104.A N GLY 100.A O no hydrogen 2.715 N/A TRP 105.A N ALA 101.A O no hydrogen 2.715 N/A THR 106.A N GLY 102.A O no hydrogen 3.367 N/A THR 106.A OG1 GLY 102.A O no hydrogen 2.985 N/A PHE 107.A N ILE 103.A O no hydrogen 2.797 N/A ALA 108.A N GLY 104.A O no hydrogen 2.805 N/A TYR 109.A N TRP 105.A O no hydrogen 3.012 N/A TYR 109.A OH HIS 125.A NE2 no hydrogen 2.655 N/A TYR 109.A OH TYR 254.A O no hydrogen 2.790 N/A ARG 110.A N THR 106.A O no hydrogen 3.000 N/A TYR 111.A N PHE 107.A O no hydrogen 2.694 N/A TYR 111.A N ALA 108.A O no hydrogen 3.318 N/A GLU 113.A N GLU 113.A OE1 no hydrogen 3.089 N/A TYR 114.A N TYR 111.A O no hydrogen 2.667 N/A TYR 114.A OH GLU 85.A OE1 no hydrogen 2.634 N/A VAL 115.A N PRO 112.A O no hydrogen 3.344 N/A GLN 116.A N CYS 92.A O no hydrogen 2.783 N/A GLN 116.A NE2 SER 91.A OG no hydrogen 3.091 N/A LYS 117.A NZ LEU 286.A O no hydrogen 2.950 N/A LEU 118.A N PRO 231.A O no hydrogen 3.025 N/A ILE 119.A N LEU 94.A O no hydrogen 2.956 N/A ALA 120.A N GLN 233.A O no hydrogen 2.822 N/A PHE 121.A N VAL 96.A O no hydrogen 2.865 N/A ASN 122.A ND2 GLY 237.A O no hydrogen 3.073 N/A ASN 122.A ND2 ASP 240.A OD2 no hydrogen 3.197 N/A HIS 125.A NE2 TYR 109.A OH no hydrogen 2.655 N/A TYR 127.A N HIS 125.A ND1 no hydrogen 3.115 N/A TYR 127.A OH GLU 225.A O no hydrogen 2.688 N/A THR 128.A N HIS 125.A ND1 no hydrogen 3.378 N/A THR 128.A OG1 ASN 247.A O no hydrogen 2.945 N/A ALA 129.A N HIS 125.A O no hydrogen 2.930 N/A ARG 131.A N TYR 127.A O no hydrogen 3.192 N/A ARG 131.A NE GLU 132.A OE2 no hydrogen 2.951 N/A ARG 131.A NH1 ASP 249.A O no hydrogen 2.892 N/A ARG 131.A NH2 GLU 132.A OE2 no hydrogen 3.207 N/A ARG 131.A NH2 GLU 246.A O no hydrogen 2.964 N/A ARG 131.A NH2 ASP 249.A O no hydrogen 2.671 N/A GLU 132.A N THR 128.A O no hydrogen 2.931 N/A LEU 133.A N ALA 129.A O no hydrogen 3.259 N/A ARG 134.A N ARG 131.A O no hydrogen 3.144 N/A ARG 134.A NH1 LEU 215.A O no hydrogen 2.947 N/A ARG 134.A NH1 ARG 217.A O no hydrogen 2.807 N/A THR 135.A N ARG 131.A O no hydrogen 2.946 N/A THR 135.A OG1 ARG 131.A O no hydrogen 3.422 N/A ASN 136.A N GLU 132.A O no hydrogen 2.939 N/A ASN 136.A ND2 GLU 132.A OE1 no hydrogen 3.051 N/A ASN 138.A N ASN 136.A OD1 no hydrogen 3.076 N/A GLN 139.A N ASN 136.A O no hydrogen 2.853 N/A GLN 139.A NE2 GLN 139.A O no hydrogen 3.175 N/A GLN 139.A NE2 SER 143.A OG no hydrogen 3.002 N/A GLN 139.A NE2 THR 242.A O no hydrogen 3.100 N/A GLN 140.A N ASN 136.A O no hydrogen 3.093 N/A GLN 140.A NE2 LEU 133.A O no hydrogen 3.176 N/A LYS 141.A N LYS 137.A O no hydrogen 3.093 N/A ALA 142.A N ASN 138.A O no hydrogen 2.944 N/A SER 143.A N GLN 139.A O no hydrogen 2.743 N/A SER 143.A OG GLN 139.A O no hydrogen 3.208 N/A GLU 144.A N LYS 141.A O no hydrogen 3.392 N/A MET 146.A N SER 143.A O no hydrogen 2.800 N/A TRP 148.A NE1 GLU 153.A OE1 no hydrogen 2.935 N/A PHE 149.A N TYR 145.A O no hydrogen 3.053 N/A GLN 150.A NE2 MET 146.A O no hydrogen 3.464 N/A GLN 150.A NE2 TYR 204.A O no hydrogen 3.098 N/A LYS 151.A N TRP 148.A O no hydrogen 3.041 N/A VAL 154.A N LYS 151.A O no hydrogen 3.234 N/A GLN 155.A NE2 GLU 159.A OE2 no hydrogen 2.958 N/A TYR 157.A N VAL 154.A O no hydrogen 2.864 N/A MET 158.A N GLN 155.A O no hydrogen 3.058 N/A GLU 159.A N GLN 155.A O no hydrogen 2.996 N/A ARG 160.A N ASP 156.A O no hydrogen 2.950 N/A PHE 163.A N GLU 159.A O no hydrogen 2.643 N/A SER 164.A N ARG 160.A O no hydrogen 2.971 N/A SER 164.A N ASP 161.A O no hydrogen 3.064 N/A SER 164.A OG ARG 160.A O no hydrogen 2.590 N/A ARG 167.A N PHE 163.A O no hydrogen 2.711 N/A ARG 167.A NE ASN 162.A O no hydrogen 2.680 N/A ARG 167.A NH1 ASP 161.A O no hydrogen 2.685 N/A LYS 168.A N SER 164.A O no hydrogen 3.029 N/A LEU 169.A N GLY 165.A O no hydrogen 3.182 N/A VAL 170.A N LEU 166.A O no hydrogen 3.051 N/A ASP 172.A N ARG 167.A O no hydrogen 2.884 N/A VAL 175.A N ILE 171.A O no hydrogen 2.982 N/A LYS 176.A N ASP 172.A O no hydrogen 3.089 N/A LYS 177.A N PRO 173.A O no hydrogen 2.742 N/A LYS 177.A NZ GLU 273.A OE2.A no hydrogen 3.374 N/A GLY 178.A N GLY 174.A O no hydrogen 3.112 N/A LEU 180.A N GLY 174.A O no hydrogen 2.913 N/A THR 181.A N ASP 184.A OD2 no hydrogen 2.758 N/A ASP 183.A N THR 181.A OG1 no hydrogen 3.159 N/A ASP 184.A N THR 181.A OG1 no hydrogen 2.891 N/A VAL 185.A N THR 181.A O no hydrogen 2.973 N/A GLN 186.A N ALA 182.A O no hydrogen 3.152 N/A ALA 187.A N ASP 183.A O no hydrogen 2.846 N/A TYR 188.A N ASP 184.A O no hydrogen 3.115 N/A TYR 188.A OH ASP 33.A OD1 no hydrogen 2.682 N/A MET 189.A N VAL 185.A O no hydrogen 3.226 N/A ASN 190.A N GLN 186.A O no hydrogen 2.989 N/A SER 191.A N ALA 187.A O no hydrogen 3.053 N/A SER 191.A OG TYR 188.A O no hydrogen 2.593 N/A TRP 192.A N TYR 188.A O no hydrogen 2.984 N/A TRP 192.A NE1 PRO 32.A O no hydrogen 2.958 N/A GLU 193.A N MET 189.A O no hydrogen 3.064 N/A ASN 194.A N ASN 190.A O no hydrogen 2.817 N/A GLY 195.A N SER 191.A O no hydrogen 2.764 N/A SER 196.A N GLY 58.A O no hydrogen 3.102 N/A SER 199.A OG SER 196.A O no hydrogen 3.197 N/A MET 200.A N SER 196.A O no hydrogen 2.997 N/A LEU 201.A N VAL 197.A O no hydrogen 2.826 N/A SER 202.A N LEU 198.A O no hydrogen 2.936 N/A SER 202.A OG LEU 198.A O no hydrogen 2.659 N/A TYR 203.A OH ARG 57.A O no hydrogen 2.551 N/A TYR 204.A N LEU 201.A O no hydrogen 2.975 N/A ARG 205.A NE PHE 149.A O no hydrogen 2.592 N/A ARG 205.A NE GLN 150.A O no hydrogen 3.337 N/A ASN 206.A ND2 LEU 68.A O no hydrogen 2.664 N/A LEU 207.A N TYR 204.A O no hydrogen 2.913 N/A THR 211.A OG1 GLU 213.A OE1 no hydrogen 3.296 N/A GLU 213.A N GLU 213.A OE1 no hydrogen 2.908 N/A ASP 214.A N THR 211.A O no hydrogen 2.754 N/A ASP 214.A N THR 211.A OG1 no hydrogen 2.877 N/A LEU 215.A N THR 211.A O no hydrogen 3.020 N/A ARG 216.A NH1 GLU 212.A OE1 no hydrogen 3.517 N/A ARG 216.A NH2 GLU 212.A OE1 no hydrogen 3.538 N/A ARG 217.A NE LYS 208.A O no hydrogen 3.418 N/A ARG 217.A NH2 LYS 208.A O no hydrogen 3.206 N/A ARG 217.A NH2 LEU 220.A O no hydrogen 2.554 N/A LYS 218.A NZ GLU 226.A OE2 no hydrogen 3.459 N/A SER 219.A OG PHE 221.A O no hydrogen 2.700 N/A LEU 220.A N PRO 126.A O no hydrogen 2.728 N/A LEU 228.A N TYR 254.A O no hydrogen 2.867 N/A VAL 232.A N ASN 257.A O no hydrogen 3.428 N/A GLN 233.A N LEU 118.A O no hydrogen 2.819 N/A GLN 233.A NE2 ILE 234.A O no hydrogen 3.103 N/A ILE 234.A N SER 259.A O no hydrogen 2.725 N/A ILE 235.A N ALA 120.A O no hydrogen 2.920 N/A TRP 236.A N HIS 261.A O no hydrogen 2.801 N/A GLY 237.A N ASN 122.A OD1 no hydrogen 2.670 N/A ASN 238.A N LEU 263.A O no hydrogen 2.663 N/A GLN 239.A N ALA 266.A O no hydrogen 3.053 N/A ASP 240.A N GLY 237.A O no hydrogen 3.215 N/A THR 242.A N ASP 240.A OD1 no hydrogen 2.992 N/A THR 242.A OG1 ASP 240.A OD1 no hydrogen 2.987 N/A THR 242.A OG1 ASP 240.A OD2 no hydrogen 3.111 N/A MET 244.A N GLN 139.A OE1 no hydrogen 2.766 N/A GLU 246.A N GLU 246.A OE1 no hydrogen 2.558 N/A ASN 247.A N MET 244.A O no hydrogen 3.173 N/A ASN 247.A ND2 GLN 139.A OE1 no hydrogen 3.038 N/A ASN 247.A ND2 MET 244.A O no hydrogen 3.095 N/A LEU 248.A N PRO 245.A O no hydrogen 2.912 N/A ASP 249.A N GLU 246.A O no hydrogen 2.925 N/A GLU 253.A N GLY 250.A O no hydrogen 3.344 N/A TYR 254.A N ILE 251.A O no hydrogen 2.870 N/A VAL 255.A N ILE 251.A O no hydrogen 2.831 N/A ASN 257.A ND2 ASN 229.A O no hydrogen 2.899 N/A SER 259.A N VAL 232.A O no hydrogen 2.912 N/A HIS 261.A N ILE 234.A O no hydrogen 2.601 N/A HIS 261.A NE2 GLU 277.A OE2 no hydrogen 3.033 N/A LEU 263.A N TRP 236.A O no hydrogen 2.749 N/A SER 267.A N GLU 273.A OE1.B no hydrogen 2.723 N/A SER 267.A OG GLN 239.A O no hydrogen 3.054 N/A HIS 268.A ND1 ASP 240.A OD2 no hydrogen 3.118 N/A HIS 268.A NE2 ASP 98.A OD1 no hydrogen 2.566 N/A ALA 269.A N GLU 273.A OE2.B no hydrogen 3.005 N/A GLN 271.A N GLN 271.A OE1 no hydrogen 2.700 N/A HIS 272.A N ALA 269.A O no hydrogen 3.246 N/A GLU 273.A N ALA 269.A O no hydrogen 3.210 N/A GLU 273.A N PRO 270.A O no hydrogen 3.108 N/A LYS 274.A N PRO 270.A O no hydrogen 2.991 N/A LYS 274.A NZ GLU 273.A OE1.A no hydrogen 3.036 N/A LYS 274.A NZ GLU 273.A OE2.A no hydrogen 3.293 N/A VAL 278.A N LYS 274.A O no hydrogen 3.125 N/A ASN 279.A N PRO 275.A O no hydrogen 2.733 N/A ASN 279.A ND2 HIS 40.A O no hydrogen 3.687 N/A ASN 280.A N GLN 276.A O no hydrogen 3.040 N/A ASN 280.A N GLU 277.A O no hydrogen 3.101 N/A VAL 281.A N GLU 277.A O no hydrogen 3.063 N/A MET 282.A N VAL 278.A O no hydrogen 3.022 N/A TRP 283.A N ASN 279.A O no hydrogen 3.000 N/A TRP 283.A NE1 GLU 44.A OE2 no hydrogen 2.701 N/A ASN 284.A N ASN 280.A O no hydrogen 3.038 N/A PHE 285.A N VAL 281.A O no hydrogen 2.923 N/A LEU 286.A N MET 282.A O no hydrogen 2.816 N/A ASN 287.A N TRP 283.A O no hydrogen 3.115 N/A ASN 287.A N ASN 284.A O no hydrogen 3.135 N/A ASN 287.A ND2 TRP 283.A O no hydrogen 2.587 N/A LYS 288.A N ASN 284.A O no hydrogen 3.055 N/A LYS 288.A NZ SER 259.A OG no hydrogen 2.975 N/A