Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dr0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ ASP 6.A OD1 no hydrogen 2.810 N/A LYS 3.A NZ ASP 6.A OD2 no hydrogen 3.346 N/A PHE 17.A N ASP 15.A OD1 no hydrogen 2.915 N/A THR 18.A N ASP 15.A OD1 no hydrogen 2.643 N/A THR 18.A OG1 ASP 15.A OD1 no hydrogen 3.281 N/A THR 18.A OG1 ASP 15.A OD2 no hydrogen 2.672 N/A THR 18.A OG1 TYR 204.A OH no hydrogen 2.787 N/A GLN 19.A NE2 GLN 85.A OE1 no hydrogen 3.684 N/A PHE 21.A N PHE 17.A O no hydrogen 3.060 N/A TYR 22.A N THR 18.A O no hydrogen 2.684 N/A ASN 23.A N GLN 19.A O no hydrogen 2.984 N/A GLN 24.A N MET 20.A O no hydrogen 2.966 N/A GLN 24.A NE2 GLN 28.A OE1 no hydrogen 3.116 N/A ASN 25.A N PHE 21.A O no hydrogen 2.811 N/A ASN 25.A ND2 PHE 21.A O no hydrogen 2.672 N/A VAL 26.A N TYR 22.A O no hydrogen 3.048 N/A LYS 27.A N ASN 23.A O no hydrogen 3.042 N/A GLN 28.A N GLN 24.A O no hydrogen 3.100 N/A GLN 28.A N ASN 25.A O no hydrogen 3.175 N/A GLN 28.A NE2 ASP 197.A OD1 no hydrogen 2.961 N/A PHE 29.A N VAL 26.A O no hydrogen 3.353 N/A TRP 30.A NE1 ASP 197.A OD2 no hydrogen 2.785 N/A LEU 31.A N GLU 34.A OE2 no hydrogen 3.107 N/A GLU 34.A N LEU 31.A O no hydrogen 2.995 N/A ILE 35.A N PRO 32.A O no hydrogen 2.959 N/A ASP 40.A N LEU 37.A O no hydrogen 3.033 N/A LEU 41.A N ASN 38.A O no hydrogen 3.232 N/A THR 43.A OG1 ASP 40.A O no hydrogen 3.471 N/A TRP 44.A N ASP 40.A O no hydrogen 3.025 N/A LYS 45.A N LEU 41.A O no hydrogen 3.107 N/A TYR 46.A N LEU 42.A O no hydrogen 3.145 N/A LEU 47.A N TRP 44.A O no hydrogen 3.120 N/A GLY 48.A N GLU 51.A OE1 no hydrogen 2.908 N/A ASN 50.A ND2 GLN 249.A O no hydrogen 2.839 N/A GLN 52.A N GLY 48.A O no hydrogen 3.015 N/A GLN 52.A NE2 TRP 44.A O no hydrogen 2.759 N/A ASP 53.A N LYS 49.A O no hydrogen 2.955 N/A THR 54.A N ASN 50.A O no hydrogen 3.045 N/A THR 54.A OG1 ASN 50.A O no hydrogen 3.251 N/A THR 54.A OG1 LEU 246.A O no hydrogen 2.792 N/A TYR 55.A N GLU 51.A O no hydrogen 2.921 N/A MET 56.A N GLN 52.A O no hydrogen 2.960 N/A LYS 57.A N ASP 53.A O no hydrogen 3.089 N/A LYS 57.A NZ ASP 53.A OD1 no hydrogen 3.456 N/A LYS 57.A NZ ASP 53.A OD2 no hydrogen 2.975 N/A VAL 58.A N THR 54.A O no hydrogen 2.876 N/A LEU 59.A N TYR 55.A O no hydrogen 3.141 N/A ALA 60.A N MET 56.A O no hydrogen 2.969 N/A GLY 61.A N LYS 57.A O no hydrogen 2.900 N/A LEU 62.A N VAL 58.A O no hydrogen 3.084 N/A THR 63.A N LEU 59.A O no hydrogen 2.830 N/A THR 63.A OG1 LEU 59.A O no hydrogen 2.716 N/A LEU 64.A N ALA 60.A O no hydrogen 3.034 N/A LEU 65.A N GLY 61.A O no hydrogen 3.227 N/A ASP 66.A N LEU 62.A O no hydrogen 2.995 N/A THR 67.A N THR 63.A O no hydrogen 2.869 N/A THR 67.A OG1 THR 63.A O no hydrogen 2.623 N/A GLU 68.A N LEU 64.A O no hydrogen 3.121 N/A GLN 69.A N LEU 65.A O no hydrogen 2.894 N/A GLN 69.A NE2 SER 160.A OG no hydrogen 2.755 N/A GLN 69.A NE2 GLU 164.A OE2 no hydrogen 3.192 N/A GLY 70.A N ASP 66.A O no hydrogen 2.883 N/A ASN 71.A N THR 67.A O no hydrogen 2.860 N/A THR 72.A N GLU 68.A O no hydrogen 2.915 N/A THR 72.A OG1 GLU 68.A OE1 no hydrogen 2.903 N/A GLY 73.A N GLU 68.A O no hydrogen 2.989 N/A MET 74.A N GLN 69.A O no hydrogen 2.844 N/A ILE 76.A N THR 72.A O no hydrogen 2.995 N/A VAL 77.A N GLY 73.A O no hydrogen 3.111 N/A ALA 78.A N MET 74.A O no hydrogen 2.906 N/A GLU 79.A N PRO 75.A O no hydrogen 2.971 N/A HIS 80.A N ILE 76.A O no hydrogen 3.332 N/A HIS 80.A N VAL 77.A O no hydrogen 3.104 N/A HIS 80.A ND1 ILE 76.A O no hydrogen 3.002 N/A VAL 81.A N VAL 77.A O no hydrogen 3.036 N/A GLN 85.A N GLU 14.A OE2 no hydrogen 2.923 N/A GLN 85.A NE2 ASN 9.A O no hydrogen 3.255 N/A GLN 85.A NE2 LYS 12.A O no hydrogen 2.762 N/A ARG 86.A N GLU 14.A OE1 no hydrogen 3.226 N/A ARG 86.A NE ASP 15.A OD2 no hydrogen 2.751 N/A ARG 86.A NH1 GLU 211.A OE1 no hydrogen 3.116 N/A ARG 86.A NH2 ASP 15.A OD2 no hydrogen 3.038 N/A ARG 86.A NH2 GLU 211.A OE2 no hydrogen 2.554 N/A LYS 87.A N GLY 83.A O no hydrogen 2.902 N/A LYS 87.A NZ ALA 78.A O no hydrogen 2.897 N/A LYS 87.A NZ VAL 81.A O no hydrogen 2.781 N/A ALA 88.A N HIS 84.A O no hydrogen 2.941 N/A VAL 89.A N GLN 85.A O no hydrogen 3.109 N/A LEU 90.A N ARG 86.A O no hydrogen 3.070 N/A ASN 91.A N LYS 87.A O no hydrogen 2.819 N/A ASN 91.A ND2 LYS 87.A O no hydrogen 2.654 N/A PHE 92.A N ALA 88.A O no hydrogen 3.024 N/A MET 93.A N VAL 89.A O no hydrogen 2.920 N/A ALA 94.A N LEU 90.A O no hydrogen 2.955 N/A MET 95.A N ASN 91.A O no hydrogen 3.061 N/A MET 96.A N PHE 92.A O no hydrogen 3.041 N/A GLU 97.A N MET 93.A O no hydrogen 3.054 N/A ASN 98.A N ALA 94.A O no hydrogen 3.363 N/A ASN 98.A ND2 ASN 71.A OD1 no hydrogen 3.062 N/A ALA 99.A N MET 95.A O no hydrogen 2.781 N/A VAL 100.A N MET 96.A O no hydrogen 3.119 N/A HIS 101.A N MET 96.A O no hydrogen 2.693 N/A HIS 101.A NE2 ASP 197.A OD2 no hydrogen 2.739 N/A ALA 102.A N GLU 97.A O no hydrogen 2.890 N/A LYS 103.A NZ ASN 107.A OD1 no hydrogen 3.567 N/A SER 104.A N VAL 100.A O no hydrogen 3.018 N/A SER 104.A OG.A VAL 100.A O no hydrogen 2.614 N/A SER 104.A OG.B HIS 101.A O no hydrogen 2.579 N/A TYR 105.A OH ASP 66.A OD2 no hydrogen 3.291 N/A ASN 107.A N LYS 103.A O no hydrogen 3.168 N/A ASN 107.A ND2 GLU 33.A OE2 no hydrogen 2.987 N/A ILE 108.A N SER 104.A O no hydrogen 3.017 N/A PHE 109.A N TYR 105.A O no hydrogen 2.858 N/A MET 110.A N SER 106.A O no hydrogen 2.833 N/A THR 111.A N ASN 107.A O no hydrogen 3.221 N/A THR 111.A N ILE 108.A O no hydrogen 3.200 N/A THR 111.A OG1 ASN 107.A O no hydrogen 2.990 N/A LEU 112.A N ILE 108.A O no hydrogen 3.078 N/A ALA 113.A N PHE 109.A O no hydrogen 2.889 N/A THR 117.A N PRO 114.A O no hydrogen 3.047 N/A ILE 118.A N PRO 114.A O no hydrogen 3.151 N/A ASN 119.A N THR 115.A O no hydrogen 2.779 N/A GLU 120.A N GLU 116.A O no hydrogen 2.939 N/A VAL 121.A N THR 117.A O no hydrogen 3.045 N/A PHE 122.A N ILE 118.A O no hydrogen 3.204 N/A GLU 123.A N ASN 119.A O no hydrogen 3.041 N/A TRP 124.A N GLU 120.A O no hydrogen 2.835 N/A VAL 125.A N VAL 121.A O no hydrogen 3.039 N/A LYS 126.A NZ GLU 123.A OE2 no hydrogen 2.877 N/A GLN 127.A N TRP 124.A O no hydrogen 3.349 N/A ASN 128.A N TRP 124.A O no hydrogen 3.028 N/A LEU 131.A N ASN 128.A OD1 no hydrogen 3.034 N/A GLN 132.A N ASN 128.A O no hydrogen 3.006 N/A GLN 132.A NE2 VAL 125.A O no hydrogen 2.912 N/A LYS 133.A N LYS 129.A O no hydrogen 2.916 N/A LYS 134.A N TYR 130.A O no hydrogen 3.006 N/A LYS 134.A NZ GLU 239.A OE1 no hydrogen 2.787 N/A LYS 134.A NZ GLU 239.A OE2 no hydrogen 2.866 N/A ALA 135.A N LEU 131.A O no hydrogen 3.096 N/A GLN 136.A N GLN 132.A O no hydrogen 2.820 N/A MET 137.A N LYS 133.A O no hydrogen 3.010 N/A ILE 138.A N LYS 134.A O no hydrogen 2.989 N/A VAL 139.A N ALA 135.A O no hydrogen 2.926 N/A GLY 140.A N GLN 136.A O no hydrogen 2.984 N/A LEU 141.A N MET 137.A O no hydrogen 3.353 N/A TYR 142.A N ILE 138.A O no hydrogen 3.150 N/A TYR 142.A OH GLN 69.A OE1 no hydrogen 2.563 N/A LYS 143.A N VAL 139.A O no hydrogen 2.946 N/A ALA 144.A N LEU 141.A O no hydrogen 3.216 N/A ILE 145.A N TYR 142.A O no hydrogen 3.425 N/A GLN 146.A N SER 152.A OG no hydrogen 2.880 N/A ASP 149.A N GLN 146.A O no hydrogen 3.007 N/A ILE 151.A N ASP 149.A OD1 no hydrogen 3.221 N/A SER 152.A OG ASP 149.A O no hydrogen 2.959 N/A LEU 153.A N ASP 149.A O no hydrogen 3.309 N/A PHE 154.A N GLU 150.A O no hydrogen 2.850 N/A LYS 155.A N ILE 151.A O no hydrogen 3.075 N/A ALA 156.A N SER 152.A O no hydrogen 3.169 N/A MET 157.A N LEU 153.A O no hydrogen 2.915 N/A VAL 158.A N PHE 154.A O no hydrogen 2.894 N/A ALA 159.A N LYS 155.A O no hydrogen 3.072 N/A SER 160.A N ALA 156.A O no hydrogen 2.863 N/A VAL 161.A N MET 157.A O no hydrogen 2.886 N/A TYR 162.A N VAL 158.A O no hydrogen 2.863 N/A TYR 162.A OH ALA 228.A O no hydrogen 2.723 N/A LEU 163.A N ALA 159.A O no hydrogen 2.887 N/A GLU 164.A N SER 160.A O no hydrogen 2.828 N/A SER 165.A N VAL 161.A O no hydrogen 2.827 N/A PHE 166.A N TYR 162.A O no hydrogen 3.167 N/A LEU 167.A N TYR 162.A O no hydrogen 2.769 N/A TYR 169.A N PHE 166.A O no hydrogen 3.097 N/A SER 170.A OG GLU 239.A OE2 no hydrogen 2.504 N/A GLY 171.A N PHE 168.A O no hydrogen 3.072 N/A PHE 172.A N PHE 168.A O no hydrogen 2.892 N/A TYR 173.A N TYR 169.A O no hydrogen 3.133 N/A LEU 176.A N PHE 172.A O no hydrogen 3.199 N/A TYR 177.A N TYR 173.A O no hydrogen 2.781 N/A PHE 178.A N TYR 174.A O no hydrogen 3.014 N/A TYR 179.A N PRO 175.A O no hydrogen 2.918 N/A TYR 179.A OH GLU 189.A OE2 no hydrogen 2.488 N/A GLY 180.A N LEU 176.A O no hydrogen 2.944 N/A GLN 181.A N PHE 178.A O no hydrogen 2.881 N/A GLN 181.A NE2 TYR 177.A O no hydrogen 3.153 N/A GLY 182.A N TYR 179.A O no hydrogen 2.987 N/A LYS 183.A N PHE 178.A O no hydrogen 2.886 N/A LYS 183.A NZ GLN 181.A OE1 no hydrogen 3.284 N/A LEU 184.A N THR 43.A OG1 no hydrogen 3.153 N/A GLN 186.A N ASP 40.A OD1 no hydrogen 2.873 N/A GLN 186.A NE2 ALA 36.A O no hydrogen 2.615 N/A SER 187.A N ASP 40.A OD2 no hydrogen 2.636 N/A SER 187.A OG ASP 40.A OD2 no hydrogen 2.694 N/A GLY 188.A N LEU 184.A O no hydrogen 2.904 N/A GLU 189.A N MET 185.A O no hydrogen 2.904 N/A ILE 190.A N GLN 186.A O no hydrogen 3.220 N/A ILE 191.A N SER 187.A O no hydrogen 3.033 N/A ASN 192.A N GLY 188.A O no hydrogen 2.938 N/A ASN 192.A ND2 GLY 188.A O no hydrogen 3.039 N/A ASN 192.A ND2 GLY 289.A O no hydrogen 3.382 N/A LEU 193.A N GLU 189.A O no hydrogen 3.128 N/A ILE 194.A N ILE 190.A O no hydrogen 2.949 N/A LEU 195.A N ILE 191.A O no hydrogen 2.792 N/A ARG 196.A N ASN 192.A O no hydrogen 2.870 N/A ARG 196.A NH2 GLN 28.A O no hydrogen 3.027 N/A ARG 196.A NH2 ASP 197.A OD1 no hydrogen 2.896 N/A ASP 197.A N LEU 193.A O no hydrogen 3.092 N/A GLU 198.A N ILE 194.A O no hydrogen 2.927 N/A ALA 199.A N LEU 195.A O no hydrogen 2.971 N/A HIS 201.A N ASP 197.A O no hydrogen 2.940 N/A GLY 202.A N GLU 198.A O no hydrogen 2.827 N/A VAL 203.A N ALA 199.A O no hydrogen 3.191 N/A TYR 204.A N ILE 200.A O no hydrogen 2.986 N/A TYR 204.A OH THR 18.A OG1 no hydrogen 2.787 N/A VAL 205.A N HIS 201.A O no hydrogen 3.043 N/A GLY 206.A N GLY 202.A O no hydrogen 2.967 N/A LEU 207.A N VAL 203.A O no hydrogen 2.912 N/A LEU 208.A N TYR 204.A O no hydrogen 3.151 N/A ALA 209.A N VAL 205.A O no hydrogen 2.919 N/A GLN 210.A N GLY 206.A O no hydrogen 2.957 N/A GLN 210.A NE2 GLY 206.A O no hydrogen 3.589 N/A GLN 210.A NE2 ASN 270.A O no hydrogen 2.800 N/A GLU 211.A N LEU 207.A O no hydrogen 3.099 N/A ILE 212.A N LEU 208.A O no hydrogen 3.365 N/A TYR 213.A N ALA 209.A O no hydrogen 2.979 N/A ASN 214.A N GLN 210.A O no hydrogen 2.868 N/A LYS 215.A N ILE 212.A O no hydrogen 3.095 N/A GLN 216.A N TYR 213.A O no hydrogen 3.128 N/A GLN 216.A NE2 GLU 150.A OE2 no hydrogen 2.963 N/A GLN 216.A NE2 ILE 212.A O no hydrogen 2.976 N/A LYS 220.A N THR 217.A OG1 no hydrogen 2.997 N/A LYS 220.A NZ GLU 223.A OE1 no hydrogen 3.191 N/A LYS 221.A N THR 217.A O no hydrogen 2.902 N/A LYS 221.A NZ GLU 218.A OE2 no hydrogen 3.218 N/A ALA 222.A N GLU 218.A O no hydrogen 2.992 N/A GLU 223.A N GLU 219.A O no hydrogen 3.219 N/A LEU 224.A N LYS 220.A O no hydrogen 2.926 N/A ARG 225.A N LYS 221.A O no hydrogen 2.925 N/A ARG 225.A NH1 TYR 213.A OH no hydrogen 2.779 N/A GLU 226.A N ALA 222.A O no hydrogen 3.149 N/A PHE 227.A N GLU 223.A O no hydrogen 2.862 N/A ALA 228.A N LEU 224.A O no hydrogen 2.909 N/A ILE 229.A N ARG 225.A O no hydrogen 2.886 N/A ASP 230.A N GLU 226.A O no hydrogen 2.823 N/A LEU 231.A N PHE 227.A O no hydrogen 2.888 N/A LEU 232.A N ALA 228.A O no hydrogen 2.935 N/A ASN 233.A N ILE 229.A O no hydrogen 2.919 N/A ASN 233.A ND2 ILE 229.A O no hydrogen 3.223 N/A ASN 233.A ND2 TYR 276.A OH no hydrogen 2.982 N/A GLN 234.A N ASP 230.A O no hydrogen 2.997 N/A LEU 235.A N LEU 231.A O no hydrogen 2.926 N/A TYR 236.A N LEU 232.A O no hydrogen 2.706 N/A GLU 237.A N ASN 233.A O no hydrogen 2.937 N/A ASN 238.A N GLN 234.A O no hydrogen 3.291 N/A ASN 238.A ND2 TYR 130.A O no hydrogen 3.024 N/A GLU 239.A N LEU 235.A O no hydrogen 2.854 N/A LEU 240.A N TYR 236.A O no hydrogen 2.879 N/A GLU 241.A N GLU 237.A O no hydrogen 3.493 N/A TYR 242.A N ASN 238.A O no hydrogen 3.038 N/A THR 243.A N GLU 239.A O no hydrogen 2.738 N/A THR 243.A OG1 GLU 239.A O no hydrogen 2.835 N/A GLU 244.A N LEU 240.A O no hydrogen 2.951 N/A ASP 245.A N GLU 241.A O no hydrogen 2.972 N/A LEU 246.A N TYR 242.A O no hydrogen 3.057 N/A TYR 247.A N THR 243.A O no hydrogen 2.793 N/A TYR 247.A OH SER 170.A O no hydrogen 2.557 N/A ASP 248.A N GLU 244.A O no hydrogen 3.118 N/A GLN 249.A NE2 ASP 53.A OD2 no hydrogen 2.820 N/A GLN 249.A NE2 THR 54.A OG1 no hydrogen 2.926 N/A VAL 250.A N TYR 247.A O no hydrogen 3.004 N/A GLY 251.A N ASP 248.A O no hydrogen 3.221 N/A LEU 252.A N TYR 247.A O no hydrogen 3.206 N/A SER 253.A OG THR 243.A O no hydrogen 3.563 N/A SER 253.A OG ASP 248.A OD1 no hydrogen 2.688 N/A VAL 256.A N LEU 252.A O no hydrogen 3.022 N/A LYS 257.A N SER 253.A O no hydrogen 2.965 N/A LYS 257.A NZ GLU 244.A OE2 no hydrogen 2.720 N/A LYS 258.A N HIS 254.A O no hydrogen 3.207 N/A PHE 259.A N ASP 255.A O no hydrogen 3.208 N/A ILE 260.A N VAL 256.A O no hydrogen 2.905 N/A ARG 261.A N LYS 257.A O no hydrogen 3.145 N/A ARG 261.A NE GLU 280.A OE2 no hydrogen 2.877 N/A ARG 261.A NH1 TYR 236.A OH no hydrogen 2.779 N/A ARG 261.A NH2 GLU 280.A OE1 no hydrogen 2.917 N/A ARG 261.A NH2 GLU 280.A OE2 no hydrogen 3.413 N/A TYR 262.A N LYS 258.A O no hydrogen 3.076 N/A ASN 263.A N PHE 259.A O no hydrogen 3.035 N/A ASN 263.A ND2 PHE 259.A O no hydrogen 2.961 N/A ALA 264.A N ILE 260.A O no hydrogen 2.792 N/A ASN 265.A N ARG 261.A O no hydrogen 3.175 N/A ASN 265.A ND2 PHE 277.A O no hydrogen 2.829 N/A LYS 266.A N TYR 262.A O no hydrogen 3.389 N/A ALA 267.A N ASN 263.A O no hydrogen 2.911 N/A LEU 268.A N ALA 264.A O no hydrogen 2.959 N/A MET 269.A N ASN 265.A O no hydrogen 2.946 N/A ASN 270.A N LYS 266.A O no hydrogen 2.905 N/A ASN 270.A ND2 SER 165.A OG no hydrogen 3.054 N/A LEU 271.A N ALA 267.A O no hydrogen 3.192 N/A LEU 271.A N LEU 268.A O no hydrogen 2.986 N/A GLY 272.A N MET 269.A O no hydrogen 2.925 N/A PHE 273.A N LEU 268.A O no hydrogen 2.944 N/A TYR 276.A N ASN 265.A OD1 no hydrogen 2.852 N/A PHE 277.A N ASN 265.A OD1 no hydrogen 2.998 N/A ASN 283.A ND2 ASP 255.A OD2 no hydrogen 3.349 N/A ILE 285.A N ASN 283.A OD1 no hydrogen 3.155 N/A LEU 287.A N ASN 283.A O no hydrogen 3.341 N/A ASN 288.A N PRO 284.A O no hydrogen 2.937 N/A GLY 289.A N ILE 285.A O no hydrogen 2.922 N/A LEU 290.A N LEU 287.A O no hydrogen 3.344 N/A