Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2x3f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 SER 83.A OG no hydrogen 2.643 N/A THR 1.A OG1 ALA 87.A O no hydrogen 3.429 N/A LYS 2.A N ASP 88.A O no hydrogen 2.967 N/A ILE 4.A N VAL 90.A O no hydrogen 2.850 N/A VAL 7.A N ASP 97.A OD2 no hydrogen 2.947 N/A GLU 9.A N THR 6.A OG1 no hydrogen 3.157 N/A MET 10.A N THR 6.A O no hydrogen 3.212 N/A GLN 11.A N VAL 7.A O no hydrogen 2.929 N/A HIS 12.A N LYS 8.A O no hydrogen 2.989 N/A ILE 13.A N GLU 9.A O no hydrogen 2.996 N/A VAL 14.A N MET 10.A O no hydrogen 3.048 N/A LYS 15.A N GLN 11.A O no hydrogen 2.938 N/A ALA 16.A N HIS 12.A O no hydrogen 3.098 N/A ALA 17.A N ILE 13.A O no hydrogen 2.912 N/A LYS 18.A N VAL 14.A O no hydrogen 2.955 N/A LYS 18.A NZ MET 140.A O no hydrogen 2.715 N/A ARG 19.A N LYS 15.A O no hydrogen 3.204 N/A ARG 19.A NH1 ARG 19.A O no hydrogen 3.124 N/A SER 20.A N ALA 16.A O no hydrogen 3.251 N/A SER 20.A N ALA 17.A O no hydrogen 3.138 N/A SER 20.A OG ALA 16.A O no hydrogen 3.552 N/A SER 20.A OG ALA 17.A O no hydrogen 3.225 N/A SER 20.A OG THR 22.A OG1 no hydrogen 2.673 N/A GLY 21.A N LYS 18.A O no hydrogen 3.004 N/A THR 22.A N ALA 17.A O no hydrogen 2.962 N/A THR 22.A OG1 SER 20.A OG no hydrogen 2.673 N/A THR 23.A N ASP 49.A OD2 no hydrogen 2.994 N/A ILE 24.A N ASP 142.A OD2 no hydrogen 2.726 N/A GLY 25.A N ILE 50.A O no hydrogen 2.947 N/A PHE 26.A N TYR 143.A O no hydrogen 2.848 N/A ILE 27.A N VAL 52.A O no hydrogen 2.960 N/A THR 29.A N SER 54.A O no hydrogen 2.982 N/A THR 29.A OG1 SER 54.A O no hydrogen 2.696 N/A GLY 31.A N THR 29.A OG1 no hydrogen 2.931 N/A ALA 32.A N ASP 78.A OD2 no hydrogen 2.841 N/A LEU 33.A N ASP 78.A OD1 no hydrogen 2.919 N/A HIS 34.A N HIS 37.A ND1 no hydrogen 3.102 N/A GLY 36.A N HIS 34.A ND1 no hydrogen 3.135 N/A LEU 38.A N HIS 34.A O no hydrogen 3.089 N/A THR 39.A N ASP 35.A O no hydrogen 2.920 N/A THR 39.A OG1 ASP 35.A O no hydrogen 2.796 N/A MET 40.A N GLY 36.A O no hydrogen 3.451 N/A VAL 41.A N HIS 37.A O no hydrogen 2.952 N/A ARG 42.A N LEU 38.A O no hydrogen 2.783 N/A GLU 43.A N THR 39.A O no hydrogen 3.149 N/A SER 44.A N MET 40.A O no hydrogen 3.003 N/A SER 44.A OG ASN 48.A OD1 no hydrogen 3.476 N/A SER 44.A OG THR 51.A OG1 no hydrogen 2.707 N/A VAL 45.A N VAL 41.A O no hydrogen 2.888 N/A SER 46.A N ARG 42.A O no hydrogen 3.120 N/A THR 47.A N GLU 43.A O no hydrogen 3.069 N/A THR 47.A N SER 44.A O no hydrogen 3.180 N/A THR 47.A OG1 GLU 43.A O no hydrogen 3.252 N/A ASN 48.A N SER 44.A O no hydrogen 2.866 N/A ASP 49.A N THR 23.A OG1 no hydrogen 2.733 N/A ILE 50.A N THR 23.A O no hydrogen 2.916 N/A THR 51.A N ASP 88.A OD2 no hydrogen 2.904 N/A THR 51.A OG1 SER 44.A OG no hydrogen 2.707 N/A VAL 52.A N GLY 25.A O no hydrogen 2.897 N/A VAL 53.A N ILE 89.A O no hydrogen 2.874 N/A SER 54.A N ILE 27.A O no hydrogen 3.090 N/A VAL 55.A N PHE 91.A O no hydrogen 2.874 N/A PHE 56.A N THR 29.A O no hydrogen 3.141 N/A ASN 58.A ND2 GLN 61.A OE1 no hydrogen 2.848 N/A ASN 58.A ND2 GLY 127.A O no hydrogen 3.030 N/A GLN 61.A N ASN 58.A O no hydrogen 3.223 N/A PHE 62.A N PRO 59.A O no hydrogen 3.248 N/A GLY 63.A N GLU 66.A OE1 no hydrogen 2.812 N/A GLU 66.A N GLY 63.A O no hydrogen 3.326 N/A ARG 73.A NH1 PHE 68.A O no hydrogen 2.992 N/A ARG 73.A NH1 TYR 71.A O no hydrogen 2.908 N/A ARG 73.A NH2 PHE 68.A O no hydrogen 3.408 N/A GLN 74.A NE2 ASP 78.A OD1 no hydrogen 3.120 N/A ASP 78.A N GLN 74.A O no hydrogen 2.867 N/A LEU 79.A N ILE 75.A O no hydrogen 2.788 N/A GLU 80.A N ASP 76.A O no hydrogen 2.973 N/A LEU 81.A N LYS 77.A O no hydrogen 2.876 N/A VAL 82.A N ASP 78.A O no hydrogen 3.130 N/A SER 83.A N LEU 79.A O no hydrogen 2.975 N/A SER 83.A OG THR 1.A OG1 no hydrogen 2.643 N/A SER 83.A OG LEU 79.A O no hydrogen 2.547 N/A GLU 84.A N GLU 80.A O no hydrogen 3.032 N/A GLY 86.A N SER 83.A O no hydrogen 3.048 N/A ALA 87.A N VAL 82.A O no hydrogen 3.041 N/A ASP 88.A N THR 51.A O no hydrogen 2.962 N/A ILE 89.A N THR 51.A O no hydrogen 3.218 N/A VAL 90.A N LYS 2.A O no hydrogen 2.824 N/A PHE 91.A N VAL 53.A O no hydrogen 2.799 N/A HIS 92.A N ILE 4.A O no hydrogen 2.842 N/A HIS 92.A ND1 VAL 55.A O no hydrogen 2.673 N/A ASP 97.A N ALA 94.A O no hydrogen 2.984 N/A MET 98.A N ALA 94.A O no hydrogen 3.142 N/A TYR 99.A N VAL 95.A O no hydrogen 2.738 N/A TYR 99.A OH ASN 58.A OD1 no hydrogen 2.808 N/A VAL 109.A N ASP 126.A OD1 no hydrogen 2.717 N/A ALA 113.A N GLY 110.A O no hydrogen 2.931 N/A ASP 114.A N PRO 111.A O no hydrogen 3.112 N/A GLU 117.A N GLN 152.A OE1 no hydrogen 2.959 N/A GLY 118.A N VAL 115.A O no hydrogen 3.066 N/A ALA 119.A N LEU 116.A O no hydrogen 3.076 N/A LYS 120.A N LEU 116.A O no hydrogen 2.904 N/A LYS 120.A NZ GLU 240.A O no hydrogen 3.169 N/A ARG 121.A N GLU 117.A O no hydrogen 2.735 N/A ARG 121.A NE GLU 66.A OE2 no hydrogen 2.839 N/A ARG 121.A NH2 GLU 66.A OE1 no hydrogen 2.935 N/A ARG 121.A NH2 GLU 66.A OE2 no hydrogen 3.518 N/A HIS 124.A N ARG 121.A O no hydrogen 2.991 N/A HIS 124.A ND1 GLN 61.A O no hydrogen 2.780 N/A GLY 127.A N GLY 123.A O no hydrogen 3.070 N/A VAL 128.A N HIS 124.A O no hydrogen 3.084 N/A VAL 129.A N PHE 125.A O no hydrogen 2.972 N/A THR 130.A N ASP 126.A O no hydrogen 3.089 N/A THR 130.A OG1 ASP 126.A O no hydrogen 2.753 N/A VAL 131.A N GLY 127.A O no hydrogen 3.140 N/A VAL 132.A N VAL 128.A O no hydrogen 2.876 N/A ASN 133.A N VAL 129.A O no hydrogen 2.844 N/A LYS 134.A N THR 130.A O no hydrogen 3.271 N/A LYS 134.A NZ MET 98.A O no hydrogen 2.728 N/A LEU 135.A N VAL 131.A O no hydrogen 2.940 N/A PHE 136.A N VAL 132.A O no hydrogen 2.887 N/A ASN 137.A N ASN 133.A O no hydrogen 3.116 N/A ILE 138.A N LYS 134.A O no hydrogen 2.906 N/A VAL 139.A N LEU 135.A O no hydrogen 2.890 N/A MET 140.A N PHE 136.A O no hydrogen 2.962 N/A ASP 142.A N ILE 24.A O no hydrogen 2.836 N/A TYR 143.A N ILE 24.A O no hydrogen 3.291 N/A ALA 144.A N GLU 169.A O no hydrogen 2.942 N/A TYR 145.A N PHE 26.A O no hydrogen 2.847 N/A TYR 145.A OH ASN 48.A OD1 no hydrogen 3.031 N/A PHE 146.A N ILE 171.A O no hydrogen 2.909 N/A LYS 148.A N ILE 173.A O no hydrogen 2.869 N/A ASP 150.A N GLY 147.A O no hydrogen 3.198 N/A GLN 152.A NE2 LEU 112.A O no hydrogen 2.805 N/A GLN 152.A NE2 VAL 115.A O no hydrogen 2.908 N/A LEU 154.A N ASP 150.A O no hydrogen 2.889 N/A ALA 155.A N ALA 151.A O no hydrogen 3.099 N/A ILE 156.A N GLN 152.A O no hydrogen 3.079 N/A VAL 157.A N GLN 153.A O no hydrogen 2.848 N/A GLU 158.A N LEU 154.A O no hydrogen 2.964 N/A GLN 159.A N ALA 155.A O no hydrogen 3.052 N/A GLN 159.A NE2 ASP 163.A OD1 no hydrogen 2.846 N/A MET 160.A N ILE 156.A O no hydrogen 2.885 N/A VAL 161.A N VAL 157.A O no hydrogen 2.913 N/A LYS 162.A N GLU 158.A O no hydrogen 3.189 N/A ASP 163.A N GLN 159.A O no hydrogen 2.799 N/A PHE 164.A N MET 160.A O no hydrogen 2.889 N/A ASN 165.A N LYS 162.A O no hydrogen 3.299 N/A HIS 166.A N VAL 161.A O no hydrogen 3.130 N/A HIS 166.A NE2 ASN 133.A OD1 no hydrogen 2.848 N/A GLU 169.A N ASP 142.A O no hydrogen 2.917 N/A ILE 171.A N ALA 144.A O no hydrogen 2.908 N/A ILE 173.A N PHE 146.A O no hydrogen 2.770 N/A ARG 177.A NH1 GLY 181.A O no hydrogen 2.935 N/A ARG 177.A NH1 ASP 275.A OD1 no hydrogen 3.471 N/A ARG 177.A NH1 ASP 275.A OD2 no hydrogen 2.777 N/A ARG 177.A NH2 ASP 275.A OD1 no hydrogen 2.869 N/A ARG 177.A NH2 ASP 275.A OD2 no hydrogen 3.512 N/A GLU 178.A N LEU 182.A O no hydrogen 2.803 N/A GLY 181.A N GLU 178.A O no hydrogen 2.850 N/A LEU 182.A N ASP 180.A OD1 no hydrogen 3.137 N/A LYS 184.A N VAL 176.A O no hydrogen 2.945 N/A LYS 184.A NZ GLU 178.A OE1 no hydrogen 3.299 N/A LYS 184.A NZ GLU 178.A OE2 no hydrogen 3.007 N/A SER 186.A OG GLY 31.A O no hydrogen 3.342 N/A SER 186.A OG ALA 32.A O no hydrogen 2.575 N/A ARG 187.A N SER 185.A OG no hydrogen 3.040 N/A ARG 187.A NE ASP 67.A OD1 no hydrogen 3.508 N/A ARG 187.A NE ASP 67.A OD2 no hydrogen 3.268 N/A ARG 187.A NH2 ASP 67.A OD1 no hydrogen 3.087 N/A ASN 188.A N SER 185.A O no hydrogen 3.044 N/A ASN 188.A ND2 ALA 183.A O no hydrogen 2.995 N/A TYR 190.A N ARG 187.A O no hydrogen 3.105 N/A TYR 190.A OH ASP 67.A OD2 no hydrogen 2.475 N/A LEU 191.A N ASN 188.A O no hydrogen 3.065 N/A THR 192.A N GLU 195.A OE1 no hydrogen 3.050 N/A GLU 195.A N THR 192.A OG1 no hydrogen 3.240 N/A ARG 196.A N THR 192.A O no hydrogen 2.884 N/A ARG 196.A NH1 ASP 180.A OD2 no hydrogen 2.834 N/A ARG 196.A NH1 ARG 196.A O no hydrogen 3.107 N/A ARG 196.A NH2 ASP 180.A OD1 no hydrogen 3.436 N/A ARG 196.A NH2 ASP 180.A OD2 no hydrogen 3.026 N/A GLN 197.A N GLU 193.A O no hydrogen 3.350 N/A GLU 198.A N GLN 194.A O no hydrogen 3.008 N/A ALA 199.A N GLU 195.A O no hydrogen 2.579 N/A HIS 201.A N GLU 198.A O no hydrogen 2.901 N/A HIS 201.A ND1 TYR 230.A OH no hydrogen 2.860 N/A LEU 202.A N ALA 199.A O no hydrogen 3.119 N/A SER 203.A OG VAL 200.A O no hydrogen 2.834 N/A LYS 204.A N VAL 200.A O no hydrogen 3.286 N/A SER 205.A N HIS 201.A O no hydrogen 2.948 N/A SER 205.A OG LEU 202.A O no hydrogen 2.748 N/A LEU 206.A N LEU 202.A O no hydrogen 3.247 N/A LEU 207.A N SER 203.A O no hydrogen 3.146 N/A LEU 208.A N LYS 204.A O no hydrogen 2.977 N/A ALA 209.A N SER 205.A O no hydrogen 2.906 N/A GLN 210.A N LEU 206.A O no hydrogen 2.907 N/A ALA 211.A N LEU 207.A O no hydrogen 2.916 N/A LEU 212.A N LEU 208.A O no hydrogen 2.981 N/A TYR 213.A N ALA 209.A O no hydrogen 2.999 N/A GLN 214.A N GLN 210.A O no hydrogen 2.690 N/A ASP 215.A N ALA 211.A O no hydrogen 2.703 N/A GLY 216.A N TYR 213.A O no hydrogen 3.025 N/A GLU 217.A N LEU 212.A O no hydrogen 2.900 N/A ARG 218.A NH1 TYR 213.A O no hydrogen 2.836 N/A ARG 218.A NH1 GLU 217.A O no hydrogen 2.858 N/A GLN 219.A N GLU 217.A OE2 no hydrogen 2.972 N/A SER 220.A N HIS 254.A O no hydrogen 2.823 N/A SER 220.A OG GLN 253.A O no hydrogen 3.109 N/A SER 220.A OG HIS 254.A O no hydrogen 3.380 N/A VAL 222.A N GLN 219.A O no hydrogen 3.108 N/A ILE 223.A N GLN 219.A O no hydrogen 3.328 N/A ILE 224.A N SER 220.A O no hydrogen 2.852 N/A ASP 225.A N LYS 221.A O no hydrogen 2.978 N/A LYS 226.A N VAL 222.A O no hydrogen 2.969 N/A VAL 227.A N ILE 223.A O no hydrogen 2.866 N/A THR 228.A N ILE 224.A O no hydrogen 2.840 N/A THR 228.A OG1 ILE 224.A O no hydrogen 2.588 N/A GLN 229.A N ASP 225.A O no hydrogen 2.765 N/A TYR 230.A N LYS 226.A O no hydrogen 3.029 N/A TYR 230.A OH HIS 201.A ND1 no hydrogen 2.860 N/A LEU 231.A N VAL 227.A O no hydrogen 2.932 N/A GLU 232.A N THR 228.A O no hydrogen 2.923 N/A SER 233.A N GLN 229.A O no hydrogen 3.179 N/A SER 233.A OG GLN 229.A O no hydrogen 3.508 N/A SER 233.A OG TYR 230.A O no hydrogen 3.168 N/A SER 233.A OG HIS 234.A ND1 no hydrogen 3.148 N/A HIS 234.A N LEU 231.A O no hydrogen 2.990 N/A HIS 234.A ND1 TYR 230.A O no hydrogen 2.697 N/A ILE 235.A N LEU 231.A O no hydrogen 2.897 N/A SER 236.A N GLU 198.A OE1 no hydrogen 2.775 N/A SER 236.A OG GLU 198.A OE1 no hydrogen 2.726 N/A ARG 238.A N LYS 267.A O no hydrogen 2.866 N/A GLU 240.A N ALA 265.A O no hydrogen 2.810 N/A GLU 241.A N ALA 265.A O no hydrogen 3.106 N/A ALA 243.A N SER 263.A O no hydrogen 2.965 N/A TYR 245.A N PHE 261.A O no hydrogen 3.127 N/A SER 246.A N VAL 251.A O no hydrogen 2.903 N/A SER 246.A OG VAL 251.A O no hydrogen 3.557 N/A TYR 247.A N ARG 259.A O no hydrogen 2.994 N/A TYR 247.A OH ALA 151.A O no hydrogen 2.760 N/A GLN 249.A N GLN 249.A OE1 no hydrogen 2.781 N/A LEU 250.A N SER 246.A O no hydrogen 2.911 N/A VAL 251.A N SER 246.A OG no hydrogen 3.132 N/A GLN 253.A N VAL 244.A O no hydrogen 3.014 N/A GLN 253.A NE2 VAL 251.A O no hydrogen 3.004 N/A GLN 253.A NE2 GLU 252.A O no hydrogen 3.372 N/A ILE 256.A N ARG 218.A O no hydrogen 2.732 N/A ILE 260.A N ILE 279.A O no hydrogen 2.884 N/A PHE 261.A N TYR 245.A O no hydrogen 2.779 N/A ILE 262.A N ILE 277.A O no hydrogen 2.838 N/A SER 263.A N ALA 243.A O no hydrogen 2.933 N/A LEU 264.A N ASP 275.A O no hydrogen 2.882 N/A ALA 265.A N GLU 241.A O no hydrogen 3.029 N/A VAL 266.A N LEU 273.A O no hydrogen 2.934 N/A LYS 267.A N ARG 238.A O no hydrogen 2.765 N/A PHE 268.A N ALA 271.A O no hydrogen 2.768 N/A SER 269.A N GLU 195.A OE2 no hydrogen 2.982 N/A ARG 272.A NE GLU 240.A OE1 no hydrogen 3.256 N/A ARG 272.A NE GLU 240.A OE2 no hydrogen 3.297 N/A ARG 272.A NH1 GLU 117.A OE1 no hydrogen 2.730 N/A ARG 272.A NH2 GLU 117.A OE1 no hydrogen 3.433 N/A ARG 272.A NH2 GLU 117.A OE2 no hydrogen 2.867 N/A ARG 272.A NH2 GLU 240.A OE1 no hydrogen 3.212 N/A LEU 273.A N VAL 266.A O no hydrogen 2.888 N/A ASP 275.A N LEU 264.A O no hydrogen 3.250 N/A ASN 276.A N ASP 275.A OD1 no hydrogen 2.851 N/A ASN 276.A ND2 LYS 148.A O no hydrogen 2.964 N/A ASN 276.A ND2 LYS 149.A O no hydrogen 3.173 N/A ILE 277.A N ILE 262.A O no hydrogen 3.007 N/A ILE 279.A N ILE 260.A O no hydrogen 2.891 N/A