Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dko_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A N MET 145.A O no hydrogen 2.811 N/A ILE 3.A N GLN 81.A OE1 no hydrogen 2.732 N/A GLU 6.A N ASP 4.A OD1 no hydrogen 2.919 N/A THR 7.A N ASP 4.A O no hydrogen 2.880 N/A THR 7.A OG1 ASP 4.A O no hydrogen 2.661 N/A TYR 8.A N PRO 5.A O no hydrogen 3.321 N/A ARG 13.A N ASP 10.A O no hydrogen 3.248 N/A ALA 14.A N PRO 11.A O no hydrogen 3.250 N/A VAL 15.A N PRO 11.A O no hydrogen 3.425 N/A HIS 16.A N ASN 12.A O no hydrogen 3.019 N/A GLN 17.A N ARG 13.A O no hydrogen 3.009 N/A PHE 18.A N ALA 14.A O no hydrogen 3.082 N/A ALA 19.A N VAL 15.A O no hydrogen 2.987 N/A LEU 22.A N VAL 93.A O no hydrogen 2.680 N/A SER 25.A OG ASP 23.A OD2 no hydrogen 2.553 N/A CYS 26.A N ASP 23.A O no hydrogen 2.977 N/A CYS 26.A SG ASP 23.A OD2 no hydrogen 3.509 N/A ILE 27.A N ALA 24.A O no hydrogen 3.088 N/A LYS 28.A N ARG 44.A O no hydrogen 2.793 N/A LYS 28.A NZ GLU 30.A OE2 no hydrogen 2.682 N/A GLU 30.A N SER 42.A O no hydrogen 2.883 N/A ARG 31.A N SER 42.A O no hydrogen 3.443 N/A ILE 33.A N VAL 40.A O no hydrogen 2.653 N/A GLY 34.A N VAL 40.A O no hydrogen 2.928 N/A VAL 40.A N GLY 34.A O no hydrogen 2.770 N/A CYS 41.A N ILE 57.A O no hydrogen 2.832 N/A SER 42.A N ARG 31.A O no hydrogen 2.852 N/A GLY 43.A N VAL 55.A O no hydrogen 2.907 N/A ARG 44.A N LYS 28.A O no hydrogen 2.850 N/A LEU 45.A N VAL 53.A O no hydrogen 2.897 N/A LYS 46.A N CYS 26.A O no hydrogen 2.774 N/A VAL 53.A N LEU 45.A O no hydrogen 3.070 N/A VAL 55.A N GLY 43.A O no hydrogen 3.031 N/A ALA 56.A N ILE 104.A O no hydrogen 2.659 N/A ILE 57.A N CYS 41.A O no hydrogen 2.729 N/A LYS 58.A N ILE 102.A O no hydrogen 2.851 N/A LYS 58.A NZ GLU 75.A OE1 no hydrogen 2.810 N/A THR 59.A N GLU 39.A O no hydrogen 2.861 N/A THR 59.A OG1 GLU 39.A O no hydrogen 2.859 N/A LEU 60.A N VAL 100.A O no hydrogen 2.906 N/A LYS 61.A N PHE 37.A O no hydrogen 2.869 N/A THR 65.A N GLN 68.A OE1 no hydrogen 2.963 N/A THR 65.A OG1 GLN 68.A OE1 no hydrogen 3.412 N/A GLN 68.A N THR 65.A OG1 no hydrogen 3.193 N/A ARG 69.A N THR 65.A O no hydrogen 3.148 N/A ARG 69.A NE THR 95.A O no hydrogen 2.983 N/A ARG 69.A NH1 THR 95.A O no hydrogen 3.236 N/A ARG 69.A NH2 ASN 12.A OD1 no hydrogen 3.118 N/A ARG 70.A N GLU 66.A O no hydrogen 3.096 N/A ASP 71.A N LYS 67.A O no hydrogen 3.355 N/A PHE 72.A N GLN 68.A O no hydrogen 3.129 N/A LEU 73.A N ARG 69.A O no hydrogen 2.902 N/A CYS 74.A N.A ARG 70.A O no hydrogen 2.985 N/A CYS 74.A N.B ARG 70.A O no hydrogen 2.996 N/A CYS 74.A SG.A ARG 70.A O no hydrogen 3.194 N/A GLU 75.A N PHE 72.A O no hydrogen 3.403 N/A ALA 76.A N LEU 73.A O no hydrogen 2.805 N/A SER 77.A N LEU 73.A O no hydrogen 3.266 N/A ILE 78.A N CYS 74.A O.A no hydrogen 3.070 N/A ILE 78.A N CYS 74.A O.B no hydrogen 3.072 N/A MET 79.A N GLU 75.A O no hydrogen 2.867 N/A GLY 80.A N ALA 76.A O no hydrogen 2.861 N/A GLN 81.A N ILE 78.A O no hydrogen 3.051 N/A GLN 81.A NE2 ILE 3.A O no hydrogen 2.774 N/A GLN 81.A NE2 SER 77.A O no hydrogen 2.991 N/A PHE 82.A N MET 79.A O no hydrogen 3.047 N/A ASP 83.A N TYR 141.A OH no hydrogen 2.943 N/A ASN 86.A N HIS 84.A ND1 no hydrogen 3.038 N/A ASN 86.A ND2 CYS 165.A O no hydrogen 2.961 N/A VAL 87.A N HIS 84.A O no hydrogen 3.129 N/A VAL 88.A N VAL 167.A O no hydrogen 3.016 N/A HIS 89.A N GLU 105.A OE2 no hydrogen 2.933 N/A GLU 91.A N VAL 103.A O no hydrogen 2.778 N/A GLY 92.A N VAL 103.A O no hydrogen 3.240 N/A VAL 93.A N LYS 20.A O no hydrogen 2.803 N/A VAL 94.A N MET 101.A O no hydrogen 2.962 N/A THR 95.A N GLU 21.A OE2 no hydrogen 2.813 N/A THR 95.A OG1 GLU 21.A OE1 no hydrogen 2.745 N/A THR 95.A OG1 GLU 21.A OE2 no hydrogen 3.429 N/A MET 101.A N VAL 94.A O no hydrogen 2.994 N/A ILE 102.A N LYS 58.A O no hydrogen 2.905 N/A VAL 103.A N GLY 92.A O no hydrogen 2.862 N/A ILE 104.A N ALA 56.A O no hydrogen 2.804 N/A GLU 105.A N HIS 89.A O no hydrogen 2.926 N/A ASN 109.A N VAL 159.A O no hydrogen 2.853 N/A ASN 109.A ND2 ASN 160.A O no hydrogen 3.185 N/A GLY 110.A N MET 107.A O no hydrogen 3.122 N/A LEU 112.A N ILE 157.A O no hydrogen 2.704 N/A PHE 115.A N ALA 111.A O no hydrogen 3.032 N/A LEU 116.A N LEU 112.A O no hydrogen 2.937 N/A ARG 117.A N ASP 113.A O no hydrogen 3.136 N/A ARG 117.A NH1 ASP 113.A OD2 no hydrogen 3.307 N/A ARG 117.A NH1 GLY 206.A O no hydrogen 2.744 N/A ARG 117.A NH2 ASP 113.A OD2 no hydrogen 2.862 N/A LYS 118.A N ALA 114.A O no hydrogen 3.052 N/A HIS 119.A N PHE 115.A O no hydrogen 3.084 N/A HIS 119.A N LEU 116.A O no hydrogen 2.938 N/A HIS 119.A ND1 PHE 115.A O no hydrogen 3.018 N/A GLN 122.A N HIS 119.A O no hydrogen 3.032 N/A PHE 123.A N TYR 205.A OH no hydrogen 2.961 N/A THR 124.A N GLN 127.A OE1 no hydrogen 2.907 N/A THR 124.A OG1 GLN 127.A OE1 no hydrogen 3.351 N/A GLN 127.A N THR 124.A OG1 no hydrogen 3.268 N/A LEU 128.A N THR 124.A O no hydrogen 2.967 N/A VAL 129.A N VAL 125.A O no hydrogen 2.803 N/A GLY 130.A N ILE 126.A O no hydrogen 2.868 N/A MET 131.A N GLN 127.A O no hydrogen 3.085 N/A LEU 132.A N LEU 128.A O no hydrogen 3.078 N/A ARG 133.A N VAL 129.A O no hydrogen 2.782 N/A ARG 133.A NE ASP 264.A OD1 no hydrogen 2.745 N/A ARG 133.A NH2 ASP 264.A OD2 no hydrogen 3.346 N/A GLY 134.A N GLY 130.A O no hydrogen 3.043 N/A ILE 135.A N MET 131.A O no hydrogen 3.085 N/A ALA 136.A N LEU 132.A O no hydrogen 2.884 N/A ALA 137.A N ARG 133.A O no hydrogen 2.937 N/A GLY 138.A N GLY 134.A O no hydrogen 2.989 N/A MET 139.A N ILE 135.A O no hydrogen 2.908 N/A ARG 140.A N ALA 136.A O no hydrogen 2.852 N/A TYR 141.A N ALA 137.A O no hydrogen 3.102 N/A LEU 142.A N GLY 138.A O no hydrogen 3.017 N/A ALA 143.A N MET 139.A O no hydrogen 2.773 N/A ASP 144.A N.A ARG 140.A O no hydrogen 3.074 N/A ASP 144.A N.B ARG 140.A O no hydrogen 3.073 N/A MET 145.A N TYR 141.A O no hydrogen 3.077 N/A GLY 146.A N ALA 143.A O no hydrogen 3.033 N/A TYR 147.A N LEU 142.A O no hydrogen 2.871 N/A HIS 149.A N ASP 191.A OD2 no hydrogen 2.879 N/A HIS 149.A NE2 SER 168.A O no hydrogen 2.644 N/A ARG 150.A N ASP 191.A OD1 no hydrogen 3.118 N/A ASP 151.A N HIS 149.A ND1 no hydrogen 3.116 N/A ALA 154.A N GLU 201.A OE2 no hydrogen 2.966 N/A ASN 156.A N ALA 153.A O no hydrogen 2.758 N/A ASN 156.A ND2 ASP 151.A O no hydrogen 2.699 N/A ASN 156.A ND2 ASP 151.A OD2 no hydrogen 2.958 N/A ILE 157.A N ALA 154.A O no hydrogen 3.137 N/A LEU 158.A N LYS 166.A O no hydrogen 3.008 N/A VAL 159.A N GLY 110.A O no hydrogen 2.846 N/A ASN 160.A N VAL 164.A O no hydrogen 3.138 N/A LEU 163.A N ASN 160.A O no hydrogen 2.861 N/A VAL 164.A N ASN 160.A OD1 no hydrogen 3.040 N/A CYS 165.A SG LEU 163.A O no hydrogen 3.831 N/A LYS 166.A N LEU 158.A O no hydrogen 2.915 N/A LYS 166.A NZ GLU 105.A OE1 no hydrogen 2.752 N/A LYS 166.A NZ GLU 105.A OE2 no hydrogen 2.915 N/A VAL 167.A N ASN 86.A O no hydrogen 2.848 N/A SER 168.A N ASN 156.A O no hydrogen 2.979 N/A SER 168.A OG LYS 166.A O no hydrogen 3.045 N/A PHE 170.A N ASN 156.A OD1 no hydrogen 2.912 N/A GLY 171.A N ASP 169.A OD1 no hydrogen 3.051 N/A ARG 174.A NH1 MET 213.A O no hydrogen 2.817 N/A ARG 174.A NH1 ASN 215.A OD1 no hydrogen 3.027 N/A ARG 174.A NH2 PRO 209.A O no hydrogen 2.939 N/A ARG 174.A NH2 MET 213.A O no hydrogen 3.204 N/A TRP 175.A N PRO 172.A O no hydrogen 2.977 N/A TRP 175.A NE1 GLU 201.A OE2 no hydrogen 2.906 N/A THR 176.A N VAL 173.A O no hydrogen 3.080 N/A THR 176.A OG1 PRO 172.A O no hydrogen 2.698 N/A GLU 179.A N GLU 179.A OE1 no hydrogen 2.871 N/A ALA 180.A N ALA 177.A O no hydrogen 3.037 N/A ILE 181.A N ALA 177.A O no hydrogen 3.006 N/A GLN 182.A N PRO 178.A O no hydrogen 2.943 N/A TYR 183.A N GLU 179.A O no hydrogen 3.029 N/A LYS 185.A N GLU 179.A O no hydrogen 3.133 N/A THR 187.A N SER 190.A OG no hydrogen 2.745 N/A SER 190.A N THR 187.A OG1 no hydrogen 3.183 N/A SER 190.A OG THR 187.A O no hydrogen 2.738 N/A ASP 191.A N THR 187.A O no hydrogen 3.064 N/A VAL 192.A N SER 188.A O no hydrogen 2.993 N/A TRP 193.A N ALA 189.A O no hydrogen 3.365 N/A SER 194.A N SER 190.A O no hydrogen 3.168 N/A SER 194.A OG TRP 175.A O no hydrogen 2.664 N/A SER 194.A OG SER 190.A O no hydrogen 3.381 N/A TYR 195.A N ASP 191.A O no hydrogen 2.801 N/A TYR 195.A OH LEU 132.A O no hydrogen 2.736 N/A GLY 196.A N VAL 192.A O no hydrogen 3.020 N/A ILE 197.A N TRP 193.A O no hydrogen 3.191 N/A VAL 198.A N SER 194.A O no hydrogen 2.907 N/A MET 199.A N TYR 195.A O no hydrogen 2.802 N/A TRP 200.A N GLY 196.A O no hydrogen 3.140 N/A TRP 200.A NE1 PRO 229.A O no hydrogen 3.049 N/A GLU 201.A N ILE 197.A O no hydrogen 2.852 N/A VAL 202.A N VAL 198.A O no hydrogen 2.894 N/A MET 203.A N MET 199.A O no hydrogen 3.018 N/A SER 204.A N TRP 200.A O no hydrogen 3.004 N/A SER 204.A OG TRP 200.A O no hydrogen 3.018 N/A SER 204.A OG GLU 201.A O no hydrogen 3.261 N/A TYR 205.A N VAL 202.A O no hydrogen 2.981 N/A GLY 206.A N GLU 201.A O no hydrogen 2.716 N/A ARG 208.A N GLU 207.A OE2.B no hydrogen 2.886 N/A ARG 208.A NH1 TRP 211.A O no hydrogen 2.602 N/A TRP 211.A N ARG 208.A O no hydrogen 2.887 N/A TRP 211.A NE1 GLU 207.A OE2.A no hydrogen 2.986 N/A MET 213.A N TYR 210.A O no hydrogen 2.974 N/A ASP 217.A N SER 214.A OG no hydrogen 3.037 N/A VAL 218.A N SER 214.A O no hydrogen 2.890 N/A ILE 219.A N ASN 215.A O no hydrogen 3.057 N/A LYS 220.A N GLN 216.A O no hydrogen 3.064 N/A ALA 221.A N ASP 217.A O no hydrogen 3.001 N/A ILE 222.A N VAL 218.A O no hydrogen 2.905 N/A GLU 223.A N ILE 219.A O no hydrogen 2.946 N/A GLU 224.A N LYS 220.A O no hydrogen 2.935 N/A GLY 225.A N ILE 222.A O no hydrogen 3.050 N/A TYR 226.A N ALA 221.A O no hydrogen 2.831 N/A ARG 227.A NE TRP 246.A O no hydrogen 2.973 N/A ARG 227.A NH1 ILE 222.A O no hydrogen 3.018 N/A ARG 227.A NH1 TYR 226.A O no hydrogen 2.865 N/A ARG 227.A NH2 TRP 246.A O no hydrogen 2.958 N/A CYS 234.A N PRO 231.A O no hydrogen 2.960 N/A CYS 234.A SG PRO 235.A O no hydrogen 3.594 N/A GLY 237.A N ALA 273.A O no hydrogen 2.583 N/A HIS 239.A N PRO 235.A O no hydrogen 3.182 N/A HIS 239.A NE2 LEU 228.A O no hydrogen 2.771 N/A GLN 240.A N ALA 236.A O no hydrogen 2.790 N/A GLN 240.A NE2 ASP 244.A OD1 no hydrogen 3.084 N/A LEU 241.A N GLY 237.A O no hydrogen 3.131 N/A MET 242.A N LEU 238.A O no hydrogen 3.075 N/A LEU 243.A N HIS 239.A O no hydrogen 2.859 N/A ASP 244.A N GLN 240.A O no hydrogen 2.896 N/A CYS 245.A N LEU 241.A O no hydrogen 3.024 N/A CYS 245.A SG LEU 241.A O no hydrogen 3.447 N/A TRP 246.A N MET 242.A O no hydrogen 3.090 N/A TRP 246.A N LEU 243.A O no hydrogen 3.061 N/A GLN 247.A N ASP 244.A O no hydrogen 3.327 N/A GLU 252.A N GLU 249.A O no hydrogen 2.830 N/A ARG 253.A N ARG 250.A O no hydrogen 3.095 N/A ARG 253.A NE GLN 247.A O no hydrogen 2.739 N/A ARG 253.A NH1 GLU 179.A OE1 no hydrogen 3.542 N/A ARG 253.A NH1 GLU 179.A OE2 no hydrogen 2.857 N/A ARG 253.A NH1 ALA 189.A O no hydrogen 3.062 N/A ARG 253.A NH2 GLU 179.A OE1 no hydrogen 2.885 N/A ARG 253.A NH2 GLN 247.A O no hydrogen 3.044 N/A LYS 255.A N GLN 258.A OE1 no hydrogen 2.871 N/A LYS 255.A NZ ARG 253.A O no hydrogen 3.494 N/A ILE 259.A N LYS 255.A O no hydrogen 2.918 N/A VAL 260.A N PHE 256.A O no hydrogen 2.851 N/A GLY 261.A N GLU 257.A O no hydrogen 3.126 N/A ILE 262.A N GLN 258.A O no hydrogen 2.934 N/A LEU 263.A N ILE 259.A O no hydrogen 2.958 N/A ASP 264.A N VAL 260.A O no hydrogen 2.841 N/A LYS 265.A N GLY 261.A O no hydrogen 3.167 N/A MET 266.A N ILE 262.A O no hydrogen 3.175 N/A ILE 267.A N LEU 263.A O no hydrogen 2.861 N/A ARG 268.A N ASP 264.A O no hydrogen 2.848 N/A ASN 269.A N LYS 265.A O no hydrogen 2.817 N/A ASN 271.A N ASN 269.A OD1 no hydrogen 3.201 N/A SER 272.A N ASN 269.A O no hydrogen 2.964 N/A SER 272.A OG LYS 265.A O no hydrogen 3.468 N/A SER 272.A OG ASN 269.A O no hydrogen 2.840 N/A ALA 273.A N PRO 270.A O no hydrogen 3.270 N/A HIS 274.A N ASN 271.A O no hydrogen 3.218 N/A