Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ots_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N THR 1.A O no hydrogen 2.929 N/A GLN 5.A N PHE 20.A O no hydrogen 2.948 N/A ARG 7.A N TYR 18.A O no hydrogen 2.825 N/A ARG 7.A NH1.B VAL 6.A O no hydrogen 3.126 N/A VAL 9.A N PHE 16.A O no hydrogen 2.959 N/A HIS 11.A N TYR 14.A O no hydrogen 2.765 N/A TYR 14.A N HIS 11.A O no hydrogen 2.896 N/A TYR 14.A OH ASP 73.A OD2 no hydrogen 2.667 N/A GLN 15.A N THR 68.A OG1 no hydrogen 2.825 N/A GLN 15.A NE2 GLY 66.A O no hydrogen 2.980 N/A PHE 16.A N VAL 9.A O no hydrogen 2.839 N/A CYS 17.A N THR 67.A OG1 no hydrogen 2.978 N/A CYS 17.A SG ASP 60.A OD2 no hydrogen 3.273 N/A TYR 18.A N ARG 7.A O no hydrogen 2.992 N/A SER 19.A N CYS 58.A O no hydrogen 2.874 N/A PHE 20.A N GLN 5.A O no hydrogen 2.996 N/A ARG 21.A N LEU 56.A O no hydrogen 3.243 N/A ARG 21.A NH1 LEU 2.A O no hydrogen 2.863 N/A ARG 21.A NH2 VAL 47.A O no hydrogen 3.387 N/A ARG 21.A NH2 PRO 51.A O no hydrogen 3.448 N/A SER 29.A OG HIS 55.A ND1 no hydrogen 2.791 N/A ILE 30.A N HIS 55.A O no hydrogen 2.831 N/A LEU 31.A N HIS 99.A O no hydrogen 3.085 N/A MET 32.A N VAL 57.A O no hydrogen 2.820 N/A LEU 33.A N VAL 101.A O no hydrogen 2.856 N/A HIS 34.A ND1 GLY 35.A O no hydrogen 2.691 N/A SER 37.A N HIS 64.A NE2 no hydrogen 3.013 N/A SER 37.A OG PHE 36.A O no hydrogen 2.683 N/A ALA 38.A N GLY 35.A O no hydrogen 3.476 N/A LYS 40.A N ASP 60.A OD1 no hydrogen 2.825 N/A LYS 40.A NZ ASP 60.A OD1 no hydrogen 3.479 N/A LYS 40.A NZ ASP 60.A OD2 no hydrogen 2.836 N/A ASP 41.A N HIS 39.A ND1 no hydrogen 3.158 N/A MET 42.A N HIS 39.A O no hydrogen 3.123 N/A LEU 44.A N ASP 41.A O no hydrogen 3.249 N/A VAL 46.A N TRP 43.A O no hydrogen 3.177 N/A VAL 47.A N TRP 43.A O no hydrogen 2.974 N/A LYS 48.A N LEU 44.A O no hydrogen 3.025 N/A PHE 49.A N VAL 46.A O no hydrogen 2.969 N/A LEU 50.A N VAL 47.A O no hydrogen 2.866 N/A HIS 55.A ND1 SER 29.A OG no hydrogen 2.791 N/A LEU 56.A N ARG 21.A O no hydrogen 3.099 N/A VAL 57.A N ILE 30.A O no hydrogen 2.835 N/A CYS 58.A N SER 19.A O no hydrogen 2.976 N/A VAL 59.A N MET 32.A O no hydrogen 3.404 N/A ASP 60.A N CYS 17.A O no hydrogen 2.864 N/A MET 61.A N HIS 34.A NE2 no hydrogen 3.012 N/A GLY 63.A N THR 68.A O no hydrogen 2.982 N/A HIS 64.A N MET 61.A O no hydrogen 2.866 N/A HIS 64.A ND1 PRO 62.A O no hydrogen 3.116 N/A GLY 66.A N ASP 60.A OD2 no hydrogen 3.084 N/A THR 67.A N HIS 64.A O no hydrogen 3.005 N/A THR 67.A OG1 ASP 60.A O no hydrogen 2.611 N/A THR 68.A N GLN 15.A O no hydrogen 2.925 N/A THR 68.A OG1 GLN 15.A O no hydrogen 3.392 N/A ARG 69.A NE GLY 63.A O no hydrogen 2.896 N/A ARG 69.A NH1 HIS 195.A ND1 no hydrogen 3.056 N/A ARG 69.A NH2 GLY 63.A O no hydrogen 2.998 N/A ARG 69.A NH2 HIS 195.A ND1 no hydrogen 3.270 N/A LEU 72.A N SER 70.A OG no hydrogen 3.175 N/A ASP 73.A N SER 70.A O no hydrogen 2.962 N/A SER 76.A N ASP 74.A OD1 no hydrogen 3.139 N/A SER 76.A OG ASP 74.A OD1 no hydrogen 2.859 N/A SER 76.A OG ASP 74.A OD2 no hydrogen 3.439 N/A ILE 77.A N SER 211.A OG no hydrogen 2.955 N/A GLY 79.A N SER 76.A OG no hydrogen 3.235 N/A GLN 80.A N SER 76.A O no hydrogen 2.924 N/A GLN 80.A NE2 LEU 75.A O no hydrogen 2.877 N/A VAL 81.A N ILE 77.A O no hydrogen 2.828 N/A LYS 82.A N ASP 78.A O no hydrogen 3.111 N/A LYS 82.A NZ ASP 78.A OD1 no hydrogen 3.319 N/A LYS 82.A NZ ASP 78.A OD2 no hydrogen 2.755 N/A ARG 83.A N GLY 79.A O no hydrogen 3.034 N/A ARG 83.A NE ASP 73.A OD1 no hydrogen 2.805 N/A ARG 83.A NH1 GLN 86.A OE1 no hydrogen 2.744 N/A ARG 83.A NH2 ASP 73.A OD1 no hydrogen 3.277 N/A ILE 84.A N GLN 80.A O no hydrogen 2.911 N/A HIS 85.A N VAL 81.A O no hydrogen 2.960 N/A GLN 86.A N LYS 82.A O no hydrogen 3.122 N/A PHE 87.A N ARG 83.A O no hydrogen 2.973 N/A VAL 88.A N ILE 84.A O no hydrogen 2.878 N/A GLU 89.A N HIS 85.A O no hydrogen 2.936 N/A CYS 90.A N GLN 86.A O no hydrogen 2.891 N/A CYS 90.A SG HIS 10.A O no hydrogen 3.832 N/A CYS 90.A SG GLN 86.A O no hydrogen 3.127 N/A LEU 91.A N PHE 87.A O no hydrogen 3.041 N/A LYS 92.A N GLU 89.A O no hydrogen 3.340 N/A LEU 93.A N VAL 88.A O no hydrogen 2.922 N/A ASN 94.A ND2 GLU 89.A OE2 no hydrogen 2.744 N/A ASN 94.A ND2 ASP 120.A OD1 no hydrogen 3.072 N/A ASN 94.A ND2 ASP 120.A OD2 no hydrogen 3.533 N/A LYS 95.A N LYS 92.A O no hydrogen 3.104 N/A LYS 96.A NZ GLY 25.A O no hydrogen 2.968 N/A LYS 96.A NZ LYS 27.A O no hydrogen 2.988 N/A PHE 98.A N ASP 120.A O no hydrogen 2.913 N/A HIS 99.A N SER 29.A O no hydrogen 2.876 N/A LEU 100.A N SER 123.A O no hydrogen 2.959 N/A VAL 101.A N LEU 31.A O no hydrogen 2.895 N/A GLY 102.A N CYS 125.A O no hydrogen 2.951 N/A THR 103.A N LEU 33.A O no hydrogen 3.049 N/A THR 103.A OG1 VAL 127.A O no hydrogen 3.256 N/A ALA 104.A N VAL 127.A O no hydrogen 2.937 N/A GLY 106.A N THR 103.A O no hydrogen 2.890 N/A GLN 108.A N ALA 104.A O no hydrogen 3.013 N/A GLN 108.A NE2 SER 211.A O no hydrogen 2.821 N/A GLN 108.A NE2 SER 214.A OG no hydrogen 2.399 N/A VAL 109.A N MET 105.A O no hydrogen 3.023 N/A ALA 110.A N GLY 106.A O no hydrogen 2.883 N/A GLY 111.A N GLY 107.A O no hydrogen 2.977 N/A VAL 112.A N GLN 108.A O no hydrogen 2.951 N/A TYR 113.A N VAL 109.A O no hydrogen 2.766 N/A TYR 113.A OH HIS 85.A ND1 no hydrogen 3.357 N/A TYR 113.A OH ASP 120.A OD2 no hydrogen 2.626 N/A ALA 114.A N ALA 110.A O no hydrogen 3.086 N/A ALA 115.A N GLY 111.A O no hydrogen 3.193 N/A TYR 116.A N VAL 112.A O no hydrogen 2.890 N/A TYR 116.A OH ASP 78.A OD1 no hydrogen 2.777 N/A TYR 117.A N TYR 113.A O no hydrogen 2.858 N/A ASP 120.A N TYR 117.A O no hydrogen 3.326 N/A VAL 121.A N PRO 118.A O no hydrogen 3.449 N/A SER 122.A N PHE 98.A O no hydrogen 2.887 N/A SER 122.A OG SER 123.A OG no hydrogen 3.229 N/A SER 123.A OG SER 122.A OG no hydrogen 3.229 N/A LEU 124.A N PRO 225.A O no hydrogen 3.052 N/A CYS 125.A N LEU 100.A O no hydrogen 2.872 N/A CYS 125.A SG GLN 227.A OE1 no hydrogen 3.311 N/A LEU 126.A N GLN 227.A O no hydrogen 2.804 N/A VAL 127.A N GLY 102.A O no hydrogen 2.821 N/A CYS 128.A N ILE 229.A O no hydrogen 2.858 N/A CYS 128.A SG THR 103.A OG1 no hydrogen 3.737 N/A CYS 128.A SG HIS 262.A O no hydrogen 3.579 N/A ALA 130.A N ALA 104.A O no hydrogen 3.005 N/A GLN 133.A N HIS 216.A ND1 no hydrogen 3.074 N/A TYR 134.A OH ASP 238.A O no hydrogen 2.812 N/A ASN 138.A ND2 VAL 236.A O no hydrogen 3.045 N/A VAL 141.A N ASN 138.A OD1 no hydrogen 2.997 N/A GLN 142.A N ASN 138.A O no hydrogen 2.980 N/A ARG 143.A N GLN 139.A O no hydrogen 2.896 N/A ARG 143.A NH1 GLU 146.A OE1 no hydrogen 2.967 N/A LEU 144.A N PHE 140.A O no hydrogen 3.017 N/A LYS 145.A N VAL 141.A O no hydrogen 3.036 N/A LYS 145.A NZ ASP 137.A OD1 no hydrogen 3.556 N/A LYS 145.A NZ ASP 137.A OD2 no hydrogen 2.764 N/A GLU 146.A N GLN 142.A O no hydrogen 3.004 N/A LEU 147.A N ARG 143.A O no hydrogen 2.873 N/A GLN 148.A N LEU 144.A O no hydrogen 3.000 N/A GLY 149.A N LYS 145.A O no hydrogen 3.344 N/A GLY 149.A N GLU 146.A O no hydrogen 3.114 N/A SER 150.A N LEU 147.A O no hydrogen 3.144 N/A SER 150.A OG LEU 147.A O no hydrogen 3.410 N/A ALA 151.A N GLN 148.A O no hydrogen 3.416 N/A ALA 152.A N LEU 147.A O no hydrogen 3.051 N/A VAL 153.A N ALA 151.A O no hydrogen 2.885 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.822 N/A LYS 155.A N ALA 152.A O no hydrogen 2.964 N/A ILE 156.A N VAL 153.A O no hydrogen 3.434 N/A ILE 159.A N ILE 156.A O no hydrogen 2.957 N/A SER 161.A N GLU 165.A OE1 no hydrogen 2.817 N/A SER 161.A OG GLU 165.A OE1 no hydrogen 2.834 N/A THR 162.A N GLU 165.A OE1 no hydrogen 3.323 N/A GLU 165.A N THR 162.A OG1 no hydrogen 3.089 N/A MET 166.A N THR 162.A O no hydrogen 2.932 N/A SER 167.A N.A PRO 163.A O no hydrogen 2.965 N/A SER 167.A N.B PRO 163.A O no hydrogen 2.963 N/A GLU 168.A N GLU 164.A O no hydrogen 3.185 N/A MET 169.A N GLU 165.A O no hydrogen 3.017 N/A LEU 170.A N MET 166.A O no hydrogen 2.896 N/A GLN 171.A N SER 167.A O.A no hydrogen 3.113 N/A GLN 171.A N SER 167.A O.B no hydrogen 3.128 N/A GLN 171.A NE2 SER 167.A O.A no hydrogen 3.139 N/A GLN 171.A NE2 SER 167.A O.B no hydrogen 3.133 N/A LEU 172.A N GLU 168.A O no hydrogen 2.995 N/A CYS 173.A N MET 169.A O no hydrogen 3.081 N/A CYS 173.A SG MET 169.A O no hydrogen 3.444 N/A TYR 175.A N GLU 267.A OE1 no hydrogen 2.856 N/A ARG 177.A NE PHE 178.A O no hydrogen 3.133 N/A ARG 177.A NH2 PHE 178.A O no hydrogen 3.551 N/A LEU 185.A N PRO 181.A O no hydrogen 3.174 N/A GLN 186.A N GLN 182.A O no hydrogen 2.909 N/A GLY 187.A N GLN 183.A O no hydrogen 3.079 N/A LEU 188.A N ILE 184.A O no hydrogen 2.961 N/A VAL 189.A N LEU 185.A O no hydrogen 2.979 N/A ASP 190.A N GLN 186.A O no hydrogen 2.964 N/A VAL 191.A N GLY 187.A O no hydrogen 3.374 N/A ARG 192.A N VAL 189.A O no hydrogen 2.940 N/A ARG 192.A NH1 SER 37.A O no hydrogen 3.363 N/A ARG 192.A NH1 SER 37.A OG no hydrogen 3.185 N/A ARG 192.A NH2 SER 37.A OG no hydrogen 2.972 N/A ILE 193.A N VAL 189.A O no hydrogen 2.876 N/A HIS 195.A N ARG 192.A O no hydrogen 2.850 N/A ASN 196.A N ILE 193.A O no hydrogen 3.083 N/A ASN 196.A ND2 PRO 160.A O no hydrogen 3.182 N/A TYR 199.A N HIS 195.A O no hydrogen 2.980 N/A ARG 200.A N ASN 196.A O no hydrogen 2.841 N/A LYS 201.A N ASN 197.A O no hydrogen 3.136 N/A LYS 201.A NZ SER 71.A O no hydrogen 3.409 N/A LEU 202.A N PHE 198.A O no hydrogen 2.852 N/A PHE 203.A N TYR 199.A O no hydrogen 2.824 N/A LEU 204.A N ARG 200.A O no hydrogen 3.186 N/A GLU 205.A N LYS 201.A O no hydrogen 3.121 N/A ILE 206.A N LEU 202.A O no hydrogen 2.957 N/A VAL 207.A N PHE 203.A O no hydrogen 3.101 N/A SER 208.A N GLU 205.A O no hydrogen 3.326 N/A SER 208.A OG GLU 205.A O no hydrogen 2.896 N/A LYS 210.A NZ SER 76.A OG no hydrogen 3.352 N/A SER 211.A N SER 208.A O no hydrogen 2.899 N/A ARG 212.A N SER 208.A O no hydrogen 2.864 N/A ARG 212.A NE VAL 207.A O no hydrogen 2.806 N/A ARG 212.A NH1 VAL 207.A O no hydrogen 3.010 N/A SER 214.A N SER 211.A O no hydrogen 3.209 N/A SER 214.A OG SER 211.A O no hydrogen 3.317 N/A HIS 216.A N GLY 131.A O no hydrogen 2.890 N/A GLN 217.A N TYR 213.A O no hydrogen 2.993 N/A ASN 218.A N LEU 215.A O no hydrogen 3.126 N/A ASN 218.A ND2 SER 214.A O no hydrogen 2.809 N/A LYS 221.A N ASN 218.A O no hydrogen 3.031 N/A LYS 221.A NZ ASP 220.A OD1 no hydrogen 2.750 N/A ILE 222.A N MET 219.A O no hydrogen 3.221 N/A THR 226.A N ASN 251.A O no hydrogen 2.970 N/A THR 226.A OG1 VAL 224.A O no hydrogen 3.048 N/A GLN 227.A N LEU 124.A O no hydrogen 2.936 N/A GLN 227.A NE2 LEU 275.A O no hydrogen 2.930 N/A ILE 228.A N GLN 253.A O no hydrogen 2.864 N/A ILE 229.A N LEU 126.A O no hydrogen 2.962 N/A TRP 230.A N GLU 255.A O no hydrogen 3.012 N/A TRP 230.A NE1 LEU 237.A O no hydrogen 2.798 N/A LYS 232.A N LEU 257.A O no hydrogen 2.960 N/A LYS 232.A NZ GLU 258.A OE2 no hydrogen 2.684 N/A GLN 233.A N CYS 260.A O no hydrogen 2.886 N/A ASP 234.A N GLY 231.A O no hydrogen 3.097 N/A VAL 236.A N ASP 234.A OD1 no hydrogen 2.935 N/A LEU 237.A N ASP 234.A OD1 no hydrogen 2.838 N/A SER 240.A N ASP 238.A OD2 no hydrogen 3.006 N/A SER 240.A OG ASP 238.A OD2 no hydrogen 2.751 N/A GLY 241.A N ASP 238.A O no hydrogen 3.062 N/A ALA 242.A N VAL 239.A O no hydrogen 3.130 N/A MET 244.A N SER 240.A O no hydrogen 3.478 N/A LEU 245.A N GLY 241.A O no hydrogen 3.143 N/A ALA 246.A N ALA 242.A O no hydrogen 2.996 N/A LYS 247.A N ASP 243.A O no hydrogen 2.951 N/A LYS 247.A NZ ASP 243.A OD2 no hydrogen 3.075 N/A SER 248.A N LEU 245.A O no hydrogen 3.001 N/A SER 248.A OG MET 244.A O no hydrogen 3.087 N/A CYS 252.A SG THR 226.A O no hydrogen 3.658 N/A GLN 253.A N THR 226.A O no hydrogen 3.054 N/A GLU 255.A N ILE 228.A O no hydrogen 2.760 N/A LEU 257.A N TRP 230.A O no hydrogen 2.782 N/A CYS 260.A N GLN 233.A OE1 no hydrogen 2.923 N/A CYS 260.A SG GLY 261.A O no hydrogen 3.730 N/A GLY 261.A N GLU 267.A OE1 no hydrogen 2.843 N/A GLY 261.A N GLU 267.A OE2 no hydrogen 3.250 N/A HIS 262.A ND1 ASP 234.A OD2 no hydrogen 2.950 N/A SER 263.A N CYS 173.A O no hydrogen 2.883 N/A SER 263.A OG CYS 173.A O no hydrogen 2.727 N/A MET 266.A N SER 263.A O no hydrogen 2.898 N/A GLU 267.A N SER 263.A O no hydrogen 2.835 N/A ARG 268.A N VAL 264.A O no hydrogen 2.856 N/A ARG 268.A NH1 GLU 258.A O no hydrogen 2.951 N/A THR 272.A N ARG 268.A O no hydrogen 2.989 N/A THR 272.A OG1 ARG 268.A O no hydrogen 2.811 N/A ALA 273.A N PRO 269.A O no hydrogen 2.996 N/A LYS 274.A N ARG 270.A O no hydrogen 3.030 N/A LYS 274.A NZ ASP 278.A OD2 no hydrogen 3.361 N/A LEU 275.A N LYS 271.A O no hydrogen 2.857 N/A ILE 276.A N THR 272.A O no hydrogen 2.960 N/A ILE 277.A N ALA 273.A O no hydrogen 3.210 N/A ASP 278.A N LYS 274.A O no hydrogen 2.937 N/A PHE 279.A N LEU 275.A O no hydrogen 2.974 N/A LEU 280.A N ILE 276.A O no hydrogen 3.122 N/A ALA 281.A N ILE 277.A O no hydrogen 3.061 N/A SER 282.A N ASP 278.A O no hydrogen 2.970 N/A SER 282.A OG ASP 278.A O no hydrogen 3.567 N/A SER 282.A OG PHE 279.A O no hydrogen 2.869 N/A VAL 283.A N PHE 279.A O no hydrogen 2.975 N/A HIS 284.A N LEU 280.A O no hydrogen 3.160 N/A ASN 285.A N ALA 281.A O no hydrogen 2.925 N/A THR 286.A N SER 282.A O no hydrogen 3.054 N/A THR 286.A OG1 SER 282.A O no hydrogen 3.453 N/A THR 286.A OG1 VAL 283.A O no hydrogen 3.073 N/A ASP 287.A N VAL 283.A O no hydrogen 3.014 N/A ASN 288.A N HIS 284.A O no hydrogen 2.978 N/A ASN 289.A N ASN 285.A O no hydrogen 2.974 N/A ASN 289.A ND2 ASN 285.A OD1 no hydrogen 3.070 N/A LYS 290.A N THR 286.A O no hydrogen 2.883 N/A