Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6l2i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N LEU 177.A O no hydrogen 2.831 N/A TYR 5.A N ASP 8.A OD2 no hydrogen 2.981 N/A ASP 8.A N TYR 5.A O no hydrogen 2.944 N/A VAL 9.A N GLU 6.A O no hydrogen 3.150 N/A ALA 13.A N VAL 11.A O no hydrogen 2.790 N/A LEU 14.A N ASP 165.A OD2 no hydrogen 2.941 N/A ASP 15.A N ALA 12.A O no hydrogen 2.911 N/A LYS 17.A N LEU 14.A O no hydrogen 3.054 N/A LYS 18.A N ASP 73.A OD2 no hydrogen 3.047 N/A ILE 19.A N ASP 41.A O no hydrogen 3.220 N/A ALA 20.A N VAL 74.A O no hydrogen 2.787 N/A VAL 21.A N ILE 43.A O no hydrogen 2.944 N/A ILE 22.A N MET 76.A O no hydrogen 2.743 N/A GLY 23.A N GLY 45.A O no hydrogen 3.020 N/A TYR 24.A OH ASP 58.A OD2 no hydrogen 2.531 N/A HIS 29.A N GLY 25.A O no hydrogen 2.784 N/A ALA 30.A N SER 26.A O no hydrogen 2.912 N/A HIS 31.A N GLN 27.A O no hydrogen 3.047 N/A ALA 32.A N GLY 28.A O no hydrogen 3.053 N/A GLN 33.A N HIS 29.A O no hydrogen 2.937 N/A GLN 33.A NE2 TYR 24.A OH no hydrogen 3.271 N/A GLN 33.A NE2 HIS 29.A NE2 no hydrogen 3.625 N/A ASN 34.A N ALA 30.A O no hydrogen 3.020 N/A ASN 34.A ND2 VAL 135.A O no hydrogen 3.043 N/A ASN 34.A ND2 VAL 170.A O no hydrogen 2.966 N/A LEU 35.A N HIS 31.A O no hydrogen 2.999 N/A ARG 36.A N ALA 32.A O no hydrogen 3.134 N/A ARG 36.A NH1 ASP 58.A O no hydrogen 3.342 N/A ARG 36.A NH2 GLN 33.A OE1 no hydrogen 2.879 N/A ARG 36.A NH2 ASP 58.A O no hydrogen 3.213 N/A ASP 37.A N GLN 33.A O no hydrogen 3.052 N/A SER 38.A N ASN 34.A O no hydrogen 3.011 N/A SER 38.A N LEU 35.A O no hydrogen 3.259 N/A SER 38.A OG ASN 34.A O no hydrogen 3.450 N/A SER 38.A OG TYR 139.A OH no hydrogen 2.669 N/A SER 38.A OG GLY 169.A O no hydrogen 3.030 N/A GLY 39.A N ARG 36.A O no hydrogen 3.011 N/A ARG 40.A N LEU 35.A O no hydrogen 2.857 N/A ARG 40.A NH1 ASP 15.A OD1 no hydrogen 2.339 N/A ARG 40.A NH2 ASP 15.A OD1 no hydrogen 3.073 N/A ARG 40.A NH2 ASP 165.A OD2 no hydrogen 2.696 N/A ILE 43.A N ILE 19.A O no hydrogen 2.835 N/A ILE 44.A N ASP 61.A O no hydrogen 3.219 N/A GLY 45.A N VAL 21.A O no hydrogen 3.066 N/A VAL 46.A N TYR 63.A O no hydrogen 3.156 N/A ASP 53.A N GLY 49.A O no hydrogen 3.276 N/A LYS 54.A N LYS 50.A O no hydrogen 2.967 N/A ALA 55.A N SER 51.A O no hydrogen 2.850 N/A LYS 56.A N PHE 52.A O no hydrogen 2.965 N/A GLU 57.A N ASP 53.A O no hydrogen 2.754 N/A ASP 58.A N ALA 55.A O no hydrogen 3.008 N/A PHE 60.A N ALA 55.A O no hydrogen 3.189 N/A THR 62.A OG1 PHE 60.A O no hydrogen 2.809 N/A TYR 63.A N ILE 44.A O no hydrogen 2.893 N/A GLU 67.A N THR 64.A OG1 no hydrogen 3.319 N/A ALA 68.A N THR 64.A O no hydrogen 3.034 N/A THR 69.A N VAL 65.A O no hydrogen 3.069 N/A THR 69.A OG1 VAL 65.A O no hydrogen 2.786 N/A LYS 70.A N ALA 66.A O no hydrogen 3.100 N/A LEU 71.A N GLU 67.A O no hydrogen 3.199 N/A ALA 72.A N THR 69.A O no hydrogen 3.167 N/A ASP 73.A N LYS 18.A O no hydrogen 2.717 N/A VAL 74.A N LYS 18.A O no hydrogen 3.022 N/A ILE 75.A N ALA 101.A O no hydrogen 2.811 N/A MET 76.A N ALA 20.A O no hydrogen 2.936 N/A ILE 77.A N GLY 103.A O no hydrogen 2.897 N/A LEU 78.A N ILE 22.A O no hydrogen 2.905 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.743 N/A ILE 83.A N PRO 80.A O no hydrogen 2.916 N/A GLN 84.A N PRO 80.A O no hydrogen 3.296 N/A GLN 84.A N ASP 81.A O no hydrogen 3.442 N/A GLN 84.A NE2 ALA 79.A O no hydrogen 2.834 N/A GLN 85.A NE2 GLU 89.A OE2 no hydrogen 3.365 N/A LEU 87.A N ILE 83.A O no hydrogen 3.119 N/A TYR 88.A N GLN 84.A O no hydrogen 2.683 N/A GLU 89.A N GLN 85.A O no hydrogen 2.925 N/A ALA 90.A N GLU 86.A O no hydrogen 3.058 N/A GLU 91.A N LEU 87.A O no hydrogen 3.000 N/A ILE 92.A N TYR 88.A O no hydrogen 3.109 N/A ALA 93.A N TYR 88.A O no hydrogen 2.710 N/A ASN 95.A N ILE 92.A O no hydrogen 2.812 N/A ASN 95.A ND2 GLU 91.A O no hydrogen 2.801 N/A LEU 96.A N ALA 93.A O no hydrogen 3.305 N/A GLU 97.A N ASN 100.A OD1 no hydrogen 2.658 N/A GLY 99.A N ASP 120.A O no hydrogen 2.890 N/A ASN 100.A N GLU 97.A O no hydrogen 3.046 N/A ALA 101.A N ASP 73.A O no hydrogen 2.878 N/A VAL 102.A N ASP 122.A O no hydrogen 2.807 N/A GLY 103.A N ILE 75.A O no hydrogen 2.759 N/A PHE 104.A N PHE 124.A O no hydrogen 3.119 N/A HIS 106.A ND1 GLU 185.A OE2 no hydrogen 2.654 N/A GLY 107.A N GLU 185.A OE1 no hydrogen 2.870 N/A ASN 109.A ND2 ASP 81.A O no hydrogen 2.949 N/A ASN 109.A ND2 GLN 84.A OE1 no hydrogen 2.611 N/A HIS 111.A N GLY 107.A O no hydrogen 2.745 N/A PHE 112.A N PHE 108.A O no hydrogen 2.974 N/A GLU 113.A N ILE 110.A O no hydrogen 3.188 N/A ILE 115.A N ASN 109.A O no hydrogen 3.116 N/A LYS 116.A NZ GLU 113.A OE1 no hydrogen 3.005 N/A VAL 121.A N PRO 118.A O no hydrogen 3.039 N/A ASP 122.A N ASN 100.A O no hydrogen 2.954 N/A VAL 123.A N GLN 153.A O no hydrogen 2.978 N/A PHE 124.A N VAL 102.A O no hydrogen 2.933 N/A MET 125.A N ALA 150.A O no hydrogen 2.803 N/A CYS 126.A N PHE 104.A O no hydrogen 3.197 N/A ALA 127.A N LEU 148.A O no hydrogen 2.829 N/A LYS 129.A N PRO 146.A O no hydrogen 2.834 N/A VAL 135.A N PRO 131.A O no hydrogen 3.006 N/A ARG 136.A N GLY 132.A O no hydrogen 3.047 N/A ARG 136.A NH1 ASN 34.A OD1 no hydrogen 2.923 N/A ARG 136.A NH1 ASP 37.A OD2 no hydrogen 2.822 N/A ARG 136.A NH2 ASP 37.A OD2 no hydrogen 2.839 N/A ARG 137.A N HIS 133.A O no hydrogen 2.935 N/A THR 138.A N LEU 134.A O no hydrogen 3.029 N/A THR 138.A OG1 LEU 134.A O no hydrogen 2.771 N/A THR 138.A OG1 VAL 135.A O no hydrogen 3.288 N/A TYR 139.A OH SER 38.A OG no hydrogen 2.669 N/A GLU 140.A N ARG 136.A O no hydrogen 2.847 N/A GLU 141.A N ARG 137.A O no hydrogen 2.895 N/A GLY 142.A N TYR 139.A O no hydrogen 3.112 N/A PHE 143.A N THR 138.A O no hydrogen 2.901 N/A ALA 147.A N GLY 176.A O no hydrogen 3.087 N/A LEU 148.A N ALA 127.A O no hydrogen 3.110 N/A TYR 149.A N LEU 178.A O no hydrogen 3.057 N/A TYR 149.A OH GLU 4.A OE1 no hydrogen 2.566 N/A ALA 150.A N MET 125.A O no hydrogen 3.179 N/A TYR 152.A N VAL 123.A O no hydrogen 2.907 N/A GLN 153.A NE2 VAL 117.A O no hydrogen 3.068 N/A GLN 153.A NE2 VAL 121.A O no hydrogen 3.032 N/A ALA 155.A N ASP 122.A OD1 no hydrogen 2.711 N/A THR 156.A N ASP 122.A OD1 no hydrogen 3.002 N/A THR 156.A OG1 ASP 122.A OD1 no hydrogen 3.371 N/A THR 156.A OG1 ASP 122.A OD2 no hydrogen 2.561 N/A GLY 157.A N ASP 154.A OD1 no hydrogen 2.807 N/A ASN 158.A N THR 156.A OG1 no hydrogen 2.966 N/A ALA 159.A N ASP 154.A OD1 no hydrogen 3.192 N/A LYS 160.A NZ GLU 179.A OE2 no hydrogen 3.139 N/A ILE 162.A N ASN 158.A O no hydrogen 2.946 N/A ALA 163.A N ALA 159.A O no hydrogen 2.983 N/A MET 164.A N LYS 160.A O no hydrogen 2.931 N/A ASP 165.A N ASN 161.A O no hydrogen 2.903 N/A TRP 166.A N ILE 162.A O no hydrogen 2.841 N/A TRP 166.A NE1 HIS 31.A ND1 no hydrogen 2.991 N/A CYS 167.A N ALA 163.A O no hydrogen 3.001 N/A CYS 167.A SG.A ALA 163.A O no hydrogen 3.860 N/A CYS 167.A SG.B ALA 163.A O no hydrogen 3.380 N/A LYS 168.A N MET 164.A O no hydrogen 2.943 N/A GLY 169.A N ASP 165.A O no hydrogen 2.743 N/A VAL 170.A N TRP 166.A O no hydrogen 2.932 N/A GLY 171.A N LYS 168.A O no hydrogen 3.138 N/A ALA 172.A N CYS 167.A O no hydrogen 2.857 N/A ALA 173.A N CYS 167.A O no hydrogen 3.373 N/A ARG 174.A N GLY 171.A O no hydrogen 3.246 N/A ARG 174.A NH1 TYR 139.A O no hydrogen 3.298 N/A ARG 174.A NH1 PHE 143.A O no hydrogen 2.951 N/A VAL 175.A N ALA 172.A O no hydrogen 3.047 N/A GLY 176.A N ALA 172.A O no hydrogen 2.967 N/A LEU 177.A N GLU 4.A O no hydrogen 2.748 N/A LEU 178.A N ALA 147.A O no hydrogen 3.026 N/A THR 180.A N TYR 149.A O no hydrogen 2.891 N/A THR 180.A OG1 THR 181.A O no hydrogen 3.520 N/A THR 181.A N THR 180.A OG1 no hydrogen 2.721 N/A TYR 182.A OH PHE 124.A O no hydrogen 2.715 N/A LYS 183.A NZ GLU 187.A OE1 no hydrogen 2.655 N/A LYS 183.A NZ GLU 187.A OE2 no hydrogen 3.473 N/A GLU 184.A N THR 181.A OG1 no hydrogen 3.004 N/A GLU 185.A N THR 181.A O no hydrogen 2.881 N/A THR 186.A N TYR 182.A O no hydrogen 2.971 N/A THR 186.A OG1 TYR 182.A O no hydrogen 2.743 N/A THR 186.A OG1 GLU 185.A OE1 no hydrogen 3.417 N/A GLU 187.A N LYS 183.A O no hydrogen 2.887 N/A GLU 188.A N GLU 184.A O no hydrogen 2.885 N/A ASP 189.A N GLU 185.A O no hydrogen 2.997 N/A LEU 190.A N THR 186.A O no hydrogen 3.082 N/A PHE 191.A N GLU 187.A O no hydrogen 2.900 N/A GLY 192.A N GLU 188.A O no hydrogen 2.839 N/A GLU 193.A N ASP 189.A O no hydrogen 3.208 N/A GLN 194.A N LEU 190.A O no hydrogen 3.036 N/A ALA 195.A N PHE 191.A O no hydrogen 2.786 N/A VAL 196.A N GLY 192.A O no hydrogen 3.053 N/A LEU 197.A N GLY 192.A O no hydrogen 2.837 N/A CYS 198.A N GLU 193.A O no hydrogen 2.943 N/A GLY 199.A N GLU 193.A O no hydrogen 2.901 N/A GLY 200.A N GLN 194.A O no hydrogen 3.071 N/A THR 202.A N CYS 198.A O no hydrogen 3.026 N/A THR 202.A OG1 CYS 198.A O no hydrogen 2.830 N/A THR 202.A OG1 GLY 199.A O no hydrogen 3.271 N/A ALA 203.A N GLY 199.A O no hydrogen 3.038 N/A LEU 204.A N GLY 200.A O no hydrogen 2.797 N/A ILE 205.A N LEU 201.A O no hydrogen 2.977 N/A GLU 206.A N THR 202.A O no hydrogen 2.890 N/A ALA 207.A N ALA 203.A O no hydrogen 2.987 N/A GLY 208.A N LEU 204.A O no hydrogen 3.055 N/A PHE 209.A N ILE 205.A O no hydrogen 2.939 N/A GLU 210.A N GLU 206.A O no hydrogen 2.908 N/A VAL 211.A N ALA 207.A O no hydrogen 2.894 N/A LEU 212.A N GLY 208.A O no hydrogen 3.061 N/A THR 213.A N PHE 209.A O no hydrogen 2.964 N/A THR 213.A OG1 PHE 209.A O no hydrogen 2.838 N/A THR 213.A OG1 GLU 210.A O no hydrogen 3.409 N/A GLU 214.A N GLU 210.A O no hydrogen 2.849 N/A ALA 215.A N VAL 211.A O no hydrogen 3.121 N/A GLY 216.A N THR 213.A O no hydrogen 3.105 N/A TYR 217.A N LEU 212.A O no hydrogen 3.017 N/A ALA 222.A N ALA 218.A O no hydrogen 2.887 N/A TYR 223.A N PRO 219.A O no hydrogen 2.834 N/A PHE 224.A N LEU 221.A O no hydrogen 3.091 N/A GLU 225.A N LEU 221.A O no hydrogen 3.244 N/A VAL 226.A N ALA 222.A O no hydrogen 3.056 N/A LEU 227.A N TYR 223.A O no hydrogen 3.059 N/A HIS 228.A N TYR 223.A O no hydrogen 3.060 N/A GLU 229.A N PHE 224.A O no hydrogen 3.125 N/A MET 230.A N LEU 227.A O no hydrogen 2.984 N/A LYS 231.A NZ ASP 235.A OD1 no hydrogen 3.446 N/A LYS 231.A NZ ASP 235.A OD2 no hydrogen 2.795 N/A VAL 234.A N MET 230.A O no hydrogen 2.908 N/A ASP 235.A N LYS 231.A O no hydrogen 2.854 N/A LEU 236.A N LEU 232.A O no hydrogen 3.041 N/A ILE 237.A N ILE 233.A O no hydrogen 3.098 N/A TYR 238.A N VAL 234.A O no hydrogen 2.799 N/A GLU 239.A N ASP 235.A O no hydrogen 3.034 N/A GLY 240.A N LEU 236.A O no hydrogen 2.801 N/A GLY 241.A N ILE 237.A O no hydrogen 2.736 N/A LYS 244.A N GLY 240.A O no hydrogen 3.235 N/A LYS 244.A NZ GLU 239.A OE2 no hydrogen 2.717 N/A MET 245.A N GLY 241.A O no hydrogen 3.449 N/A ARG 246.A N PHE 242.A O no hydrogen 2.971 N/A ARG 246.A NE ASP 257.A OD2 no hydrogen 2.775 N/A ARG 246.A NH2 ASP 257.A OD1 no hydrogen 2.801 N/A ARG 246.A NH2 ASP 257.A OD2 no hydrogen 3.358 N/A GLN 247.A N LYS 243.A O no hydrogen 3.145 N/A GLN 247.A N LYS 244.A O no hydrogen 3.206 N/A SER 248.A N LYS 244.A O no hydrogen 3.265 N/A SER 248.A N MET 245.A O no hydrogen 3.097 N/A ILE 249.A N MET 245.A O no hydrogen 3.184 N/A ALA 253.A N SER 250.A OG no hydrogen 2.946 N/A GLU 254.A N SER 250.A O no hydrogen 2.893 N/A TYR 255.A N ASN 251.A O no hydrogen 2.944 N/A GLY 256.A N THR 252.A O no hydrogen 3.063 N/A ASP 257.A N ALA 253.A O no hydrogen 2.844 N/A TYR 258.A N GLU 254.A O no hydrogen 3.078 N/A TYR 258.A OH GLU 254.A OE2 no hydrogen 2.656 N/A VAL 259.A N TYR 255.A O no hydrogen 2.996 N/A SER 260.A N GLY 256.A O no hydrogen 2.806 N/A GLY 261.A N ASP 257.A O no hydrogen 3.047 N/A ARG 263.A N SER 260.A O no hydrogen 2.944 N/A VAL 264.A N SER 260.A O no hydrogen 3.126 N/A VAL 264.A N GLY 261.A O no hydrogen 3.179 N/A ILE 265.A N GLY 261.A O no hydrogen 2.935 N/A GLN 268.A NE2 ASN 272.A OD1 no hydrogen 3.003 N/A LYS 270.A N THR 266.A O no hydrogen 3.095 N/A GLU 271.A N GLU 267.A O no hydrogen 2.924 N/A ASN 272.A N GLN 268.A O no hydrogen 2.916 N/A MET 273.A N VAL 269.A O no hydrogen 2.968 N/A LYS 274.A N LYS 270.A O no hydrogen 2.975 N/A LYS 274.A NZ GLU 271.A OE2 no hydrogen 3.158 N/A ALA 275.A N GLU 271.A O no hydrogen 3.050 N/A VAL 276.A N ASN 272.A O no hydrogen 3.102 N/A LEU 277.A N MET 273.A O no hydrogen 2.898 N/A ALA 278.A N LYS 274.A O no hydrogen 2.911 N/A ASP 279.A N ALA 275.A O no hydrogen 3.210 N/A ILE 280.A N VAL 276.A O no hydrogen 3.253 N/A ILE 280.A N LEU 277.A O no hydrogen 3.055 N/A GLN 281.A N LEU 277.A O no hydrogen 2.904 N/A ASN 282.A N ALA 278.A O no hydrogen 2.911 N/A ASN 282.A ND2 ASP 279.A OD1 no hydrogen 3.354 N/A LYS 284.A N ASN 282.A OD1 no hydrogen 2.837 N/A LYS 284.A NZ ASP 288.A OD2 no hydrogen 2.898 N/A PHE 285.A N ASP 279.A O no hydrogen 2.903 N/A ASN 287.A N GLY 283.A O no hydrogen 2.989 N/A ASP 288.A N LYS 284.A O no hydrogen 2.899 N/A PHE 289.A N PHE 285.A O no hydrogen 2.864 N/A VAL 290.A N ALA 286.A O no hydrogen 3.021 N/A ASN 291.A N ASN 287.A O no hydrogen 2.771 N/A ASP 292.A N ASP 288.A O no hydrogen 2.930 N/A TYR 293.A N PHE 289.A O no hydrogen 2.998 N/A LYS 294.A N VAL 290.A O no hydrogen 2.915 N/A ALA 295.A N ASN 291.A O no hydrogen 3.082 N/A ALA 295.A N ASP 292.A O no hydrogen 3.216 N/A GLY 296.A N TYR 293.A O no hydrogen 3.093 N/A ARG 297.A N ASP 292.A O no hydrogen 2.779 N/A LYS 299.A N ASP 292.A OD1 no hydrogen 2.856 N/A LEU 300.A N ASP 292.A OD2 no hydrogen 3.111 N/A THR 301.A N ARG 297.A O no hydrogen 2.845 N/A THR 301.A OG1 ARG 297.A O no hydrogen 2.758 N/A ALA 302.A N PRO 298.A O no hydrogen 3.132 N/A TYR 303.A N LYS 299.A O no hydrogen 2.892 N/A ARG 304.A N LEU 300.A O no hydrogen 2.966 N/A GLU 305.A N THR 301.A O no hydrogen 3.074 N/A GLN 306.A N ALA 302.A O no hydrogen 2.957 N/A ALA 307.A N TYR 303.A O no hydrogen 2.947 N/A ALA 308.A N ARG 304.A O no hydrogen 2.966 N/A ASN 309.A N GLN 306.A O no hydrogen 3.045 N/A LEU 310.A N ALA 307.A O no hydrogen 3.315 N/A GLU 313.A N LEU 310.A O no hydrogen 3.013 N/A LYS 314.A N LEU 310.A O no hydrogen 3.139 N/A LYS 314.A NZ ASN 309.A O no hydrogen 3.267 N/A LYS 314.A NZ GLU 311.A OE2.B no hydrogen 3.042 N/A VAL 315.A N GLU 311.A O no hydrogen 2.804 N/A GLY 316.A N ILE 312.A O no hydrogen 2.904 N/A ALA 317.A N GLU 313.A O no hydrogen 3.077 N/A GLU 318.A N LYS 314.A O no hydrogen 3.336 N/A LEU 319.A N VAL 315.A O no hydrogen 3.003 N/A ARG 320.A N GLY 316.A O no hydrogen 2.889 N/A ARG 320.A NH1 TYR 223.A OH no hydrogen 3.008 N/A LYS 321.A N ALA 317.A O no hydrogen 3.000 N/A ALA 322.A N GLU 318.A O no hydrogen 3.107 N/A MET 323.A N ARG 320.A O no hydrogen 3.266 N/A