Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4i9n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N ALA 2.A O no hydrogen 3.022 N/A GLN 6.A N ALA 2.A O no hydrogen 3.062 N/A GLN 6.A N LEU 3.A O no hydrogen 3.134 N/A LEU 7.A N LEU 3.A O no hydrogen 3.152 N/A ILE 8.A N LYS 4.A O no hydrogen 2.876 N/A ASN 10.A ND2 LEU 12.A O no hydrogen 3.059 N/A LYS 13.A NZ GLU 15.A OE2 no hydrogen 2.741 N/A VAL 17.A N GLU 15.A O no hydrogen 3.208 N/A GLN 19.A N ASP 45.A OD2 no hydrogen 3.272 N/A GLN 19.A NE2 VAL 17.A O no hydrogen 3.309 N/A ASN 20.A N ASP 45.A OD1 no hydrogen 3.053 N/A ASN 20.A N ASP 45.A OD2 no hydrogen 3.177 N/A LYS 21.A NZ GLU 46.A OE2 no hydrogen 3.014 N/A LYS 21.A NZ VAL 84.A O no hydrogen 2.947 N/A LYS 21.A NZ ALA 86.A O no hydrogen 2.787 N/A ILE 22.A N GLU 46.A O no hydrogen 2.973 N/A THR 23.A N LEU 90.A O no hydrogen 2.975 N/A THR 23.A OG1 SER 88.A OG no hydrogen 2.679 N/A VAL 24.A N ALA 48.A O no hydrogen 2.909 N/A VAL 25.A N ILE 92.A O no hydrogen 2.870 N/A GLY 26.A N VAL 50.A O no hydrogen 2.702 N/A VAL 27.A N ASP 51.A OD2 no hydrogen 3.057 N/A MET 32.A N GLY 28.A O no hydrogen 3.149 N/A ALA 33.A N ALA 29.A O no hydrogen 3.214 N/A CYS 34.A N VAL 30.A O no hydrogen 2.936 N/A CYS 34.A SG VAL 30.A O no hydrogen 3.265 N/A ALA 35.A N GLY 31.A O no hydrogen 2.964 N/A ILE 36.A N MET 32.A O no hydrogen 2.852 N/A SER 37.A N ALA 33.A O no hydrogen 3.037 N/A SER 37.A OG ALA 33.A O no hydrogen 2.603 N/A ILE 38.A N CYS 34.A O no hydrogen 2.892 N/A LEU 39.A N ALA 35.A O no hydrogen 2.928 N/A MET 40.A N ILE 36.A O no hydrogen 2.833 N/A LYS 41.A N ILE 38.A O no hydrogen 3.176 N/A LYS 41.A NZ GLU 253.A OE1 no hydrogen 3.100 N/A ASP 42.A N LEU 39.A O no hydrogen 3.390 N/A LEU 43.A N ILE 38.A O no hydrogen 3.487 N/A ASP 45.A N ASN 20.A O no hydrogen 3.263 N/A LEU 47.A N LYS 75.A O no hydrogen 2.928 N/A ALA 48.A N ILE 22.A O no hydrogen 2.954 N/A LEU 49.A N VAL 77.A O no hydrogen 2.859 N/A VAL 50.A N VAL 24.A O no hydrogen 3.131 N/A MET 53.A N ASP 51.A OD1 no hydrogen 2.747 N/A LYS 56.A NZ GLU 60.A OE2 no hydrogen 2.944 N/A LEU 57.A N MET 53.A O no hydrogen 2.874 N/A LYS 58.A N GLU 54.A O no hydrogen 2.821 N/A GLY 59.A N ASP 55.A O no hydrogen 2.884 N/A GLU 60.A N LYS 56.A O no hydrogen 3.023 N/A MET 61.A N LEU 57.A O no hydrogen 3.173 N/A MET 62.A N LYS 58.A O no hydrogen 2.909 N/A ASP 63.A N GLY 59.A O no hydrogen 2.711 N/A LEU 64.A N GLU 60.A O no hydrogen 2.989 N/A GLN 65.A N MET 61.A O no hydrogen 2.814 N/A GLN 65.A NE2 ILE 76.A O no hydrogen 3.183 N/A HIS 66.A N MET 62.A O no hydrogen 2.947 N/A GLY 67.A N LEU 64.A O no hydrogen 2.849 N/A SER 68.A N GLN 65.A O no hydrogen 2.949 N/A SER 68.A OG GLN 65.A O no hydrogen 2.556 N/A PHE 70.A N GLY 67.A O no hydrogen 2.837 N/A LEU 71.A N SER 68.A O no hydrogen 2.764 N/A THR 73.A OG1 ALA 44.A O no hydrogen 3.250 N/A VAL 77.A N LEU 47.A O no hydrogen 2.892 N/A GLY 79.A N LEU 49.A O no hydrogen 3.294 N/A LYS 80.A NZ GLU 54.A OE2 no hydrogen 2.766 N/A SER 83.A N ASP 81.A OD1 no hydrogen 2.704 N/A SER 83.A OG ASP 81.A OD1 no hydrogen 2.640 N/A VAL 84.A N ASP 81.A O no hydrogen 3.350 N/A THR 85.A N TYR 82.A O no hydrogen 2.999 N/A THR 85.A OG1 TYR 82.A O no hydrogen 2.888 N/A ALA 86.A N SER 83.A O no hydrogen 3.129 N/A ASN 87.A N TYR 119.A O no hydrogen 2.828 N/A SER 88.A N SER 120.A OG no hydrogen 2.702 N/A SER 88.A OG THR 23.A OG1 no hydrogen 2.679 N/A SER 88.A OG THR 85.A O no hydrogen 2.878 N/A LYS 89.A N LYS 21.A O no hydrogen 3.033 N/A LYS 89.A NZ GLN 19.A O no hydrogen 2.910 N/A VAL 91.A N LYS 124.A O no hydrogen 2.888 N/A ILE 92.A N THR 23.A O no hydrogen 2.894 N/A ILE 93.A N LEU 126.A O no hydrogen 2.657 N/A THR 94.A N VAL 25.A O no hydrogen 2.942 N/A THR 94.A OG1 VAL 25.A O no hydrogen 2.432 N/A THR 94.A OG1 GLY 26.A O no hydrogen 3.175 N/A GLN 103.A NE2 GLN 323.A O no hydrogen 2.949 N/A ARG 104.A N LEU 101.A O no hydrogen 2.495 N/A ARG 104.A NH1 ARG 98.A O no hydrogen 3.353 N/A ASN 105.A N LEU 101.A O no hydrogen 3.383 N/A VAL 106.A N VAL 102.A O no hydrogen 2.602 N/A ASN 107.A N GLN 103.A O no hydrogen 2.688 N/A ILE 108.A N ARG 104.A O no hydrogen 2.644 N/A PHE 109.A N ASN 105.A O no hydrogen 2.831 N/A LYS 110.A N VAL 106.A O no hydrogen 2.802 N/A LYS 110.A NZ LYS 110.A O no hydrogen 2.764 N/A PHE 111.A N ASN 107.A O no hydrogen 3.375 N/A PHE 111.A N ILE 108.A O no hydrogen 3.222 N/A ILE 112.A N ILE 108.A O no hydrogen 2.990 N/A ILE 113.A N PHE 109.A O no hydrogen 3.012 N/A ASN 115.A N PHE 111.A O no hydrogen 3.421 N/A VAL 116.A N ILE 112.A O no hydrogen 2.864 N/A VAL 117.A N ILE 113.A O no hydrogen 2.825 N/A LYS 118.A N PRO 114.A O no hydrogen 2.948 N/A LYS 118.A NZ TYR 119.A OH no hydrogen 3.417 N/A TYR 119.A N VAL 116.A O no hydrogen 3.164 N/A SER 120.A N VAL 116.A O no hydrogen 2.984 N/A SER 120.A OG THR 85.A O no hydrogen 2.885 N/A CYS 123.A N SER 120.A O no hydrogen 3.152 N/A CYS 123.A SG SER 120.A O no hydrogen 3.404 N/A CYS 123.A SG LYS 124.A O no hydrogen 3.780 N/A LYS 124.A N LYS 89.A O no hydrogen 2.859 N/A LYS 124.A NZ LYS 89.A O no hydrogen 3.183 N/A LYS 124.A NZ GLN 289.A O no hydrogen 3.489 N/A LEU 125.A N ARG 149.A O no hydrogen 2.917 N/A LEU 126.A N VAL 91.A O no hydrogen 2.925 N/A VAL 127.A N ILE 151.A O no hydrogen 2.794 N/A VAL 128.A N ILE 93.A O no hydrogen 2.826 N/A SER 129.A OG ILE 93.A O no hydrogen 3.201 N/A SER 129.A OG ALA 95.A O no hydrogen 2.608 N/A LEU 135.A N PRO 131.A O no hydrogen 2.986 N/A THR 136.A N VAL 132.A O no hydrogen 3.039 N/A THR 136.A OG1 VAL 132.A O no hydrogen 2.464 N/A TYR 137.A N ASP 133.A O no hydrogen 3.297 N/A VAL 138.A N ILE 134.A O no hydrogen 2.797 N/A ALA 139.A N LEU 135.A O no hydrogen 2.659 N/A TRP 140.A N THR 136.A O no hydrogen 2.842 N/A LYS 141.A N TYR 137.A O no hydrogen 2.955 N/A ILE 142.A N VAL 138.A O no hydrogen 3.048 N/A SER 143.A N ALA 139.A O no hydrogen 2.968 N/A SER 143.A OG ALA 139.A O no hydrogen 3.235 N/A SER 143.A OG TRP 140.A O no hydrogen 2.998 N/A PHE 145.A N SER 143.A OG no hydrogen 2.957 N/A ASN 148.A ND2 ASN 290.A O no hydrogen 2.796 N/A ARG 149.A N PRO 146.A O no hydrogen 3.131 N/A ARG 149.A NH2 PRO 121.A O no hydrogen 3.419 N/A VAL 150.A N LYS 147.A O no hydrogen 3.270 N/A ILE 151.A N LEU 125.A O no hydrogen 2.670 N/A GLY 152.A N SER 266.A O no hydrogen 2.954 N/A SER 153.A N VAL 127.A O no hydrogen 3.012 N/A SER 153.A OG VAL 127.A O no hydrogen 3.356 N/A CYS 155.A N SER 282.A OG no hydrogen 2.955 N/A CYS 155.A SG GLY 183.A O no hydrogen 3.785 N/A ASN 156.A N SER 153.A O no hydrogen 3.064 N/A SER 159.A N CYS 155.A O no hydrogen 2.885 N/A SER 159.A OG CYS 155.A O no hydrogen 3.054 N/A ALA 160.A N ASN 156.A O no hydrogen 3.152 N/A ARG 161.A N LEU 157.A O no hydrogen 2.836 N/A ARG 161.A NH2 ASP 158.A OD2 no hydrogen 3.203 N/A PHE 162.A N ASP 158.A O no hydrogen 2.904 N/A ARG 163.A N SER 159.A O no hydrogen 3.019 N/A ARG 163.A NE ALA 174.A O no hydrogen 3.381 N/A ARG 163.A NE CYS 177.A O no hydrogen 2.783 N/A ARG 163.A NH2 ALA 174.A O no hydrogen 3.289 N/A ARG 163.A NH2 LEU 175.A O no hydrogen 3.435 N/A ARG 163.A NH2 CYS 177.A O no hydrogen 3.503 N/A TYR 164.A N ALA 160.A O no hydrogen 2.898 N/A LEU 165.A N ARG 161.A O no hydrogen 2.768 N/A MET 166.A N PHE 162.A O no hydrogen 2.808 N/A GLY 167.A N ARG 163.A O no hydrogen 2.920 N/A GLU 168.A N TYR 164.A O no hydrogen 3.118 N/A ARG 169.A N LEU 165.A O no hydrogen 3.393 N/A ARG 169.A NH1 GLU 217.A O no hydrogen 2.917 N/A ARG 169.A NH2 GLU 217.A O no hydrogen 3.484 N/A LEU 170.A N MET 166.A O no hydrogen 2.979 N/A GLY 171.A N GLY 167.A O no hydrogen 2.734 N/A VAL 172.A N GLY 167.A O no hydrogen 3.113 N/A LEU 175.A N HIS 173.A ND1 no hydrogen 2.909 N/A SER 176.A N HIS 173.A O no hydrogen 2.853 N/A CYS 177.A N ALA 174.A O no hydrogen 3.033 N/A CYS 177.A SG VAL 172.A O no hydrogen 3.859 N/A CYS 177.A SG HIS 173.A O no hydrogen 3.430 N/A HIS 178.A N ASN 197.A O no hydrogen 3.076 N/A ILE 181.A N SER 159.A OG no hydrogen 3.131 N/A LEU 182.A N VAL 190.A O no hydrogen 2.874 N/A GLY 183.A N SER 282.A O no hydrogen 2.887 N/A HIS 185.A N ASP 133.A OD2 no hydrogen 2.928 N/A SER 189.A N GLY 186.A O no hydrogen 3.136 N/A SER 189.A OG GLY 186.A O no hydrogen 2.802 N/A VAL 190.A N LEU 182.A O no hydrogen 2.634 N/A VAL 192.A N TRP 180.A O no hydrogen 3.039 N/A GLY 195.A N VAL 192.A O no hydrogen 3.025 N/A MET 196.A N TRP 193.A O no hydrogen 3.362 N/A ASN 197.A N HIS 178.A O no hydrogen 3.109 N/A VAL 201.A N VAL 198.A O no hydrogen 2.926 N/A SER 202.A OG THR 205.A OG1 no hydrogen 3.067 N/A LEU 203.A N MET 196.A O no hydrogen 2.993 N/A LYS 204.A NZ PRO 208.A O no hydrogen 3.354 N/A LYS 204.A NZ LEU 210.A O no hydrogen 2.928 N/A THR 205.A N SER 202.A OG no hydrogen 3.135 N/A THR 205.A OG1 SER 202.A OG no hydrogen 3.067 N/A LEU 206.A N SER 202.A O no hydrogen 3.325 N/A HIS 207.A N LEU 203.A O no hydrogen 2.786 N/A HIS 207.A NE2 ASP 215.A OD1 no hydrogen 2.930 N/A LEU 210.A N HIS 207.A O no hydrogen 2.829 N/A GLY 211.A N ASP 215.A OD2 no hydrogen 3.075 N/A THR 212.A N GLU 209.A O no hydrogen 2.867 N/A THR 212.A OG1 GLU 209.A O no hydrogen 2.687 N/A THR 212.A OG1 GLU 209.A OE2 no hydrogen 3.460 N/A ASP 215.A N THR 212.A O no hydrogen 3.266 N/A GLU 217.A N ASP 215.A OD1 no hydrogen 3.000 N/A GLN 218.A N ASP 215.A O no hydrogen 3.001 N/A GLN 218.A NE2 ASP 215.A O no hydrogen 3.074 N/A TRP 219.A N ASP 215.A OD2 no hydrogen 3.024 N/A TRP 219.A NE1 GLU 217.A OE2 no hydrogen 3.043 N/A GLN 221.A N GLN 218.A O no hydrogen 3.213 N/A VAL 222.A N TRP 219.A O no hydrogen 2.812 N/A LYS 224.A N LYS 220.A O no hydrogen 3.048 N/A LYS 224.A NZ ASP 228.A OD2 no hydrogen 3.436 N/A GLN 225.A N GLN 221.A O no hydrogen 2.753 N/A VAL 226.A N VAL 222.A O no hydrogen 3.180 N/A VAL 227.A N HIS 223.A O no hydrogen 3.048 N/A ASP 228.A N LYS 224.A O no hydrogen 3.053 N/A SER 229.A N VAL 226.A O no hydrogen 3.400 N/A SER 229.A OG VAL 226.A O no hydrogen 3.054 N/A GLU 232.A N ASP 228.A O no hydrogen 2.974 N/A VAL 233.A N SER 229.A O no hydrogen 2.900 N/A ILE 234.A N ALA 230.A O no hydrogen 2.942 N/A LYS 235.A N TYR 231.A O no hydrogen 2.906 N/A LEU 236.A N GLU 232.A O no hydrogen 3.237 N/A LEU 236.A N VAL 233.A O no hydrogen 2.987 N/A LYS 237.A N VAL 233.A O no hydrogen 2.911 N/A LYS 237.A NZ THR 241.A OG1 no hydrogen 3.032 N/A GLY 238.A N ILE 234.A O no hydrogen 2.788 N/A GLY 245.A N THR 241.A O no hydrogen 2.820 N/A LEU 246.A N TRP 242.A O no hydrogen 2.901 N/A SER 247.A N ALA 243.A O no hydrogen 2.957 N/A SER 247.A OG ALA 243.A O no hydrogen 3.333 N/A SER 247.A OG ILE 244.A O no hydrogen 2.736 N/A VAL 248.A N ILE 244.A O no hydrogen 2.963 N/A ALA 249.A N GLY 245.A O no hydrogen 3.184 N/A ASP 250.A N LEU 246.A O no hydrogen 3.120 N/A LEU 251.A N VAL 248.A O no hydrogen 2.953 N/A ALA 252.A N VAL 248.A O no hydrogen 2.929 N/A GLU 253.A N ALA 249.A O no hydrogen 2.891 N/A SER 254.A N ASP 250.A O no hydrogen 3.342 N/A SER 254.A OG HIS 263.A NE2 no hydrogen 2.935 N/A ILE 255.A N LEU 251.A O no hydrogen 3.043 N/A MET 256.A N ALA 252.A O no hydrogen 2.705 N/A LYS 257.A N GLU 253.A O no hydrogen 2.913 N/A LYS 257.A NZ GLU 253.A OE2 no hydrogen 3.482 N/A ASN 258.A N ILE 255.A O no hydrogen 3.220 N/A LEU 259.A N SER 254.A O no hydrogen 3.071 N/A ARG 260.A NH1 SER 293.A OG no hydrogen 3.108 N/A ARG 260.A NH2 ASP 294.A OD1 no hydrogen 3.297 N/A ARG 261.A NE SER 254.A OG no hydrogen 2.665 N/A ARG 261.A NH1 ASP 250.A OD2 no hydrogen 3.175 N/A ARG 261.A NH1 SER 254.A OG no hydrogen 2.720 N/A ARG 261.A NH2 ASP 250.A OD2 no hydrogen 3.132 N/A HIS 263.A N CYS 285.A O no hydrogen 2.960 N/A HIS 263.A NE2 SER 254.A OG no hydrogen 2.935 N/A SER 266.A N GLY 152.A O no hydrogen 2.781 N/A SER 266.A OG ASP 133.A OD1 no hydrogen 2.842 N/A THR 267.A N LEU 281.A O no hydrogen 3.145 N/A LEU 269.A N VAL 279.A O no hydrogen 3.225 N/A GLY 271.A N ILE 275.A O no hydrogen 2.919 N/A LEU 272.A N LEU 269.A O no hydrogen 2.888 N/A TYR 273.A OH VAL 296.A O no hydrogen 2.751 N/A ILE 275.A N LEU 272.A O no hydrogen 2.802 N/A LEU 281.A N THR 267.A O no hydrogen 3.142 N/A SER 282.A N GLY 183.A O no hydrogen 3.077 N/A VAL 283.A N ILE 265.A O no hydrogen 3.327 N/A CYS 285.A N HIS 263.A O no hydrogen 2.820 N/A CYS 285.A SG ILE 265.A O no hydrogen 3.735 N/A CYS 285.A SG VAL 283.A O no hydrogen 3.091 N/A VAL 286.A N ASP 294.A O no hydrogen 3.111 N/A LEU 287.A N ARG 261.A O no hydrogen 2.823 N/A GLY 288.A N GLY 291.A O no hydrogen 3.056 N/A GLN 289.A N ASN 258.A OD1 no hydrogen 2.998 N/A GLY 291.A N GLY 288.A O no hydrogen 2.795 N/A ILE 292.A N ASN 148.A O no hydrogen 2.879 N/A SER 293.A N VAL 286.A O no hydrogen 3.288 N/A SER 293.A OG ASP 294.A OD1 no hydrogen 2.546 N/A VAL 296.A N PRO 284.A O no hydrogen 2.918 N/A VAL 298.A N TYR 273.A OH no hydrogen 2.978 N/A THR 301.A N GLU 304.A OE2 no hydrogen 2.947 N/A GLU 304.A N THR 301.A OG1 no hydrogen 3.087 N/A GLU 305.A N THR 301.A O no hydrogen 2.905 N/A ALA 306.A N SER 302.A O no hydrogen 3.073 N/A HIS 307.A N GLU 303.A O no hydrogen 2.864 N/A LEU 308.A N GLU 304.A O no hydrogen 3.139 N/A LYS 309.A N GLU 305.A O no hydrogen 3.140 N/A LYS 310.A N ALA 306.A O no hydrogen 3.084 N/A SER 311.A N HIS 307.A O no hydrogen 3.091 N/A SER 311.A OG GLU 184.A OE1 no hydrogen 3.246 N/A SER 311.A OG HIS 307.A O no hydrogen 3.416 N/A ALA 312.A N LEU 308.A O no hydrogen 3.061 N/A ASP 313.A N LYS 309.A O no hydrogen 3.145 N/A THR 314.A N LYS 310.A O no hydrogen 2.898 N/A THR 314.A OG1 LYS 310.A O no hydrogen 2.962 N/A LEU 315.A N SER 311.A O no hydrogen 2.860 N/A TRP 316.A N ALA 312.A O no hydrogen 2.953 N/A GLY 317.A N ASP 313.A O no hydrogen 3.011 N/A ILE 318.A N THR 314.A O no hydrogen 3.214 N/A GLN 319.A N LEU 315.A O no hydrogen 2.753 N/A GLN 319.A NE2 ASP 278.A O no hydrogen 2.862 N/A LYS 320.A N TRP 316.A O no hydrogen 2.642 N/A GLU 321.A N ILE 318.A O no hydrogen 3.423 N/A GLN 323.A N GLN 103.A OE1 no hydrogen 2.996 N/A