Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4g8l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N SER 2.A O no hydrogen 3.207 N/A ALA 7.A N GLY 3.A O no hydrogen 3.016 N/A VAL 8.A N ARG 4.A O no hydrogen 3.421 N/A GLU 9.A N ARG 5.A O no hydrogen 3.421 N/A ASP 10.A N ALA 6.A O no hydrogen 3.295 N/A ASN 11.A N ALA 7.A O no hydrogen 2.882 N/A HIS 12.A N VAL 8.A O no hydrogen 3.026 N/A LEU 13.A N GLU 9.A O no hydrogen 2.873 N/A LEU 14.A N ASP 10.A O no hydrogen 2.883 N/A ILE 15.A N ASN 11.A O no hydrogen 3.087 N/A LYS 16.A N HIS 12.A O no hydrogen 2.955 N/A ALA 17.A N LEU 13.A O no hydrogen 2.595 N/A VAL 18.A N LEU 14.A O no hydrogen 2.934 N/A GLN 19.A N ILE 15.A O no hydrogen 2.896 N/A GLN 19.A NE2 ASN 50.A OD1 no hydrogen 3.170 N/A ASN 20.A N LYS 16.A O no hydrogen 2.864 N/A GLU 21.A N VAL 18.A O no hydrogen 2.836 N/A ASP 22.A N ALA 17.A O no hydrogen 2.994 N/A LEU 25.A N ASP 22.A OD1 no hydrogen 3.284 N/A VAL 26.A N ASP 22.A O no hydrogen 2.984 N/A GLN 27.A N VAL 23.A O no hydrogen 2.925 N/A GLN 28.A N ASP 24.A O no hydrogen 2.990 N/A LEU 29.A N LEU 25.A O no hydrogen 2.950 N/A LEU 30.A N VAL 26.A O no hydrogen 2.983 N/A GLU 31.A N GLN 27.A O no hydrogen 2.943 N/A GLY 32.A N GLN 28.A O no hydrogen 2.732 N/A GLY 33.A N LEU 30.A O no hydrogen 2.897 N/A ALA 34.A N LEU 29.A O no hydrogen 2.963 N/A ASN 35.A N ASN 11.A OD1 no hydrogen 2.963 N/A ASN 37.A N ASN 35.A OD1 no hydrogen 3.019 N/A ASN 37.A ND2 GLY 67.A O no hydrogen 3.166 N/A PHE 38.A N ASN 35.A O no hydrogen 3.243 N/A GLN 39.A NE2 GLY 44.A O no hydrogen 3.119 N/A GLN 39.A NE2 ARG 73.A O no hydrogen 3.551 N/A GLU 40.A N TRP 45.A O no hydrogen 2.938 N/A GLU 42.A N GLU 40.A OE2 no hydrogen 2.905 N/A GLY 43.A N GLU 40.A OE1 no hydrogen 2.890 N/A GLY 43.A N GLU 40.A OE2 no hydrogen 3.449 N/A GLY 44.A N GLU 40.A O no hydrogen 3.095 N/A TRP 45.A N GLU 40.A OE1 no hydrogen 2.876 N/A HIS 49.A N THR 46.A OG1 no hydrogen 3.038 N/A ASN 50.A N THR 46.A O no hydrogen 3.169 N/A ASN 50.A ND2 THR 46.A O no hydrogen 3.219 N/A ALA 51.A N PRO 47.A O no hydrogen 2.864 N/A VAL 52.A N LEU 48.A O no hydrogen 2.899 N/A GLN 53.A N HIS 49.A O no hydrogen 2.789 N/A MET 54.A N ASN 50.A O no hydrogen 3.160 N/A SER 55.A N VAL 52.A O no hydrogen 2.847 N/A ARG 56.A N ALA 51.A O no hydrogen 3.262 N/A ARG 56.A NE ASP 58.A OD1 no hydrogen 3.044 N/A ARG 56.A NE ASP 58.A OD2 no hydrogen 3.283 N/A ARG 56.A NH2 ASP 58.A OD2 no hydrogen 2.665 N/A VAL 60.A N ARG 56.A O no hydrogen 3.142 N/A GLU 61.A N GLU 57.A O no hydrogen 2.870 N/A LEU 62.A N ASP 58.A O no hydrogen 3.164 N/A LEU 63.A N ILE 59.A O no hydrogen 3.048 N/A LEU 64.A N VAL 60.A O no hydrogen 2.851 N/A ARG 65.A N GLU 61.A O no hydrogen 2.868 N/A ARG 65.A NE GLU 61.A OE2 no hydrogen 3.304 N/A HIS 66.A N LEU 62.A O no hydrogen 3.118 N/A GLY 67.A N LEU 64.A O no hydrogen 2.883 N/A ALA 68.A N LEU 63.A O no hydrogen 2.972 N/A ASP 69.A N ASN 37.A OD1 no hydrogen 2.733 N/A VAL 71.A N ASP 69.A OD1 no hydrogen 3.125 N/A ARG 73.A NH1 GLY 77.A O no hydrogen 2.809 N/A ARG 73.A NH1 CYS 106.A O no hydrogen 3.104 N/A LYS 74.A N ALA 78.A O no hydrogen 3.229 N/A LYS 74.A NZ ASN 76.A OD1 no hydrogen 2.972 N/A LYS 75.A N GLY 43.A O no hydrogen 2.919 N/A GLY 77.A N LYS 74.A O no hydrogen 2.918 N/A ALA 78.A N ASN 76.A OD1 no hydrogen 3.035 N/A THR 79.A OG1 GLU 105.A OE2 no hydrogen 2.650 N/A LEU 83.A N THR 79.A O no hydrogen 3.080 N/A ALA 84.A N PRO 80.A O no hydrogen 3.012 N/A ALA 84.A N PHE 81.A O no hydrogen 3.180 N/A ALA 85.A N ILE 82.A O no hydrogen 2.715 N/A ILE 86.A N ILE 82.A O no hydrogen 3.368 N/A ALA 87.A N LEU 83.A O no hydrogen 3.111 N/A GLY 88.A N ALA 85.A O no hydrogen 2.886 N/A SER 89.A N ALA 84.A O no hydrogen 2.985 N/A LEU 92.A N SER 89.A OG no hydrogen 3.211 N/A LEU 93.A N SER 89.A O no hydrogen 3.120 N/A LYS 94.A N VAL 90.A O no hydrogen 2.882 N/A LEU 95.A N LYS 91.A O no hydrogen 2.978 N/A PHE 96.A N LEU 92.A O no hydrogen 2.988 N/A LEU 97.A N LEU 93.A O no hydrogen 2.988 N/A SER 98.A N LYS 94.A O no hydrogen 3.163 N/A SER 98.A OG LEU 95.A O no hydrogen 2.763 N/A LYS 99.A N PHE 96.A O no hydrogen 3.340 N/A GLY 100.A N LEU 97.A O no hydrogen 3.115 N/A ALA 101.A N PHE 96.A O no hydrogen 2.925 N/A ASP 102.A N GLU 105.A OE1 no hydrogen 3.288 N/A ASN 104.A ND2 GLY 133.A O no hydrogen 3.140 N/A GLU 105.A N ASP 102.A O no hydrogen 3.000 N/A CYS 106.A SG ASP 107.A O no hydrogen 3.612 N/A ASP 107.A N PHE 111.A O no hydrogen 2.963 N/A PHE 108.A N ASN 76.A O no hydrogen 2.902 N/A TYR 109.A N ASP 107.A OD1 no hydrogen 2.931 N/A GLY 110.A N ASP 107.A O no hydrogen 3.026 N/A PHE 111.A N ASP 107.A OD1 no hydrogen 3.260 N/A MET 115.A N THR 112.A OG1 no hydrogen 3.210 N/A GLU 116.A N THR 112.A O no hydrogen 2.902 N/A ALA 117.A N ALA 113.A O no hydrogen 2.877 N/A ALA 118.A N PHE 114.A O no hydrogen 3.224 N/A ALA 118.A N MET 115.A O no hydrogen 3.002 N/A VAL 119.A N MET 115.A O no hydrogen 2.949 N/A TYR 120.A N GLU 116.A O no hydrogen 2.871 N/A GLY 121.A N ALA 118.A O no hydrogen 3.338 N/A LYS 122.A N ALA 117.A O no hydrogen 2.818 N/A LEU 126.A N LYS 122.A O no hydrogen 3.072 N/A LYS 127.A N VAL 123.A O no hydrogen 2.911 N/A PHE 128.A N LYS 124.A O no hydrogen 2.874 N/A LEU 129.A N ALA 125.A O no hydrogen 2.869 N/A TYR 130.A N LEU 126.A O no hydrogen 2.872 N/A LYS 131.A N LYS 127.A O no hydrogen 3.079 N/A ARG 132.A N LEU 129.A O no hydrogen 3.324 N/A GLY 133.A N TYR 130.A O no hydrogen 2.855 N/A ALA 134.A N LEU 129.A O no hydrogen 2.828 N/A ASN 135.A N ASN 104.A OD1 no hydrogen 2.653 N/A ASN 137.A N ASN 135.A OD1 no hydrogen 3.232 N/A ASN 137.A ND2 GLY 175.A O no hydrogen 3.011 N/A LEU 138.A N ASN 135.A O no hydrogen 3.523 N/A ARG 139.A NE CYS 181.A O no hydrogen 3.299 N/A ARG 139.A NH2 CYS 181.A O no hydrogen 3.255 N/A ARG 139.A NH2 ASN 183.A OD1 no hydrogen 2.856 N/A ARG 140.A N ALA 152.A O no hydrogen 2.800 N/A ARG 140.A NH1 ASP 157.A OD1 no hydrogen 3.546 N/A ARG 140.A NH1 ASP 157.A OD2 no hydrogen 2.577 N/A ARG 140.A NH2 ASP 157.A OD1 no hydrogen 2.916 N/A THR 142.A N ASP 145.A OD2 no hydrogen 3.347 N/A GLN 146.A N THR 142.A O no hydrogen 3.320 N/A GLN 146.A N LYS 143.A O no hydrogen 3.217 N/A GLN 146.A NE2 LYS 141.A O no hydrogen 3.688 N/A GLN 146.A NE2 THR 142.A O no hydrogen 3.628 N/A LEU 149.A N GLN 146.A O no hydrogen 2.990 N/A ARG 150.A N ASP 145.A O no hydrogen 3.359 N/A ARG 150.A NH1 ASP 145.A OD1 no hydrogen 2.687 N/A ASP 157.A N THR 153.A O no hydrogen 3.158 N/A ALA 158.A N ALA 154.A O no hydrogen 3.028 N/A ALA 159.A N LEU 155.A O no hydrogen 3.077 N/A ALA 159.A N MET 156.A O no hydrogen 2.849 N/A GLU 160.A N MET 156.A O no hydrogen 2.906 N/A LYS 161.A N ASP 157.A O no hydrogen 3.103 N/A GLY 162.A N ALA 159.A O no hydrogen 3.389 N/A HIS 163.A N ALA 158.A O no hydrogen 3.080 N/A LEU 167.A N HIS 163.A O no hydrogen 2.980 N/A LYS 168.A N VAL 164.A O no hydrogen 3.006 N/A ILE 169.A N GLU 165.A O no hydrogen 3.258 N/A LEU 170.A N VAL 166.A O no hydrogen 2.926 N/A LEU 171.A N LEU 167.A O no hydrogen 3.019 N/A ASP 172.A N LYS 168.A O no hydrogen 2.825 N/A GLU 173.A N ILE 169.A O no hydrogen 2.845 N/A MET 174.A N ILE 169.A O no hydrogen 3.065 N/A ALA 176.A N LEU 170.A O no hydrogen 2.733 N/A ASP 177.A N ASN 137.A OD1 no hydrogen 2.675 N/A ASN 179.A N ASP 177.A OD1 no hydrogen 3.184 N/A ASN 179.A ND2 GLY 212.A O no hydrogen 2.818 N/A ALA 180.A N ASP 177.A O no hydrogen 3.038 N/A CYS 181.A SG ASN 179.A O no hydrogen 3.981 N/A CYS 181.A SG GLY 185.A O no hydrogen 3.709 N/A ASP 182.A N ARG 186.A O no hydrogen 2.943 N/A MET 184.A N ASP 182.A OD1 no hydrogen 2.821 N/A GLY 185.A N ASP 182.A O no hydrogen 2.962 N/A ARG 186.A N ASP 182.A OD1 no hydrogen 3.041 N/A ARG 186.A NE ASP 182.A OD2 no hydrogen 2.860 N/A ARG 186.A NH1 GLU 220.A OE1 no hydrogen 3.025 N/A ARG 186.A NH2 ASP 182.A OD2 no hydrogen 2.957 N/A ASN 187.A ND2 ASN 179.A OD1 no hydrogen 3.385 N/A ILE 190.A N ASN 187.A OD1 no hydrogen 3.206 N/A HIS 191.A N ASN 187.A O no hydrogen 3.022 N/A ALA 192.A N ALA 188.A O no hydrogen 3.163 N/A LEU 193.A N LEU 189.A O no hydrogen 3.244 N/A LEU 194.A N ILE 190.A O no hydrogen 2.980 N/A SER 195.A OG ALA 192.A O no hydrogen 3.559 N/A ASP 197.A N SER 195.A OG no hydrogen 2.973 N/A ILE 204.A N ASP 200.A O no hydrogen 3.046 N/A THR 205.A N VAL 201.A O no hydrogen 3.015 N/A THR 205.A OG1 VAL 201.A O no hydrogen 2.777 N/A HIS 206.A N GLU 202.A O no hydrogen 2.944 N/A LEU 207.A N ALA 203.A O no hydrogen 2.749 N/A LEU 208.A N ILE 204.A O no hydrogen 2.982 N/A LEU 209.A N THR 205.A O no hydrogen 3.033 N/A ASP 210.A N HIS 206.A O no hydrogen 2.959 N/A HIS 211.A N LEU 207.A O no hydrogen 3.178 N/A HIS 211.A ND1 LEU 207.A O no hydrogen 2.913 N/A HIS 211.A NE2 ASP 172.A OD1 no hydrogen 2.551 N/A GLY 212.A N LEU 209.A O no hydrogen 3.140 N/A ALA 213.A N LEU 208.A O no hydrogen 2.924 N/A ASP 214.A N ASN 179.A OD1 no hydrogen 2.780 N/A ASN 216.A N ASP 214.A OD1 no hydrogen 3.378 N/A ASN 216.A ND2 HIS 246.A O no hydrogen 2.942 N/A ARG 218.A NE ASP 251.A OD2 no hydrogen 3.293 N/A ARG 218.A NH2 ASP 251.A OD2 no hydrogen 3.260 N/A GLY 219.A N LYS 223.A O no hydrogen 3.195 N/A ILE 227.A N THR 224.A OG1 no hydrogen 3.272 N/A LEU 228.A N THR 224.A O no hydrogen 3.058 N/A ALA 229.A N PRO 225.A O no hydrogen 2.935 N/A VAL 230.A N LEU 226.A O no hydrogen 2.986 N/A GLU 231.A N ILE 227.A O no hydrogen 2.849 N/A LYS 232.A N LEU 228.A O no hydrogen 2.857 N/A LYS 232.A NZ ASP 198.A OD1 no hydrogen 2.716 N/A LYS 233.A N VAL 230.A O no hydrogen 2.717 N/A HIS 234.A N ALA 229.A O no hydrogen 3.195 N/A VAL 238.A N HIS 234.A O no hydrogen 3.405 N/A GLN 239.A N LEU 235.A O no hydrogen 2.832 N/A ARG 240.A N GLY 236.A O no hydrogen 2.849 N/A ARG 240.A NE ARG 240.A O no hydrogen 3.058 N/A ARG 240.A NH2 ASP 210.A OD1 no hydrogen 3.407 N/A LEU 241.A N LEU 237.A O no hydrogen 2.753 N/A LEU 242.A N VAL 238.A O no hydrogen 3.093 N/A GLU 243.A N ARG 240.A O no hydrogen 3.297 N/A GLN 244.A N LEU 241.A O no hydrogen 3.444 N/A GLU 248.A N ASN 216.A OD1 no hydrogen 2.888 N/A ILE 249.A N ILE 247.A O no hydrogen 2.751 N/A ASP 251.A N GLU 248.A O no hydrogen 2.811 N/A THR 252.A OG1 ASP 253.A O no hydrogen 3.097 N/A ASP 253.A N LYS 257.A O no hydrogen 2.837 N/A SER 254.A N ARG 221.A O no hydrogen 2.866 N/A GLY 256.A N ASP 253.A O no hydrogen 3.327 N/A LYS 257.A NZ GLU 265.A OE1 no hydrogen 3.450 N/A LEU 260.A N THR 258.A OG1 no hydrogen 3.222 N/A LEU 261.A N THR 258.A OG1 no hydrogen 3.370 N/A LEU 262.A N THR 258.A O no hydrogen 3.026 N/A ALA 263.A N ALA 259.A O no hydrogen 3.102 N/A VAL 264.A N LEU 260.A O no hydrogen 3.038 N/A GLU 265.A N LEU 261.A O no hydrogen 2.837 N/A LEU 266.A N LEU 262.A O no hydrogen 2.990 N/A LYS 267.A N VAL 264.A O no hydrogen 3.027 N/A LEU 268.A N ALA 263.A O no hydrogen 2.854 N/A ALA 272.A N LEU 268.A O no hydrogen 2.982 N/A GLU 273.A N LYS 269.A O no hydrogen 3.086 N/A LEU 274.A N LYS 270.A O no hydrogen 2.849 N/A LEU 275.A N ILE 271.A O no hydrogen 2.892 N/A CYS 276.A N ALA 272.A O no hydrogen 2.971 N/A CYS 276.A SG ALA 272.A O no hydrogen 3.555 N/A ARG 278.A N LEU 275.A O no hydrogen 2.987 N/A ARG 278.A NH1 LYS 277.A O no hydrogen 3.040 N/A GLY 279.A N LEU 275.A O no hydrogen 2.577 N/A ALA 280.A N ASN 250.A OD1 no hydrogen 2.709 N/A SER 281.A OG HIS 305.A O no hydrogen 2.754 N/A SER 281.A OG GLY 306.A O no hydrogen 2.996 N/A CYS 283.A SG THR 258.A OG1 no hydrogen 3.037 N/A ASP 285.A N CYS 283.A O no hydrogen 2.751 N/A THR 289.A N ASP 285.A O no hydrogen 3.094 N/A THR 289.A N LEU 286.A O no hydrogen 2.792 N/A THR 289.A OG1 ASP 285.A O no hydrogen 2.728 N/A ALA 290.A N LEU 286.A O no hydrogen 3.027 N/A ARG 291.A N VAL 287.A O no hydrogen 2.887 N/A ARG 292.A N MET 288.A O no hydrogen 3.054 N/A ASN 293.A N THR 289.A O no hydrogen 3.075 N/A ASN 293.A N ALA 290.A O no hydrogen 3.177 N/A ASN 293.A ND2 GLU 265.A O no hydrogen 3.423 N/A TYR 294.A N ARG 291.A O no hydrogen 2.868 N/A ASP 295.A N ALA 290.A O no hydrogen 2.968 N/A LEU 298.A N ASP 295.A OD1 no hydrogen 3.223 N/A VAL 299.A N ASP 295.A O no hydrogen 2.990 N/A LYS 300.A N HIS 296.A O no hydrogen 3.299 N/A VAL 301.A N SER 297.A O no hydrogen 3.351 N/A LEU 302.A N LEU 298.A O no hydrogen 3.068 N/A LEU 303.A N VAL 299.A O no hydrogen 3.343 N/A SER 304.A N LYS 300.A O no hydrogen 3.316 N/A SER 304.A OG LYS 300.A O no hydrogen 2.957 N/A HIS 305.A N LEU 302.A O no hydrogen 3.090 N/A GLY 306.A N LEU 303.A O no hydrogen 2.785 N/A