Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4aa5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH2 PRO 88.A O no hydrogen 2.927 N/A TYR 5.A N VAL 16.A O no hydrogen 2.967 N/A TYR 5.A OH TYR 20.A O no hydrogen 2.754 N/A ARG 6.A NE GLU 15.A OE2 no hydrogen 3.063 N/A LEU 9.A N THR 12.A O no hydrogen 3.178 N/A TRP 14.A N GLN 7.A O no hydrogen 2.996 N/A GLU 15.A N TYR 99.A OH no hydrogen 2.940 N/A VAL 16.A N TYR 5.A O no hydrogen 3.122 N/A GLU 18.A N THR 3.A O no hydrogen 2.935 N/A ARG 19.A NE ASP 39.A OD1 no hydrogen 3.082 N/A ARG 19.A NH2 ASP 39.A OD1 no hydrogen 3.540 N/A ARG 19.A NH2 ASP 39.A OD2 no hydrogen 3.085 N/A TYR 20.A N PRO 17.A O no hydrogen 3.015 N/A TYR 20.A OH ASP 84.A OD2 no hydrogen 2.746 N/A GLN 21.A N PHE 38.A O no hydrogen 2.885 N/A GLN 21.A NE2 GLU 18.A O no hydrogen 2.754 N/A SER 24.A N ALA 36.A O no hydrogen 2.910 N/A VAL 26.A N VAL 34.A O no hydrogen 2.938 N/A GLY 29.A N GLY 32.A O no hydrogen 2.833 N/A TYR 31.A OH THR 168.A O no hydrogen 3.151 N/A VAL 34.A N GLY 27.A O no hydrogen 3.129 N/A CYS 35.A N VAL 48.A O no hydrogen 2.861 N/A ALA 36.A N SER 24.A O no hydrogen 2.876 N/A ALA 37.A N VAL 46.A O no hydrogen 2.845 N/A PHE 38.A N GLN 21.A O no hydrogen 2.949 N/A ASP 39.A N LEU 44.A O no hydrogen 2.934 N/A THR 40.A N ARG 19.A O no hydrogen 2.843 N/A THR 40.A OG1 ARG 19.A O no hydrogen 2.845 N/A LYS 41.A N ASP 39.A OD1 no hydrogen 3.102 N/A THR 42.A N ASP 39.A O no hydrogen 3.254 N/A THR 42.A OG1 ASP 39.A OD2 no hydrogen 2.986 N/A GLY 43.A N ASP 39.A O no hydrogen 2.916 N/A LEU 44.A N THR 42.A OG1 no hydrogen 3.236 N/A VAL 46.A N ALA 37.A O no hydrogen 2.975 N/A ALA 47.A N THR 102.A O no hydrogen 3.087 N/A VAL 48.A N CYS 35.A O no hydrogen 2.719 N/A LYS 49.A N LEU 100.A O no hydrogen 2.856 N/A LYS 49.A NZ ALA 30.A O no hydrogen 2.843 N/A LYS 49.A NZ GLU 67.A OE1 no hydrogen 3.540 N/A LYS 49.A NZ GLU 67.A OE2 no hydrogen 2.535 N/A LYS 50.A N SER 33.A O no hydrogen 3.103 N/A LYS 50.A NZ THR 12.A OG1 no hydrogen 2.683 N/A LYS 50.A NZ ILE 13.A O no hydrogen 2.678 N/A LEU 51.A N VAL 98.A O no hydrogen 3.014 N/A SER 52.A N TYR 31.A O no hydrogen 2.896 N/A GLN 56.A N ARG 53.A O no hydrogen 3.389 N/A HIS 60.A N SER 57.A OG no hydrogen 3.380 N/A HIS 60.A ND1 ARG 53.A O no hydrogen 2.613 N/A ALA 61.A N SER 57.A O no hydrogen 2.953 N/A LYS 62.A N ILE 58.A O no hydrogen 2.930 N/A LYS 62.A NZ GLU 316.A O no hydrogen 2.818 N/A LYS 62.A NZ ARG 318.A O no hydrogen 3.415 N/A ARG 63.A N ILE 59.A O no hydrogen 3.105 N/A ARG 63.A NE THR 168.A O no hydrogen 3.239 N/A ARG 63.A NH2 THR 168.A O no hydrogen 3.125 N/A THR 64.A N HIS 60.A O no hydrogen 2.924 N/A THR 64.A OG1 PRO 54.A O no hydrogen 3.055 N/A THR 64.A OG1 HIS 60.A O no hydrogen 2.643 N/A TYR 65.A N ALA 61.A O no hydrogen 3.086 N/A ARG 66.A N LYS 62.A O no hydrogen 2.822 N/A ARG 66.A NE GLU 316.A OE1 no hydrogen 3.362 N/A ARG 66.A NE GLU 316.A OE2 no hydrogen 2.893 N/A ARG 66.A NH2 GLU 316.A OE1 no hydrogen 2.866 N/A GLU 67.A N ARG 63.A O no hydrogen 2.852 N/A LEU 68.A N THR 64.A O no hydrogen 3.046 N/A ARG 69.A N TYR 65.A O no hydrogen 2.984 N/A ARG 69.A NH1 TYR 65.A OH no hydrogen 2.945 N/A ARG 69.A NH2 ASP 312.A O no hydrogen 2.718 N/A LEU 70.A N ARG 66.A O no hydrogen 2.936 N/A LEU 71.A N GLU 67.A O no hydrogen 3.058 N/A LYS 72.A N LEU 68.A O no hydrogen 3.071 N/A LYS 72.A NZ GLU 332.A O no hydrogen 3.071 N/A LYS 72.A NZ GLU 332.A OE1 no hydrogen 2.587 N/A LYS 72.A NZ SER 335.A OG no hydrogen 3.382 N/A HIS 73.A N ARG 69.A O no hydrogen 3.317 N/A HIS 73.A NE2 ASP 309.A O no hydrogen 2.827 N/A MET 74.A N LEU 71.A O no hydrogen 3.287 N/A LYS 75.A N TYR 132.A OH no hydrogen 3.035 N/A ASN 78.A N HIS 76.A ND1 no hydrogen 2.924 N/A ASN 78.A ND2 GLN 125.A OE1 no hydrogen 3.367 N/A ASN 78.A ND2 LEU 155.A O no hydrogen 2.953 N/A VAL 79.A N HIS 76.A O no hydrogen 3.119 N/A ILE 80.A N ILE 157.A O no hydrogen 3.088 N/A LEU 83.A N VAL 101.A O no hydrogen 2.896 N/A ASP 84.A N VAL 101.A O no hydrogen 3.132 N/A PHE 86.A N TYR 99.A O no hydrogen 3.099 N/A THR 87.A OG1 ASP 97.A O no hydrogen 2.707 N/A ALA 89.A N THR 87.A OG1 no hydrogen 3.219 N/A ARG 90.A N GLU 94.A OE2 no hydrogen 3.456 N/A PHE 95.A N LEU 92.A O no hydrogen 3.007 N/A TYR 99.A N PHE 86.A O no hydrogen 3.000 N/A LEU 100.A N LYS 49.A O no hydrogen 2.985 N/A VAL 101.A N ASP 84.A O no hydrogen 2.768 N/A THR 102.A N ALA 47.A O no hydrogen 3.084 N/A THR 102.A OG1 HIS 103.A O no hydrogen 2.890 N/A LEU 104.A N ARG 45.A O no hydrogen 3.277 N/A LEU 109.A N LEU 148.A O no hydrogen 3.150 N/A ASN 111.A N ASP 108.A O no hydrogen 3.296 N/A ASN 111.A N ASP 108.A OD1 no hydrogen 3.245 N/A VAL 119.A N THR 115.A O no hydrogen 3.189 N/A GLN 120.A N ASP 116.A O no hydrogen 2.892 N/A GLN 120.A NE2 ASP 116.A OD2 no hydrogen 2.765 N/A PHE 121.A N ASP 117.A O no hydrogen 3.100 N/A LEU 122.A N HIS 118.A O no hydrogen 2.848 N/A ILE 123.A N VAL 119.A O no hydrogen 2.835 N/A TYR 124.A N GLN 120.A O no hydrogen 2.853 N/A TYR 124.A OH GLU 305.A OE2 no hydrogen 2.719 N/A GLN 125.A N PHE 121.A O no hydrogen 3.085 N/A GLN 125.A NE2 PHE 121.A O no hydrogen 3.299 N/A ILE 126.A N LEU 122.A O no hydrogen 3.152 N/A LEU 127.A N ILE 123.A O no hydrogen 3.012 N/A ARG 128.A N TYR 124.A O no hydrogen 2.977 N/A ARG 128.A NE ASP 304.A O no hydrogen 2.963 N/A ARG 128.A NH1 ASN 78.A OD1 no hydrogen 2.823 N/A ARG 128.A NH2 GLU 77.A OE1 no hydrogen 3.288 N/A ARG 128.A NH2 GLU 77.A OE2 no hydrogen 3.465 N/A ARG 128.A NH2 ASP 304.A O no hydrogen 3.345 N/A GLY 129.A N GLN 125.A O no hydrogen 2.986 N/A LEU 130.A N ILE 126.A O no hydrogen 2.743 N/A LYS 131.A N LEU 127.A O no hydrogen 2.742 N/A LYS 131.A NZ GLU 305.A O no hydrogen 3.051 N/A TYR 132.A N ARG 128.A O no hydrogen 3.223 N/A TYR 132.A OH HIS 73.A O no hydrogen 3.397 N/A ILE 133.A N GLY 129.A O no hydrogen 3.081 N/A HIS 134.A N LEU 130.A O no hydrogen 2.911 N/A HIS 134.A NE2 ASP 193.A OD2 no hydrogen 2.765 N/A SER 135.A N LYS 131.A O no hydrogen 3.166 N/A SER 135.A OG LYS 131.A O no hydrogen 3.426 N/A SER 135.A OG TYR 132.A O no hydrogen 2.435 N/A ALA 136.A N ILE 133.A O no hydrogen 3.172 N/A ASP 137.A N HIS 134.A O no hydrogen 3.035 N/A ILE 138.A N ILE 133.A O no hydrogen 3.064 N/A HIS 140.A N ASP 193.A OD2 no hydrogen 2.925 N/A HIS 140.A NE2 LEU 158.A O no hydrogen 2.759 N/A ARG 141.A N ASP 193.A OD1 no hydrogen 2.862 N/A ARG 141.A NE TYR 188.A OH no hydrogen 2.882 N/A ARG 141.A NH2 TYR 188.A OH no hydrogen 3.565 N/A ASP 142.A N HIS 140.A ND1 no hydrogen 3.108 N/A LYS 144.A NZ ASP 142.A OD2 no hydrogen 2.767 N/A LYS 144.A NZ THR 173.A OG1 no hydrogen 2.614 N/A ASN 147.A N LYS 144.A O no hydrogen 3.074 N/A LEU 148.A N PRO 145.A O no hydrogen 3.137 N/A ALA 149.A N LYS 156.A O no hydrogen 2.805 N/A VAL 150.A N ALA 107.A O no hydrogen 3.267 N/A ASN 151.A N GLU 154.A O no hydrogen 3.008 N/A ASP 153.A N ASN 151.A OD1 no hydrogen 3.046 N/A LEU 155.A N GLN 125.A OE1 no hydrogen 3.015 N/A LYS 156.A N ALA 149.A O no hydrogen 2.798 N/A LYS 156.A NZ GLU 77.A O no hydrogen 2.517 N/A ILE 157.A N ASN 78.A O no hydrogen 2.970 N/A LEU 158.A N ASN 147.A O no hydrogen 2.965 N/A GLY 161.A N ILE 139.A O no hydrogen 3.200 N/A THR 166.A OG1 HIS 165.A O no hydrogen 2.785 N/A THR 168.A OG1 LEU 162.A O no hydrogen 3.021 N/A TYR 170.A OH ASP 142.A OD2 no hydrogen 2.766 N/A THR 173.A N ASP 142.A OD1 no hydrogen 3.036 N/A ARG 174.A NH2 GLY 213.A O no hydrogen 3.321 N/A TRP 175.A NE1 GLY 213.A O no hydrogen 2.944 N/A TYR 176.A N THR 173.A O no hydrogen 3.488 N/A TYR 176.A OH GLU 203.A OE1 no hydrogen 2.475 N/A TYR 176.A OH GLU 203.A OE2 no hydrogen 3.244 N/A ARG 177.A N ARG 174.A O no hydrogen 3.225 N/A ARG 177.A NE ARG 141.A O no hydrogen 3.304 N/A ARG 177.A NH2 ARG 141.A O no hydrogen 2.869 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 3.029 N/A ILE 181.A N ALA 178.A O no hydrogen 3.158 N/A MET 182.A N PRO 179.A O no hydrogen 3.343 N/A LEU 183.A N PRO 179.A O no hydrogen 3.095 N/A ASN 184.A ND2 ASN 184.A O no hydrogen 2.536 N/A HIS 187.A NE2 ASP 282.A OD1 no hydrogen 3.201 N/A ASN 189.A ND2 THR 191.A OG1 no hydrogen 2.415 N/A THR 191.A OG1 SER 281.A O no hydrogen 3.251 N/A VAL 192.A N ASN 189.A O no hydrogen 3.112 N/A ASP 193.A N GLN 190.A O no hydrogen 3.151 N/A TRP 195.A N THR 191.A O no hydrogen 3.229 N/A SER 196.A N VAL 192.A O no hydrogen 3.386 N/A SER 196.A OG TYR 176.A O no hydrogen 2.559 N/A SER 196.A OG VAL 192.A O no hydrogen 3.478 N/A VAL 197.A N ASP 193.A O no hydrogen 2.939 N/A GLY 198.A N ILE 194.A O no hydrogen 2.928 N/A CYS 199.A N TRP 195.A O no hydrogen 3.045 N/A CYS 199.A SG TRP 175.A O no hydrogen 3.830 N/A CYS 199.A SG TRP 195.A O no hydrogen 3.568 N/A ILE 200.A N SER 196.A O no hydrogen 2.930 N/A MET 201.A N VAL 197.A O no hydrogen 2.692 N/A ALA 202.A N GLY 198.A O no hydrogen 2.989 N/A GLU 203.A N CYS 199.A O no hydrogen 3.194 N/A LEU 204.A N ILE 200.A O no hydrogen 3.045 N/A LEU 205.A N MET 201.A O no hydrogen 3.287 N/A THR 206.A N ALA 202.A O no hydrogen 3.081 N/A THR 206.A OG1 ALA 202.A O no hydrogen 3.071 N/A GLY 207.A N GLU 203.A O no hydrogen 2.931 N/A ARG 208.A N THR 206.A OG1 no hydrogen 3.166 N/A GLY 213.A N GLN 219.A OE1 no hydrogen 3.227 N/A THR 214.A N ASP 218.A OD2 no hydrogen 3.082 N/A THR 214.A OG1 ASP 215.A OD2 no hydrogen 3.355 N/A ILE 217.A N ASP 215.A OD1 no hydrogen 3.098 N/A ASP 218.A N ASP 215.A OD1 no hydrogen 3.028 N/A GLN 219.A N ASP 215.A O no hydrogen 2.954 N/A GLN 219.A NE2 TRP 175.A O no hydrogen 3.467 N/A GLN 219.A NE2 PHE 211.A O no hydrogen 3.263 N/A LEU 220.A N HIS 216.A O no hydrogen 3.100 N/A LYS 221.A N ILE 217.A O no hydrogen 2.986 N/A LEU 222.A N ASP 218.A O no hydrogen 2.910 N/A ILE 223.A N GLN 219.A O no hydrogen 3.024 N/A LEU 224.A N LEU 220.A O no hydrogen 3.020 N/A ARG 225.A N LYS 221.A O no hydrogen 3.132 N/A LEU 226.A N ILE 223.A O no hydrogen 3.111 N/A VAL 227.A N ILE 223.A O no hydrogen 2.998 N/A GLY 228.A N LEU 224.A O no hydrogen 3.028 N/A THR 229.A N MET 253.A O no hydrogen 3.156 N/A THR 229.A OG1 MET 253.A O no hydrogen 3.174 N/A LEU 235.A N GLY 231.A O no hydrogen 3.176 N/A LYS 236.A N ALA 232.A O no hydrogen 3.074 N/A LYS 237.A N LEU 234.A O no hydrogen 3.094 N/A LYS 237.A NZ ASP 280.A OD1 no hydrogen 3.078 N/A LYS 237.A NZ ASP 280.A OD2 no hydrogen 2.701 N/A LYS 237.A NZ ASP 282.A OD2 no hydrogen 2.936 N/A ILE 238.A N LEU 235.A O no hydrogen 3.393 N/A SER 242.A OG SER 240.A OG no hydrogen 3.062 N/A ALA 243.A N SER 240.A OG no hydrogen 2.856 N/A ARG 244.A N SER 240.A O no hydrogen 3.275 N/A ARG 244.A NH1 ILE 238.A O no hydrogen 3.222 N/A ASN 245.A N GLU 241.A O no hydrogen 3.090 N/A TYR 246.A N SER 242.A O no hydrogen 2.990 N/A ILE 247.A N ALA 243.A O no hydrogen 3.199 N/A GLN 248.A N ARG 244.A O no hydrogen 3.108 N/A SER 249.A N TYR 246.A O no hydrogen 3.415 N/A SER 249.A OG ASN 245.A O no hydrogen 2.685 N/A LEU 250.A N TYR 246.A O no hydrogen 3.304 N/A MET 256.A N LEU 226.A O no hydrogen 2.951 N/A ASN 260.A N ASN 257.A O no hydrogen 3.041 N/A VAL 261.A N PHE 258.A O no hydrogen 3.317 N/A PHE 262.A N PHE 258.A O no hydrogen 2.957 N/A ALA 265.A N PHE 262.A O no hydrogen 3.275 N/A ASN 266.A ND2 ASP 116.A OD2 no hydrogen 2.478 N/A LEU 268.A N ASN 266.A OD1 no hydrogen 3.319 N/A VAL 270.A N ASN 266.A O no hydrogen 3.100 N/A ASP 271.A N PRO 267.A O no hydrogen 2.991 N/A LEU 272.A N LEU 268.A O no hydrogen 2.997 N/A LEU 273.A N ALA 269.A O no hydrogen 3.042 N/A GLU 274.A N VAL 270.A O no hydrogen 3.053 N/A LYS 275.A N LEU 272.A O no hydrogen 3.191 N/A LYS 275.A NZ ASP 271.A OD1 no hydrogen 3.570 N/A LYS 275.A NZ ASP 271.A OD2 no hydrogen 2.493 N/A MET 276.A N LEU 273.A O no hydrogen 3.142 N/A LEU 277.A N LEU 273.A O no hydrogen 2.989 N/A ASP 282.A N ASP 280.A OD1 no hydrogen 3.169 N/A LYS 283.A N ASP 280.A O no hydrogen 3.220 N/A ARG 284.A N SER 281.A O no hydrogen 3.474 N/A ARG 284.A NE VAL 278.A O no hydrogen 3.073 N/A ARG 284.A NH1 GLU 180.A OE1 no hydrogen 3.442 N/A ARG 284.A NH1 GLU 180.A OE2 no hydrogen 2.773 N/A ARG 284.A NH1 THR 191.A O no hydrogen 2.894 N/A ARG 284.A NH2 GLU 180.A OE1 no hydrogen 2.818 N/A ARG 284.A NH2 VAL 278.A O no hydrogen 3.114 N/A ILE 285.A N LYS 275.A O no hydrogen 3.233 N/A THR 286.A N GLN 289.A OE1 no hydrogen 3.111 N/A GLN 289.A N THR 286.A OG1 no hydrogen 3.198 N/A ALA 290.A N THR 286.A O no hydrogen 2.921 N/A LEU 291.A N ALA 287.A O no hydrogen 3.074 N/A ALA 292.A N GLN 289.A O no hydrogen 3.275 N/A HIS 293.A N ALA 290.A O no hydrogen 3.319 N/A HIS 293.A NE2 ASP 271.A OD2 no hydrogen 2.950 N/A TYR 295.A N HIS 293.A ND1 no hydrogen 3.168 N/A TYR 295.A OH ASP 116.A OD1 no hydrogen 2.800 N/A PHE 296.A N HIS 293.A O no hydrogen 3.010 N/A ALA 297.A N ALA 294.A O no hydrogen 3.135 N/A TYR 299.A N PHE 296.A O no hydrogen 3.152 N/A TYR 299.A OH ASP 117.A OD1 no hydrogen 2.615 N/A HIS 300.A N PHE 296.A O no hydrogen 2.871 N/A HIS 300.A ND1 GLU 305.A OE2 no hydrogen 3.002 N/A ASP 301.A N GLU 305.A OE2 no hydrogen 3.220 N/A ASP 303.A N ASP 301.A OD1 no hydrogen 3.297 N/A ASP 304.A N ASP 301.A O no hydrogen 3.044 N/A ALA 308.A N SER 135.A OG no hydrogen 3.037 N/A GLN 313.A NE2 ASP 137.A O no hydrogen 2.726 N/A SER 314.A N ASP 312.A OD1 no hydrogen 3.129 N/A SER 314.A OG ASP 312.A OD1 no hydrogen 2.800 N/A GLU 316.A N GLN 313.A O no hydrogen 3.314 N/A SER 317.A N SER 314.A O no hydrogen 3.243 N/A SER 317.A OG SER 314.A O no hydrogen 3.031 N/A ARG 318.A N PHE 315.A O no hydrogen 2.960 N/A ARG 318.A NH1 SER 314.A OG no hydrogen 3.149 N/A LEU 321.A N GLU 324.A OE1 no hydrogen 3.046 N/A TRP 325.A N LEU 321.A O no hydrogen 3.208 N/A LYS 326.A N ILE 322.A O no hydrogen 2.895 N/A LYS 326.A NZ PHE 95.A O no hydrogen 2.766 N/A LYS 326.A NZ ASN 96.A OD1 no hydrogen 3.507 N/A SER 327.A N ASP 323.A O no hydrogen 3.049 N/A LEU 328.A N GLU 324.A O no hydrogen 3.125 N/A THR 329.A N TRP 325.A O no hydrogen 2.985 N/A THR 329.A OG1 TRP 325.A O no hydrogen 2.737 N/A TYR 330.A N LYS 326.A O no hydrogen 2.888 N/A ASP 331.A N SER 327.A O no hydrogen 2.953 N/A GLU 332.A N LEU 328.A O no hydrogen 3.239 N/A VAL 333.A N THR 329.A O no hydrogen 2.887 N/A ILE 334.A N TYR 330.A O no hydrogen 2.965 N/A SER 335.A N ASP 331.A O no hydrogen 3.115 N/A SER 335.A OG ASP 331.A O no hydrogen 3.097 N/A SER 335.A OG GLU 332.A O no hydrogen 3.530 N/A PHE 336.A N VAL 333.A O no hydrogen 3.242 N/A