Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6e99_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N PHE 1.A O no hydrogen 3.058 N/A LYS 6.A N LEU 2.A O no hydrogen 3.096 N/A LYS 6.A NZ SER 142.A O no hydrogen 2.944 N/A LYS 6.A NZ ASP 144.A OD2 no hydrogen 2.976 N/A GLU 7.A N ALA 3.A O no hydrogen 3.385 N/A ASP 8.A N LYS 4.A O no hydrogen 3.308 N/A PHE 9.A N ALA 5.A O no hydrogen 3.056 N/A LEU 10.A N LYS 6.A O no hydrogen 2.950 N/A LYS 11.A N GLU 7.A O no hydrogen 3.394 N/A TRP 13.A N PHE 9.A O no hydrogen 2.839 N/A GLU 14.A N LEU 10.A O no hydrogen 3.026 N/A ASN 15.A N LYS 11.A O no hydrogen 3.300 N/A ALA 17.A N GLN 79.A OE1 no hydrogen 3.081 N/A GLN 18.A NE2 SER 329.A O no hydrogen 3.470 N/A GLN 18.A NE2 PHE 331.A O no hydrogen 2.991 N/A THR 20.A N SER 92.A O no hydrogen 2.984 N/A THR 20.A OG1 SER 92.A O no hydrogen 3.536 N/A HIS 22.A N GLN 25.A OE1 no hydrogen 3.100 N/A GLN 25.A N HIS 22.A O no hydrogen 3.156 N/A PHE 26.A N LEU 23.A O no hydrogen 3.238 N/A GLU 27.A N LYS 44.A O no hydrogen 2.880 N/A ILE 29.A N LEU 42.A O no hydrogen 2.945 N/A LYS 30.A NZ ASP 311.A OD1 no hydrogen 2.870 N/A THR 31.A N GLU 314.A OE2 no hydrogen 3.031 N/A THR 31.A OG1 GLU 314.A OE1 no hydrogen 3.068 N/A LEU 32.A N VAL 40.A O no hydrogen 2.777 N/A GLY 33.A N VAL 40.A O no hydrogen 3.375 N/A GLY 35.A N GLY 38.A O no hydrogen 3.115 N/A GLY 38.A N GLY 35.A O no hydrogen 3.501 N/A ARG 39.A N ILE 56.A O no hydrogen 3.303 N/A ARG 39.A NE THR 31.A OG1 no hydrogen 3.215 N/A ARG 39.A NH2 THR 31.A OG1 no hydrogen 3.231 N/A ARG 39.A NH2 GLU 313.A O no hydrogen 2.771 N/A VAL 40.A N GLY 33.A O no hydrogen 2.927 N/A MET 41.A N MET 54.A O no hydrogen 2.882 N/A LEU 42.A N LYS 30.A O no hydrogen 2.775 N/A VAL 43.A N TYR 52.A O no hydrogen 2.885 N/A LYS 44.A N GLU 27.A O no hydrogen 2.981 N/A HIS 45.A N ASN 50.A O no hydrogen 2.767 N/A MET 46.A N GLN 25.A O no hydrogen 3.235 N/A THR 48.A N HIS 45.A O no hydrogen 3.311 N/A THR 48.A OG1 HIS 45.A O no hydrogen 3.551 N/A GLY 49.A N HIS 45.A O no hydrogen 2.795 N/A ASN 50.A N THR 48.A OG1 no hydrogen 3.309 N/A TYR 52.A N VAL 43.A O no hydrogen 2.950 N/A ALA 53.A N MET 103.A O no hydrogen 3.004 N/A MET 54.A N MET 41.A O no hydrogen 2.789 N/A LYS 55.A N MET 101.A O no hydrogen 2.872 N/A LYS 55.A NZ GLU 74.A OE1 no hydrogen 3.531 N/A LYS 55.A NZ GLU 74.A OE2 no hydrogen 2.774 N/A ILE 56.A N ARG 39.A O no hydrogen 2.886 N/A LEU 57.A N LEU 99.A O no hydrogen 2.948 N/A ASP 58.A N PHE 37.A O no hydrogen 2.966 N/A LYS 59.A N SER 97.A O no hydrogen 3.129 N/A LYS 59.A NZ ASP 95.A O no hydrogen 2.809 N/A LYS 59.A NZ ASN 96.A O no hydrogen 3.188 N/A LYS 59.A NZ LYS 323.A O no hydrogen 2.798 N/A LYS 61.A N ASP 58.A OD1 no hydrogen 3.341 N/A VAL 62.A N ASP 58.A O no hydrogen 3.234 N/A VAL 63.A N LYS 59.A O no hydrogen 3.217 N/A LYS 64.A N GLN 60.A O no hydrogen 3.134 N/A LEU 65.A N LYS 61.A O no hydrogen 3.260 N/A LYS 66.A N VAL 63.A O no hydrogen 3.007 N/A GLN 67.A N VAL 62.A O no hydrogen 2.962 N/A HIS 70.A ND1 GLN 67.A OE1 no hydrogen 2.799 N/A THR 71.A N GLN 67.A O no hydrogen 3.111 N/A THR 71.A OG1 GLN 67.A O no hydrogen 2.955 N/A LEU 72.A N ILE 68.A O no hydrogen 3.101 N/A ASN 73.A N GLU 69.A O no hydrogen 2.971 N/A GLU 74.A N HIS 70.A O no hydrogen 3.021 N/A LYS 75.A N THR 71.A O no hydrogen 3.372 N/A LYS 75.A NZ ALA 17.A O no hydrogen 2.868 N/A ARG 76.A N LEU 72.A O no hydrogen 3.065 N/A ARG 76.A NE TRP 13.A O no hydrogen 3.075 N/A ARG 76.A NH2 TRP 13.A O no hydrogen 3.028 N/A ILE 77.A N ASN 73.A O no hydrogen 3.018 N/A LEU 78.A N GLU 74.A O no hydrogen 3.100 N/A GLN 79.A N LYS 75.A O no hydrogen 3.160 N/A GLN 79.A NE2 LYS 12.A O no hydrogen 3.061 N/A GLN 79.A NE2 ARG 76.A O no hydrogen 2.978 N/A ALA 80.A N ILE 77.A O no hydrogen 3.053 N/A VAL 81.A N ILE 77.A O no hydrogen 3.179 N/A ASN 82.A N TYR 139.A OH no hydrogen 2.997 N/A LEU 86.A N PHE 83.A O no hydrogen 3.286 N/A VAL 87.A N VAL 165.A O no hydrogen 3.099 N/A GLU 90.A N VAL 102.A O no hydrogen 2.785 N/A PHE 91.A N VAL 102.A O no hydrogen 3.112 N/A SER 92.A N THR 20.A OG1 no hydrogen 3.212 N/A PHE 93.A N TYR 100.A O no hydrogen 3.200 N/A LYS 94.A NZ PHE 328.A O no hydrogen 2.851 N/A LYS 94.A NZ PHE 331.A O no hydrogen 3.002 N/A ASP 95.A N ASN 98.A O no hydrogen 3.075 N/A SER 97.A N ASP 95.A OD1 no hydrogen 3.171 N/A ASN 98.A N ASP 95.A OD1 no hydrogen 2.868 N/A ASN 98.A ND2 TYR 100.A OH no hydrogen 3.165 N/A ASN 98.A ND2 ARG 318.A O no hydrogen 3.606 N/A LEU 99.A N LEU 57.A O no hydrogen 2.917 N/A TYR 100.A N PHE 93.A O no hydrogen 2.881 N/A TYR 100.A OH ASP 95.A OD2 no hydrogen 2.716 N/A MET 101.A N LYS 55.A O no hydrogen 3.071 N/A VAL 102.A N PHE 91.A O no hydrogen 2.805 N/A MET 103.A N ALA 53.A O no hydrogen 2.870 N/A GLU 104.A N LYS 88.A O no hydrogen 3.069 N/A TYR 105.A OH ASP 305.A O no hydrogen 2.712 N/A MET 111.A N LEU 155.A O no hydrogen 2.778 N/A PHE 112.A N PRO 152.A O no hydrogen 3.242 N/A SER 113.A N GLU 110.A O no hydrogen 3.222 N/A LEU 115.A N MET 111.A O no hydrogen 2.914 N/A ARG 116.A N PHE 112.A O no hydrogen 3.075 N/A ARG 116.A NH1 GLU 212.A OE2 no hydrogen 2.988 N/A ARG 116.A NH2 GLU 212.A OE2 no hydrogen 2.832 N/A ARG 117.A N SER 113.A O no hydrogen 3.188 N/A ILE 118.A N HIS 114.A O no hydrogen 3.064 N/A GLY 119.A N LEU 115.A O no hydrogen 2.994 N/A PHE 121.A N MET 213.A O no hydrogen 2.846 N/A HIS 125.A N SER 122.A OG no hydrogen 3.369 N/A HIS 125.A NE2 TYR 129.A OH no hydrogen 3.116 N/A ALA 126.A N SER 122.A O no hydrogen 2.876 N/A ARG 127.A N GLU 123.A O no hydrogen 2.891 N/A ARG 127.A NE TRP 278.A O no hydrogen 2.781 N/A PHE 128.A N PRO 124.A O no hydrogen 3.231 N/A TYR 129.A N HIS 125.A O no hydrogen 3.512 N/A TYR 129.A OH HIS 125.A NE2 no hydrogen 3.116 N/A ALA 130.A N ALA 126.A O no hydrogen 2.995 N/A ALA 131.A N ARG 127.A O no hydrogen 2.988 N/A GLN 132.A NE2 PHE 128.A O no hydrogen 3.168 N/A ILE 133.A N TYR 129.A O no hydrogen 3.340 N/A VAL 134.A N ALA 130.A O no hydrogen 3.014 N/A LEU 135.A N ALA 131.A O no hydrogen 3.233 N/A THR 136.A N GLN 132.A O no hydrogen 3.082 N/A THR 136.A OG1 GLN 132.A O no hydrogen 2.704 N/A PHE 137.A N ILE 133.A O no hydrogen 2.875 N/A GLU 138.A N VAL 134.A O no hydrogen 2.991 N/A TYR 139.A N LEU 135.A O no hydrogen 3.039 N/A LEU 140.A N THR 136.A O no hydrogen 2.899 N/A HIS 141.A N PHE 137.A O no hydrogen 2.893 N/A HIS 141.A ND1 LEU 145.A O no hydrogen 3.195 N/A SER 142.A N GLU 138.A O no hydrogen 3.292 N/A SER 142.A OG TYR 139.A O no hydrogen 2.728 N/A LEU 143.A N LEU 140.A O no hydrogen 3.072 N/A ASP 144.A N HIS 141.A O no hydrogen 3.057 N/A LEU 145.A N LEU 140.A O no hydrogen 3.155 N/A ILE 146.A N LYS 172.A O no hydrogen 3.028 N/A TYR 147.A N ASP 202.A OD2 no hydrogen 2.959 N/A TYR 147.A OH THR 166.A O no hydrogen 2.695 N/A TYR 147.A OH ASP 167.A O no hydrogen 3.420 N/A ARG 148.A N ASP 202.A OD1 no hydrogen 2.984 N/A ARG 148.A NE PHE 170.A O no hydrogen 2.838 N/A ARG 148.A NH1 TYR 197.A OH no hydrogen 2.941 N/A ARG 148.A NH2 PHE 170.A O no hydrogen 3.031 N/A LYS 151.A NZ THR 183.A OG1 no hydrogen 2.884 N/A GLU 153.A N GLU 153.A OE1 no hydrogen 2.839 N/A ASN 154.A N LYS 151.A O no hydrogen 3.104 N/A ASN 154.A ND2 ASP 149.A O no hydrogen 2.841 N/A ASN 154.A ND2 ASP 149.A OD2 no hydrogen 3.210 N/A LEU 155.A N PRO 152.A O no hydrogen 3.354 N/A LEU 156.A N GLN 164.A O no hydrogen 3.043 N/A ILE 157.A N GLY 109.A O no hydrogen 3.013 N/A ASP 158.A N TYR 162.A O no hydrogen 2.915 N/A GLN 159.A NE2 PRO 298.A O no hydrogen 3.310 N/A GLN 160.A N ASP 158.A OD1 no hydrogen 2.969 N/A GLY 161.A N ASP 158.A O no hydrogen 2.992 N/A TYR 162.A N ASP 158.A OD1 no hydrogen 2.981 N/A TYR 162.A OH VAL 292.A O no hydrogen 2.662 N/A ILE 163.A N GLN 132.A OE1 no hydrogen 2.818 N/A GLN 164.A N LEU 156.A O no hydrogen 2.869 N/A VAL 165.A N PHE 85.A O no hydrogen 2.848 N/A THR 166.A N ASN 154.A O no hydrogen 2.961 N/A GLY 169.A N ASP 167.A OD1 no hydrogen 3.101 N/A ALA 171.A N PHE 168.A O no hydrogen 3.035 N/A LYS 172.A N ILE 146.A O no hydrogen 3.187 N/A ARG 173.A NE LEU 143.A O no hydrogen 3.013 N/A ARG 173.A NH2 ASP 144.A OD2 no hydrogen 3.292 N/A VAL 174.A N ASP 144.A O no hydrogen 2.951 N/A THR 178.A N TYR 197.A O no hydrogen 2.994 N/A THR 183.A OG1 ASP 149.A OD1 no hydrogen 3.121 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.788 N/A TYR 186.A N THR 183.A O no hydrogen 2.978 N/A TYR 186.A OH GLU 212.A OE1 no hydrogen 2.772 N/A LEU 187.A N PRO 184.A O no hydrogen 3.361 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.827 N/A ILE 191.A N ALA 188.A O no hydrogen 3.067 N/A LEU 193.A N PRO 189.A O no hydrogen 3.074 N/A SER 194.A N ILE 191.A O no hydrogen 3.385 N/A LYS 195.A N GLU 190.A O no hydrogen 3.242 N/A TYR 197.A N THR 178.A O no hydrogen 2.980 N/A LYS 199.A NZ VAL 174.A O no hydrogen 2.805 N/A ALA 200.A N ASN 198.A OD1 no hydrogen 3.207 N/A VAL 201.A N ASN 198.A O no hydrogen 3.295 N/A ASP 202.A N LYS 199.A O no hydrogen 3.125 N/A TRP 204.A N ALA 200.A O no hydrogen 3.182 N/A ALA 205.A N VAL 201.A O no hydrogen 3.190 N/A LEU 206.A N ASP 202.A O no hydrogen 3.095 N/A GLY 207.A N TRP 203.A O no hydrogen 3.333 N/A VAL 208.A N TRP 204.A O no hydrogen 3.203 N/A LEU 209.A N ALA 205.A O no hydrogen 2.946 N/A ILE 210.A N LEU 206.A O no hydrogen 2.916 N/A TYR 211.A N GLY 207.A O no hydrogen 3.106 N/A TYR 211.A OH ARG 238.A O no hydrogen 2.695 N/A GLU 212.A N VAL 208.A O no hydrogen 3.021 N/A MET 213.A N LEU 209.A O no hydrogen 2.932 N/A ALA 214.A N ILE 210.A O no hydrogen 3.090 N/A ALA 215.A N TYR 211.A O no hydrogen 2.808 N/A GLY 216.A N GLU 212.A O no hydrogen 2.877 N/A GLN 224.A N GLN 227.A OE1 no hydrogen 3.171 N/A GLN 227.A N GLN 224.A O no hydrogen 3.170 N/A ILE 228.A N GLN 224.A O no hydrogen 3.445 N/A TYR 229.A N PRO 225.A O no hydrogen 3.057 N/A GLU 230.A N ILE 226.A O no hydrogen 3.277 N/A LYS 231.A N GLN 227.A O no hydrogen 3.400 N/A ILE 232.A N ILE 228.A O no hydrogen 3.092 N/A VAL 233.A N TYR 229.A O no hydrogen 3.133 N/A SER 234.A N GLU 230.A O no hydrogen 3.358 N/A SER 234.A OG LYS 231.A O no hydrogen 2.799 N/A PHE 243.A N PRO 240.A O no hydrogen 3.055 N/A SER 244.A N GLU 123.A OE2 no hydrogen 2.864 N/A SER 244.A OG GLU 123.A OE1 no hydrogen 2.819 N/A SER 244.A OG GLU 123.A OE2 no hydrogen 3.532 N/A LEU 247.A N SER 244.A OG no hydrogen 3.203 N/A LYS 248.A N SER 244.A O no hydrogen 3.191 N/A ASP 249.A N SER 245.A O no hydrogen 3.250 N/A LEU 250.A N ASP 246.A O no hydrogen 3.276 N/A LEU 251.A N LEU 247.A O no hydrogen 3.077 N/A ARG 252.A N LYS 248.A O no hydrogen 3.048 N/A ASN 253.A N ASP 249.A O no hydrogen 3.268 N/A LEU 254.A N LEU 250.A O no hydrogen 3.004 N/A LEU 255.A N LEU 251.A O no hydrogen 2.817 N/A ASP 258.A N GLN 256.A OE1 no hydrogen 3.134 N/A THR 260.A N ASP 258.A OD1 no hydrogen 3.414 N/A THR 260.A OG1 ASP 258.A OD1 no hydrogen 2.787 N/A THR 260.A OG1 ASP 258.A OD2 no hydrogen 2.966 N/A LYS 261.A N ASP 258.A O no hydrogen 3.027 N/A ARG 262.A N ASP 258.A O no hydrogen 3.100 N/A ARG 262.A NE GLN 256.A O no hydrogen 2.783 N/A ARG 262.A NH1 GLU 190.A OE2 no hydrogen 2.815 N/A ARG 262.A NH1 ALA 200.A O no hydrogen 3.128 N/A ARG 262.A NH2 GLU 190.A OE1 no hydrogen 3.003 N/A ARG 262.A NH2 GLU 190.A OE2 no hydrogen 3.525 N/A ARG 262.A NH2 GLN 256.A O no hydrogen 3.061 N/A PHE 263.A N ASN 253.A O no hydrogen 2.970 N/A ASN 265.A N ARG 262.A O no hydrogen 3.122 N/A ASN 265.A ND2 LEU 259.A O no hydrogen 2.984 N/A GLY 269.A N LEU 266.A O no hydrogen 3.045 N/A ASN 271.A N ASN 268.A O no hydrogen 3.244 N/A ASN 271.A ND2 ASN 268.A O no hydrogen 3.187 N/A ASP 272.A N GLY 269.A O no hydrogen 3.430 N/A ILE 273.A N VAL 270.A O no hydrogen 3.064 N/A LYS 274.A N VAL 270.A O no hydrogen 3.133 N/A LYS 274.A NZ GLU 138.A OE1 no hydrogen 2.956 N/A ASN 275.A N ASN 271.A O no hydrogen 2.967 N/A HIS 276.A N ILE 273.A O no hydrogen 3.185 N/A HIS 276.A NE2 ASP 249.A OD2 no hydrogen 2.817 N/A TRP 278.A N HIS 276.A ND1 no hydrogen 3.133 N/A TRP 278.A NE1 GLU 123.A OE1 no hydrogen 2.926 N/A PHE 279.A N HIS 276.A O no hydrogen 3.019 N/A ALA 280.A N LYS 277.A O no hydrogen 3.303 N/A THR 282.A N PHE 279.A O no hydrogen 3.062 N/A THR 282.A OG1 PHE 279.A O no hydrogen 3.475 N/A ALA 286.A N ASP 283.A OD1 no hydrogen 3.235 N/A ILE 287.A N ASP 283.A O no hydrogen 3.180 N/A TYR 288.A N TRP 284.A O no hydrogen 3.329 N/A GLN 289.A N ILE 285.A O no hydrogen 3.068 N/A GLN 289.A NE2 ILE 285.A O no hydrogen 3.584 N/A ARG 290.A N ILE 287.A O no hydrogen 3.004 N/A LYS 291.A N ALA 286.A O no hydrogen 2.891 N/A SER 307.A N ASP 305.A OD2 no hydrogen 3.330 N/A SER 307.A OG ASP 305.A OD2 no hydrogen 2.731 N/A ASN 308.A ND2 PRO 107.A O no hydrogen 3.023 N/A ASN 308.A ND2 LYS 299.A O no hydrogen 3.696 N/A PHE 309.A N THR 306.A O no hydrogen 3.112 N/A LYS 323.A N ASN 96.A O no hydrogen 2.875 N/A GLU 327.A N GLU 327.A OE1 no hydrogen 2.797 N/A PHE 328.A N CYS 324.A O no hydrogen 3.369 N/A SER 329.A N LYS 326.A O no hydrogen 3.331 N/A PHE 331.A N PHE 328.A O no hydrogen 3.127 N/A