Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3aht_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 1.A NE1 ASP 467.A OD1 no hydrogen 3.120 N/A LEU 5.A N LEU 2.A O no hydrogen 2.923 N/A ARG 7.A NE LEU 469.A O no hydrogen 2.716 N/A ARG 7.A NH1 ASP 78.A OD2 no hydrogen 2.791 N/A ARG 7.A NH2 ASN 76.A O no hydrogen 2.552 N/A ARG 7.A NH2 ASP 78.A OD2 no hydrogen 3.434 N/A ARG 7.A NH2 LEU 469.A O no hydrogen 3.561 N/A ALA 8.A N SER 6.A OG no hydrogen 3.243 N/A ALA 9.A N SER 6.A O no hydrogen 2.823 N/A PHE 10.A N ARG 7.A O no hydrogen 3.143 N/A PHE 14.A N PRO 11.A O no hydrogen 3.087 N/A VAL 15.A N ALA 423.A O no hydrogen 3.208 N/A PHE 16.A N ASP 78.A OD2 no hydrogen 2.952 N/A GLY 17.A N TYR 425.A O no hydrogen 2.870 N/A VAL 19.A N ALA 427.A O no hydrogen 3.094 N/A THR 20.A N ARG 81.A O no hydrogen 2.887 N/A THR 20.A OG1 TYR 80.A OH no hydrogen 2.518 N/A SER 21.A OG GLN 24.A OE1 no hydrogen 2.574 N/A ALA 22.A N SER 83.A OG no hydrogen 2.532 N/A GLN 24.A NE2 PHE 434.A O no hydrogen 2.751 N/A VAL 25.A N SER 21.A O no hydrogen 3.200 N/A VAL 25.A N ALA 22.A O no hydrogen 3.139 N/A GLU 26.A N ALA 22.A O no hydrogen 2.885 N/A ALA 29.A N ASP 56.A O no hydrogen 3.299 N/A SER 31.A N MET 28.A O no hydrogen 3.361 N/A ARG 34.A N SER 31.A O no hydrogen 2.872 N/A ARG 34.A NE SER 85.A OG no hydrogen 3.023 N/A ARG 34.A NH1 ALA 29.A O no hydrogen 2.932 N/A ARG 34.A NH1 ASP 40.A OD1 no hydrogen 3.305 N/A ARG 34.A NH1 ASP 40.A OD2 no hydrogen 3.178 N/A ARG 34.A NH2 ASP 40.A OD1 no hydrogen 3.437 N/A GLY 35.A N SER 87.A O no hydrogen 3.044 N/A SER 37.A N ASP 40.A OD1 no hydrogen 2.830 N/A SER 37.A OG ASP 40.A OD1 no hydrogen 2.640 N/A ILE 38.A N LEU 128.A O no hydrogen 2.903 N/A TRP 39.A N SER 37.A OG no hydrogen 3.204 N/A ASP 40.A N SER 37.A O no hydrogen 3.006 N/A ALA 41.A N SER 37.A O no hydrogen 3.404 N/A PHE 42.A N ILE 38.A O no hydrogen 2.966 N/A ALA 43.A N TRP 39.A O no hydrogen 2.797 N/A HIS 44.A N ASP 40.A O no hydrogen 3.020 N/A HIS 44.A N ALA 41.A O no hydrogen 3.083 N/A HIS 44.A NE2 ASP 56.A OD1 no hydrogen 3.032 N/A THR 45.A N PHE 42.A O no hydrogen 3.058 N/A THR 45.A OG1 ALA 41.A O no hydrogen 3.128 N/A GLY 47.A N ASN 52.A OD1 no hydrogen 2.983 N/A ASN 48.A N THR 45.A O no hydrogen 3.063 N/A ASN 48.A ND2 PHE 42.A O no hydrogen 2.728 N/A ALA 50.A N LEU 437.A O no hydrogen 3.063 N/A ASN 52.A N VAL 49.A O no hydrogen 2.931 N/A GLN 53.A N ALA 50.A O no hydrogen 3.015 N/A GLY 55.A N TYR 23.A OH no hydrogen 2.836 N/A ASP 56.A N ASN 54.A OD1 no hydrogen 2.842 N/A THR 59.A OG1 VAL 25.A O no hydrogen 2.870 N/A ASP 60.A N VAL 57.A O no hydrogen 2.807 N/A GLN 61.A N VAL 25.A O no hydrogen 3.158 N/A GLN 61.A NE2 ASP 68.A OD2 no hydrogen 2.399 N/A TYR 62.A N GLU 26.A O no hydrogen 3.067 N/A HIS 63.A N ASP 60.A O no hydrogen 3.050 N/A ARG 64.A N ASP 60.A O no hydrogen 3.285 N/A ARG 64.A N GLN 61.A O no hydrogen 2.872 N/A ARG 64.A NE GLU 67.A OE1 no hydrogen 3.152 N/A ARG 64.A NH2 GLU 67.A OE1 no hydrogen 3.162 N/A ASP 68.A N ARG 64.A O no hydrogen 3.113 N/A VAL 69.A N TYR 65.A O no hydrogen 2.807 N/A ASN 70.A N LYS 66.A O no hydrogen 3.044 N/A LEU 71.A N GLU 67.A O no hydrogen 2.971 N/A MET 72.A N ASP 68.A O no hydrogen 3.028 N/A LYS 73.A N VAL 69.A O no hydrogen 2.963 N/A LYS 73.A NZ LYS 115.A O no hydrogen 3.024 N/A SER 74.A N ASN 70.A O no hydrogen 3.005 N/A SER 74.A OG ASN 70.A O no hydrogen 3.346 N/A SER 74.A OG LEU 71.A O no hydrogen 2.801 N/A LEU 75.A N MET 72.A O no hydrogen 3.117 N/A ASN 76.A N LYS 73.A O no hydrogen 2.942 N/A ASN 76.A ND2 ARG 466.A O no hydrogen 2.868 N/A PHE 77.A N MET 72.A O no hydrogen 3.399 N/A ASP 78.A N PHE 16.A O no hydrogen 2.943 N/A ALA 79.A N PHE 16.A O no hydrogen 3.209 N/A TYR 80.A N THR 118.A O no hydrogen 3.039 N/A TYR 80.A OH GLN 61.A OE1 no hydrogen 2.892 N/A ARG 81.A N THR 18.A O no hydrogen 2.903 N/A ARG 81.A NE ASN 122.A OD1 no hydrogen 2.962 N/A ARG 81.A NH1 GLU 381.A OE2 no hydrogen 3.377 N/A ARG 81.A NH2 ASN 122.A OD1 no hydrogen 2.808 N/A ARG 81.A NH2 ASN 170.A OD1 no hydrogen 2.844 N/A PHE 82.A N TYR 120.A O no hydrogen 3.216 N/A ILE 84.A N ASN 122.A O no hydrogen 2.913 N/A SER 85.A N TYR 105.A OH no hydrogen 2.901 N/A TRP 86.A NE1 GLY 93.A O no hydrogen 3.143 N/A SER 87.A OG GLY 35.A O no hydrogen 2.822 N/A ARG 88.A N SER 85.A O no hydrogen 2.926 N/A ARG 88.A NE GLU 26.A OE1 no hydrogen 2.815 N/A ARG 88.A NH2 GLU 26.A OE1 no hydrogen 3.112 N/A ARG 88.A NH2 MET 28.A O no hydrogen 3.188 N/A ILE 89.A N SER 85.A O no hydrogen 3.179 N/A ILE 89.A N TRP 86.A O no hydrogen 3.058 N/A PHE 90.A N TRP 86.A O no hydrogen 2.724 N/A GLY 93.A N PHE 90.A O no hydrogen 2.554 N/A ASN 98.A N ILE 89.A O no hydrogen 2.884 N/A ASN 98.A ND2 GLY 32.A O no hydrogen 2.733 N/A ASN 98.A ND2 ARG 88.A O no hydrogen 2.996 N/A VAL 102.A N ASN 98.A O no hydrogen 3.156 N/A ALA 103.A N GLN 99.A O no hydrogen 2.893 N/A TYR 104.A N GLU 100.A O no hydrogen 3.061 N/A TYR 105.A N GLY 101.A O no hydrogen 3.312 N/A TYR 105.A OH GLU 26.A OE2 no hydrogen 2.620 N/A ASN 106.A N VAL 102.A O no hydrogen 2.915 N/A ASN 107.A N ALA 103.A O no hydrogen 2.875 N/A LEU 108.A N TYR 104.A O no hydrogen 2.904 N/A ILE 109.A N TYR 105.A O no hydrogen 2.949 N/A ASN 110.A N ASN 106.A O no hydrogen 2.945 N/A TYR 111.A N ASN 107.A O no hydrogen 3.019 N/A TYR 111.A OH ASN 70.A OD1 no hydrogen 2.651 N/A LEU 112.A N LEU 108.A O no hydrogen 2.958 N/A LEU 113.A N ILE 109.A O no hydrogen 3.020 N/A GLN 114.A N ASN 110.A O no hydrogen 2.837 N/A LYS 115.A N TYR 111.A O no hydrogen 3.050 N/A LYS 115.A N LEU 112.A O no hydrogen 3.100 N/A GLY 116.A N LEU 113.A O no hydrogen 3.105 N/A ILE 117.A N LEU 112.A O no hydrogen 2.857 N/A THR 118.A N ASP 78.A O no hydrogen 2.957 N/A THR 118.A OG1 ASP 78.A O no hydrogen 3.461 N/A TYR 120.A N TYR 80.A O no hydrogen 2.995 N/A VAL 121.A N HIS 165.A O no hydrogen 2.915 N/A ASN 122.A N PHE 82.A O no hydrogen 2.916 N/A ASN 122.A ND2 TYR 124.A O no hydrogen 3.248 N/A LEU 123.A N PHE 167.A O no hydrogen 2.916 N/A HIS 125.A N ASP 127.A OD1 no hydrogen 3.346 N/A LEU 128.A N TYR 126.A O no hydrogen 3.133 N/A LEU 130.A N PRO 36.A O no hydrogen 2.854 N/A LEU 132.A N PRO 129.A O no hydrogen 2.998 N/A GLU 133.A N PRO 129.A O no hydrogen 3.323 N/A LYS 134.A N LEU 130.A O no hydrogen 3.016 N/A LYS 135.A N ALA 131.A O no hydrogen 3.019 N/A LYS 135.A NZ GLU 94.A OE1 no hydrogen 3.069 N/A LYS 135.A NZ TYR 136.A OH no hydrogen 3.336 N/A TYR 136.A N LEU 132.A O no hydrogen 2.983 N/A TYR 136.A OH GLU 94.A OE1 no hydrogen 3.099 N/A TYR 136.A OH GLU 94.A OE2 no hydrogen 2.827 N/A GLY 137.A N GLU 133.A O no hydrogen 3.113 N/A TRP 139.A NE1 TYR 124.A OH no hydrogen 3.009 N/A LEU 140.A N GLY 137.A O no hydrogen 3.384 N/A ASN 141.A N GLY 138.A O no hydrogen 2.997 N/A ASN 141.A ND2 TYR 136.A O no hydrogen 3.009 N/A LYS 143.A N ASN 141.A OD1 no hydrogen 2.606 N/A LYS 143.A NZ ASP 146.A OD1 no hydrogen 2.735 N/A MET 144.A N ASN 141.A O no hydrogen 2.967 N/A ALA 145.A N ALA 142.A O no hydrogen 3.290 N/A LEU 147.A N LYS 143.A O no hydrogen 3.256 N/A PHE 148.A N MET 144.A O no hydrogen 2.725 N/A THR 149.A N ALA 145.A O no hydrogen 2.770 N/A THR 149.A OG1 ALA 145.A O no hydrogen 2.628 N/A GLU 150.A N ASP 146.A O no hydrogen 2.892 N/A TYR 151.A N LEU 147.A O no hydrogen 3.163 N/A TYR 151.A OH LEU 123.A O no hydrogen 2.666 N/A ALA 152.A N PHE 148.A O no hydrogen 2.792 N/A ASP 153.A N THR 149.A O no hydrogen 2.743 N/A PHE 154.A N GLU 150.A O no hydrogen 3.083 N/A CYS 155.A N TYR 151.A O no hydrogen 3.291 N/A CYS 155.A SG TYR 151.A O no hydrogen 3.588 N/A PHE 156.A N ALA 152.A O no hydrogen 2.889 N/A LYS 157.A N ASP 153.A O no hydrogen 2.888 N/A THR 158.A N PHE 154.A O no hydrogen 2.757 N/A THR 158.A OG1 PHE 154.A O no hydrogen 2.501 N/A PHE 159.A N CYS 155.A O no hydrogen 2.812 N/A GLY 160.A N PHE 156.A O no hydrogen 2.895 N/A ARG 162.A N PHE 159.A O no hydrogen 2.938 N/A ARG 162.A NH1 ASN 106.A OD1 no hydrogen 3.336 N/A ARG 162.A NH1 ASN 110.A OD1 no hydrogen 2.722 N/A ARG 162.A NH2 ASN 106.A OD1 no hydrogen 2.870 N/A ARG 162.A NH2 THR 158.A O no hydrogen 3.192 N/A VAL 163.A N PHE 159.A O no hydrogen 2.760 N/A LYS 164.A NZ GLY 160.A O no hydrogen 2.867 N/A LYS 164.A NZ GLN 229.A O no hydrogen 2.697 N/A TRP 166.A N LYS 232.A O no hydrogen 2.914 N/A PHE 167.A N VAL 121.A O no hydrogen 2.748 N/A THR 168.A N GLY 234.A O no hydrogen 3.078 N/A THR 168.A OG1 HIS 214.A ND1 no hydrogen 2.717 N/A THR 168.A OG1 GLY 234.A O no hydrogen 3.523 N/A GLN 171.A N VAL 236.A O no hydrogen 2.723 N/A ARG 173.A NE ASP 238.A OD2 no hydrogen 3.080 N/A ARG 173.A NH1 TYR 328.A OH no hydrogen 3.105 N/A ILE 174.A N GLN 171.A O no hydrogen 3.077 N/A ALA 176.A N PRO 172.A O no hydrogen 3.189 N/A LEU 177.A N ARG 173.A O no hydrogen 2.771 N/A LEU 178.A N ILE 174.A O no hydrogen 2.811 N/A GLY 179.A N VAL 175.A O no hydrogen 2.773 N/A TYR 180.A N ALA 176.A O no hydrogen 2.999 N/A ASP 181.A N LEU 177.A O no hydrogen 2.921 N/A GLN 182.A N LEU 177.A O no hydrogen 2.822 N/A ASN 185.A N LEU 178.A O no hydrogen 2.719 N/A LYS 188.A N ASN 185.A O no hydrogen 2.552 N/A LYS 188.A NZ ASN 48.A OD1 no hydrogen 3.522 N/A ARG 189.A N GLY 179.A O no hydrogen 2.940 N/A ARG 189.A NE GLU 202.A OE1 no hydrogen 3.053 N/A ARG 189.A NE GLU 202.A OE2 no hydrogen 3.339 N/A ARG 189.A NH2 GLU 202.A OE2 no hydrogen 2.560 N/A CYS 190.A N GLY 196.A O no hydrogen 3.198 N/A THR 191.A N SER 199.A OG no hydrogen 3.021 N/A THR 191.A OG1 SER 199.A OG no hydrogen 3.331 N/A CYS 193.A N CYS 190.A O no hydrogen 3.156 N/A CYS 193.A SG LYS 188.A O no hydrogen 3.945 N/A GLY 196.A N CYS 193.A O no hydrogen 3.110 N/A SER 199.A N THR 191.A OG1 no hydrogen 3.016 N/A SER 199.A OG ASP 181.A O no hydrogen 2.865 N/A SER 199.A OG THR 191.A OG1 no hydrogen 3.331 N/A ALA 200.A N ASN 198.A OD1 no hydrogen 3.057 N/A THR 201.A N ASN 198.A O no hydrogen 3.111 N/A THR 201.A OG1 ASN 198.A O no hydrogen 3.519 N/A GLU 202.A N ASN 198.A O no hydrogen 2.917 N/A TYR 204.A N THR 201.A O no hydrogen 3.217 N/A TYR 204.A OH ASP 331.A OD2 no hydrogen 2.718 N/A ILE 205.A N THR 201.A O no hydrogen 3.251 N/A VAL 206.A N GLU 202.A O no hydrogen 2.875 N/A ALA 207.A N PRO 203.A O no hydrogen 3.202 N/A HIS 208.A N TYR 204.A O no hydrogen 3.094 N/A HIS 208.A ND1 TYR 275.A OH no hydrogen 2.526 N/A ASN 209.A N ILE 205.A O no hydrogen 3.164 N/A ASN 209.A ND2 TRP 139.A O no hydrogen 2.904 N/A PHE 210.A N VAL 206.A O no hydrogen 2.987 N/A LEU 211.A N ALA 207.A O no hydrogen 2.992 N/A LEU 212.A N HIS 208.A O no hydrogen 2.880 N/A SER 213.A N ASN 209.A O no hydrogen 2.717 N/A SER 213.A OG ASN 209.A O no hydrogen 2.893 N/A HIS 214.A N PHE 210.A O no hydrogen 2.808 N/A HIS 214.A ND1 THR 168.A OG1 no hydrogen 2.717 N/A HIS 214.A NE2 SER 301.A O no hydrogen 2.832 N/A ALA 215.A N LEU 211.A O no hydrogen 2.952 N/A ALA 216.A N LEU 212.A O no hydrogen 2.929 N/A ALA 217.A N SER 213.A O no hydrogen 3.095 N/A VAL 218.A N HIS 214.A O no hydrogen 2.988 N/A ALA 219.A N ALA 215.A O no hydrogen 2.836 N/A ARG 220.A N ALA 216.A O no hydrogen 2.960 N/A ARG 220.A NH1 ASP 153.A OD2 no hydrogen 2.990 N/A TYR 221.A N ALA 217.A O no hydrogen 2.985 N/A ARG 222.A N VAL 218.A O no hydrogen 2.836 N/A ARG 222.A NH2 GLY 300.A O no hydrogen 2.903 N/A ARG 222.A NH2 ASP 303.A OD1 no hydrogen 3.465 N/A THR 223.A N ALA 219.A O no hydrogen 3.014 N/A THR 223.A OG1 ALA 219.A O no hydrogen 2.803 N/A THR 223.A OG1 ARG 220.A O no hydrogen 3.393 N/A LYS 224.A N ARG 220.A O no hydrogen 2.930 N/A LYS 224.A NZ ASP 153.A OD2 no hydrogen 3.173 N/A LYS 224.A NZ TYR 225.A OH no hydrogen 3.045 N/A TYR 225.A N TYR 221.A O no hydrogen 2.892 N/A TYR 225.A OH ASP 153.A OD1 no hydrogen 2.629 N/A TYR 225.A OH ASP 153.A OD2 no hydrogen 2.963 N/A GLN 226.A N TYR 221.A O no hydrogen 2.878 N/A GLN 229.A N TYR 225.A O no hydrogen 2.893 N/A GLN 229.A NE2 PHE 156.A O no hydrogen 2.699 N/A GLN 230.A N GLN 226.A O no hydrogen 2.631 N/A LYS 232.A N LYS 164.A O no hydrogen 2.841 N/A VAL 233.A N ASP 303.A OD2 no hydrogen 2.631 N/A GLY 234.A N TRP 166.A O no hydrogen 2.811 N/A VAL 236.A N PHE 169.A O no hydrogen 2.964 N/A LEU 237.A N GLY 306.A O no hydrogen 2.697 N/A PHE 239.A N ASN 308.A O no hydrogen 2.906 N/A ASN 240.A N HIS 262.A NE2 no hydrogen 3.418 N/A TRP 241.A N THR 311.A O no hydrogen 2.895 N/A TRP 241.A NE1 GLU 243.A OE1 no hydrogen 2.905 N/A TYR 242.A OH HIS 262.A ND1 no hydrogen 2.794 N/A GLU 243.A N SER 313.A O no hydrogen 2.748 N/A LEU 245.A N MET 315.A O no hydrogen 2.864 N/A SER 246.A OG ASP 251.A OD2 no hydrogen 2.790 N/A SER 248.A N SER 246.A OG no hydrogen 3.284 N/A SER 248.A OG SER 246.A OG no hydrogen 3.293 N/A ASP 251.A N SER 248.A OG no hydrogen 3.039 N/A GLN 252.A N SER 248.A O no hydrogen 2.864 N/A GLN 252.A NE2 ASN 247.A OD1 no hydrogen 3.084 N/A ALA 253.A N THR 249.A O no hydrogen 2.835 N/A ALA 254.A N GLU 250.A O no hydrogen 3.188 N/A ALA 255.A N ASP 251.A O no hydrogen 3.144 N/A GLN 256.A N GLN 252.A O no hydrogen 3.308 N/A GLN 256.A NE2 ASP 260.A OD2 no hydrogen 3.294 N/A GLN 256.A NE2 TYR 367.A OH no hydrogen 2.918 N/A ARG 257.A N ALA 253.A O no hydrogen 2.924 N/A ARG 257.A NE TRP 332.A O no hydrogen 2.711 N/A ARG 257.A NH2 GLN 333.A O no hydrogen 2.936 N/A ALA 258.A N ALA 254.A O no hydrogen 2.912 N/A ARG 259.A N ALA 255.A O no hydrogen 3.022 N/A ARG 259.A NH1 GLN 256.A OE1 no hydrogen 2.811 N/A ARG 259.A NH2 TYR 242.A O no hydrogen 3.043 N/A ASP 260.A N GLN 256.A O no hydrogen 2.885 N/A PHE 261.A N ARG 257.A O no hydrogen 2.768 N/A HIS 262.A N ALA 258.A O no hydrogen 2.777 N/A HIS 262.A ND1 TYR 242.A OH no hydrogen 2.794 N/A ILE 263.A N ARG 259.A O no hydrogen 2.785 N/A GLY 264.A N ARG 259.A O no hydrogen 3.154 N/A TYR 266.A N ILE 263.A O no hydrogen 3.049 N/A LEU 267.A N ILE 263.A O no hydrogen 2.965 N/A ASP 268.A N GLY 264.A O no hydrogen 3.004 N/A LEU 270.A N TYR 266.A O no hydrogen 3.092 N/A ILE 271.A N LEU 267.A O no hydrogen 2.677 N/A ASN 272.A N ASP 268.A O no hydrogen 2.727 N/A ASN 272.A ND2 ASP 268.A OD1 no hydrogen 3.060 N/A GLY 273.A N PRO 269.A O no hydrogen 2.944 N/A HIS 274.A N ASP 268.A O no hydrogen 3.361 N/A HIS 274.A ND1 TYR 275.A O no hydrogen 2.825 N/A TYR 275.A OH HIS 208.A ND1 no hydrogen 2.526 N/A GLN 277.A NE2 GLN 277.A O no hydrogen 3.520 N/A GLN 277.A NE2 ASP 281.A OD1 no hydrogen 3.405 N/A GLN 280.A N PRO 276.A O no hydrogen 3.054 N/A GLN 280.A NE2 TYR 275.A O no hydrogen 2.686 N/A ASP 281.A N GLN 277.A O no hydrogen 2.766 N/A LEU 282.A N ILE 278.A O no hydrogen 2.734 N/A VAL 283.A N MET 279.A O no hydrogen 2.757 N/A LYS 284.A N GLN 280.A O no hydrogen 3.238 N/A ARG 286.A N VAL 283.A O no hydrogen 3.111 N/A ARG 286.A NH1 ALA 200.A O no hydrogen 2.745 N/A ARG 286.A NH1 ASP 331.A OD2 no hydrogen 2.937 N/A ARG 286.A NH2 ASP 331.A OD1 no hydrogen 3.178 N/A ARG 286.A NH2 ASP 331.A OD2 no hydrogen 3.225 N/A LEU 287.A N LYS 284.A O no hydrogen 2.821 N/A LYS 289.A NZ ASP 285.A OD2 no hydrogen 2.831 N/A THR 291.A N GLN 294.A OE1 no hydrogen 3.008 N/A GLN 294.A N THR 291.A OG1 no hydrogen 3.202 N/A ALA 295.A N THR 291.A O no hydrogen 2.830 N/A ARG 296.A N PRO 292.A O no hydrogen 2.832 N/A ARG 296.A NE ARG 296.A O no hydrogen 2.558 N/A ARG 296.A NH2 ARG 296.A O no hydrogen 3.551 N/A ARG 296.A NH2 LYS 299.A O no hydrogen 3.250 N/A LEU 297.A N GLU 293.A O no hydrogen 2.861 N/A VAL 298.A N GLN 294.A O no hydrogen 2.814 N/A LYS 299.A N ALA 295.A O no hydrogen 2.849 N/A GLY 300.A N LEU 270.A O no hydrogen 2.791 N/A SER 301.A N VAL 298.A O no hydrogen 3.101 N/A SER 301.A OG VAL 298.A O no hydrogen 2.564 N/A ASP 303.A N VAL 233.A O no hydrogen 2.802 N/A TYR 304.A OH TRP 166.A O no hydrogen 2.925 N/A ILE 305.A N THR 376.A O no hydrogen 2.868 N/A GLY 306.A N ILE 235.A O no hydrogen 2.851 N/A ILE 307.A N VAL 378.A O no hydrogen 2.766 N/A ASN 308.A N LEU 237.A O no hydrogen 2.870 N/A ASN 308.A ND2 ASN 170.A OD1 no hydrogen 3.549 N/A ASN 308.A ND2 GLN 171.A OE1 no hydrogen 2.708 N/A GLN 309.A N GLU 381.A O no hydrogen 3.210 N/A GLN 309.A NE2 PHE 239.A O no hydrogen 3.380 N/A GLN 309.A NE2 THR 311.A O no hydrogen 3.140 N/A TYR 310.A N ASN 240.A OD1 no hydrogen 3.321 N/A TYR 310.A OH GLU 381.A OE1 no hydrogen 2.762 N/A THR 311.A N ASN 240.A OD1 no hydrogen 3.017 N/A THR 311.A OG1 TYR 355.A O no hydrogen 2.739 N/A SER 313.A N TRP 241.A O no hydrogen 2.807 N/A MET 315.A N GLU 243.A O no hydrogen 2.728 N/A LYS 316.A N THR 335.A O no hydrogen 2.882 N/A GLY 317.A N ASP 251.A OD1 no hydrogen 2.838 N/A MET 321.A N GLN 333.A OE1 no hydrogen 2.827 N/A TYR 328.A N SER 199.A O no hydrogen 3.185 N/A TYR 328.A OH PHE 261.A O no hydrogen 2.935 N/A SER 329.A N ASP 181.A OD2 no hydrogen 3.160 N/A SER 329.A OG ASP 181.A OD2 no hydrogen 2.660 N/A ALA 330.A N SER 327.A OG no hydrogen 3.022 N/A ASP 331.A N SER 327.A O no hydrogen 3.008 N/A ASP 331.A N TYR 328.A O no hydrogen 3.245 N/A TRP 332.A N SER 329.A O no hydrogen 3.455 N/A GLN 333.A N ALA 330.A O no hydrogen 3.319 N/A GLN 333.A NE2 MET 321.A O no hydrogen 3.113 N/A THR 335.A N LYS 316.A O no hydrogen 3.001 N/A THR 335.A OG1 GLN 318.A OE1 no hydrogen 3.335 N/A VAL 337.A N TYR 314.A O no hydrogen 2.942 N/A LYS 340.A N LYS 343.A O no hydrogen 2.729 N/A LYS 343.A N LYS 340.A O no hydrogen 2.794 N/A ALA 349.A N LEU 354.A O no hydrogen 3.100 N/A ASN 350.A N ASP 385.A O no hydrogen 3.196 N/A ASN 350.A ND2 ASP 385.A OD2 no hydrogen 3.340 N/A ASN 350.A ND2 THR 441.A O no hydrogen 3.359 N/A SER 351.A N ASP 385.A OD1 no hydrogen 3.130 N/A SER 351.A OG ASP 385.A OD2 no hydrogen 2.575 N/A LEU 354.A N SER 351.A O no hydrogen 2.940 N/A TYR 355.A N THR 311.A OG1 no hydrogen 2.875 N/A ILE 356.A N PRO 347.A O no hydrogen 2.744 N/A VAL 357.A N TYR 408.A OH no hydrogen 2.889 N/A GLY 360.A N VAL 357.A O no hydrogen 2.965 N/A MET 361.A N PRO 358.A O no hydrogen 2.986 N/A TYR 362.A OH GLU 418.A OE1 no hydrogen 2.632 N/A GLY 363.A N TRP 359.A O no hydrogen 2.940 N/A CYS 364.A N GLY 360.A O no hydrogen 3.057 N/A CYS 364.A SG PHE 239.A O no hydrogen 3.725 N/A CYS 364.A SG GLY 360.A O no hydrogen 3.597 N/A VAL 365.A N MET 361.A O no hydrogen 3.223 N/A ASN 366.A N TYR 362.A O no hydrogen 2.918 N/A TYR 367.A N GLY 363.A O no hydrogen 2.960 N/A ILE 368.A N CYS 364.A O no hydrogen 3.077 N/A LYS 369.A N VAL 365.A O no hydrogen 3.010 N/A LYS 369.A NZ GLN 370.A OE1 no hydrogen 3.509 N/A GLN 370.A N ASN 366.A O no hydrogen 2.879 N/A LYS 371.A N TYR 367.A O no hydrogen 2.771 N/A TYR 372.A N ILE 368.A O no hydrogen 3.077 N/A TYR 372.A OH ASP 268.A OD2 no hydrogen 2.918 N/A ASN 374.A ND2 GLY 419.A O no hydrogen 2.868 N/A VAL 377.A N ASN 421.A O no hydrogen 2.755 N/A VAL 378.A N ILE 305.A O no hydrogen 2.785 N/A ILE 379.A N GLY 424.A O no hydrogen 3.036 N/A THR 380.A N ILE 307.A O no hydrogen 2.980 N/A THR 380.A OG1 ASN 308.A OD1 no hydrogen 2.671 N/A ASN 382.A ND2 GLN 309.A O no hydrogen 2.858 N/A GLN 386.A N LYS 443.A O no hydrogen 2.767 N/A GLN 386.A NE2 TYR 395.A O no hydrogen 3.231 N/A SER 391.A N GLN 394.A OE1 no hydrogen 2.681 N/A GLN 394.A N SER 391.A OG no hydrogen 3.303 N/A TYR 395.A N SER 391.A O no hydrogen 3.211 N/A TYR 395.A OH PRO 387.A O no hydrogen 2.883 N/A LEU 396.A N ARG 392.A O no hydrogen 3.145 N/A ARG 397.A N ASP 393.A O no hydrogen 3.189 N/A THR 399.A N ARG 397.A O no hydrogen 2.741 N/A ARG 401.A NH1 GLN 386.A OE1 no hydrogen 2.814 N/A ARG 401.A NH1 ASP 398.A OD2 no hydrogen 2.570 N/A ARG 401.A NH2 MET 384.A O no hydrogen 3.027 N/A ARG 401.A NH2 GLN 386.A OE1 no hydrogen 3.077 N/A VAL 402.A N ASP 398.A O no hydrogen 3.090 N/A HIS 403.A N THR 399.A O no hydrogen 2.997 N/A PHE 404.A N THR 400.A O no hydrogen 2.912 N/A TYR 405.A N ARG 401.A O no hydrogen 3.138 N/A TYR 405.A OH ASN 382.A O no hydrogen 2.908 N/A ARG 406.A N VAL 402.A O no hydrogen 3.154 N/A ARG 406.A NH1 TRP 1.A O no hydrogen 3.175 N/A ARG 406.A NH2 HIS 403.A ND1 no hydrogen 3.382 N/A SER 407.A N HIS 403.A O no hydrogen 3.124 N/A SER 407.A OG HIS 403.A O no hydrogen 2.989 N/A TYR 408.A N PHE 404.A O no hydrogen 2.912 N/A TYR 408.A OH TYR 310.A O no hydrogen 2.728 N/A LEU 409.A N TYR 405.A O no hydrogen 2.822 N/A THR 410.A N ARG 406.A O no hydrogen 3.035 N/A THR 410.A OG1 ARG 406.A O no hydrogen 2.787 N/A GLN 411.A N SER 407.A O no hydrogen 2.987 N/A LEU 412.A N TYR 408.A O no hydrogen 2.890 N/A LYS 413.A N LEU 409.A O no hydrogen 2.866 N/A LYS 413.A NZ ALA 9.A O no hydrogen 3.375 N/A LYS 413.A NZ ASP 417.A OD1 no hydrogen 3.548 N/A LYS 413.A NZ ASP 417.A OD2 no hydrogen 2.983 N/A LYS 414.A N THR 410.A O no hydrogen 2.975 N/A ALA 415.A N GLN 411.A O no hydrogen 3.164 N/A ILE 416.A N LEU 412.A O no hydrogen 2.932 N/A ASP 417.A N LYS 413.A O no hydrogen 2.723 N/A GLU 418.A N ALA 415.A O no hydrogen 3.082 N/A GLY 419.A N ILE 416.A O no hydrogen 2.708 N/A ALA 420.A N ALA 415.A O no hydrogen 3.330 N/A ASN 421.A N ASN 374.A OD1 no hydrogen 3.015 N/A ASN 421.A ND2 ASN 374.A O no hydrogen 2.942 N/A VAL 422.A N ALA 420.A O no hydrogen 3.065 N/A ALA 423.A N VAL 377.A O no hydrogen 2.807 N/A TYR 425.A N VAL 15.A O no hydrogen 2.706 N/A TYR 425.A OH ASN 382.A OD1 no hydrogen 2.512 N/A PHE 426.A N ILE 379.A O no hydrogen 2.752 N/A ALA 427.A N GLY 17.A O no hydrogen 2.992 N/A TRP 428.A N ASN 382.A O no hydrogen 2.945 N/A SER 429.A N PHE 444.A O no hydrogen 3.059 N/A SER 429.A OG VAL 19.A O no hydrogen 2.891 N/A SER 429.A OG LEU 431.A O no hydrogen 3.210 N/A LEU 430.A N VAL 19.A O no hydrogen 3.404 N/A LEU 431.A N SER 429.A OG no hydrogen 3.367 N/A ASP 432.A N VAL 447.A O no hydrogen 3.190 N/A ASN 433.A ND2 LEU 431.A O no hydrogen 2.947 N/A PHE 434.A N GLN 24.A O no hydrogen 3.174 N/A GLU 435.A N GLY 439.A O no hydrogen 2.761 N/A SER 438.A N GLU 435.A O no hydrogen 2.943 N/A GLY 439.A N TRP 436.A O no hydrogen 2.764 N/A TYR 440.A OH ASN 54.A O no hydrogen 2.793 N/A THR 441.A N SER 438.A O no hydrogen 2.932 N/A THR 441.A OG1 SER 438.A O no hydrogen 2.516 N/A SER 442.A OG ASP 385.A OD2 no hydrogen 2.940 N/A LYS 443.A N GLN 386.A O no hydrogen 2.976 N/A LYS 443.A NZ TYR 440.A O no hydrogen 3.144 N/A GLY 445.A N ASP 432.A OD1 no hydrogen 2.814 N/A ILE 446.A N SER 429.A O no hydrogen 2.925 N/A VAL 447.A N LEU 430.A O no hydrogen 2.882 N/A TYR 448.A N HIS 457.A O no hydrogen 2.495 N/A VAL 449.A N ASP 432.A OD2 no hydrogen 3.400 N/A ASP 450.A N GLU 455.A O no hydrogen 3.057 N/A ASN 452.A N ASP 450.A OD1 no hydrogen 2.713 N/A THR 453.A N ASP 450.A OD1 no hydrogen 3.042 N/A THR 453.A OG1 GLU 455.A OE1 no hydrogen 2.767 N/A LEU 454.A N ASP 450.A O no hydrogen 2.423 N/A GLU 455.A N THR 453.A OG1 no hydrogen 3.212 N/A ARG 456.A NE ASP 68.A OD1 no hydrogen 2.878 N/A ARG 456.A NH1 THR 59.A O no hydrogen 3.250 N/A ARG 456.A NH1 LEU 454.A O no hydrogen 2.850 N/A ARG 456.A NH2 THR 59.A O no hydrogen 2.955 N/A ARG 456.A NH2 ASP 68.A OD2 no hydrogen 3.274 N/A HIS 457.A N TYR 448.A O no hydrogen 2.926 N/A LYS 459.A N ILE 446.A O no hydrogen 2.810 N/A LYS 459.A NZ GLN 386.A OE1 no hydrogen 2.905 N/A LYS 459.A NZ ASP 432.A OD1 no hydrogen 2.776 N/A LYS 459.A NZ ASP 432.A OD2 no hydrogen 3.111 N/A LYS 459.A NZ GLY 445.A O no hydrogen 2.801 N/A ALA 460.A N LEU 396.A O no hydrogen 2.841 N/A SER 461.A N ASP 398.A OD1 no hydrogen 3.158 N/A SER 461.A OG ASP 398.A OD2 no hydrogen 2.729 N/A TYR 463.A N LYS 459.A O no hydrogen 3.291 N/A TRP 464.A N ALA 460.A O no hydrogen 2.808 N/A TRP 464.A NE1 TRP 1.A O no hydrogen 2.599 N/A PHE 465.A N SER 461.A O no hydrogen 2.891 N/A ARG 466.A N ALA 462.A O no hydrogen 2.944 N/A ASP 467.A N TYR 463.A O no hydrogen 2.953 N/A MET 468.A N TRP 464.A O no hydrogen 2.997 N/A LEU 469.A N PHE 465.A O no hydrogen 2.911 N/A LYS 470.A N ASP 467.A O no hydrogen 3.454 N/A