Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pys_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N TRP 100.A O no hydrogen 2.410 N/A THR 6.A N GLU 434.A OE1 no hydrogen 2.945 N/A THR 6.A OG1 GLU 434.A OE1 no hydrogen 3.398 N/A THR 6.A OG1 GLU 434.A OE2 no hydrogen 2.597 N/A GLY 8.A N ASP 117.A OD1 no hydrogen 2.870 N/A LYS 9.A N THR 116.A O no hydrogen 3.010 N/A GLU 11.A N GLU 114.A O no hydrogen 2.868 N/A ALA 13.A N CYS 112.A O no hydrogen 3.060 N/A ARG 16.A NH2 GLU 104.A OE1 no hydrogen 2.543 N/A ARG 16.A NH2 GLU 104.A OE2 no hydrogen 3.398 N/A LEU 17.A N PHE 110.A O no hydrogen 2.734 N/A LEU 19.A N LEU 108.A O no hydrogen 2.790 N/A ILE 23.A N ALA 46.A O no hydrogen 2.692 N/A ARG 24.A N HIS 57.A ND1 no hydrogen 2.946 N/A ARG 24.A NE ASN 55.A O no hydrogen 2.885 N/A GLU 27.A N TRP 60.A O no hydrogen 3.025 N/A GLY 31.A N SER 29.A OG no hydrogen 3.417 N/A PHE 33.A N PRO 30.A O no hydrogen 3.230 N/A ILE 34.A N PRO 30.A O no hydrogen 3.001 N/A ARG 35.A NE ASP 202.A OD1 no hydrogen 2.980 N/A ARG 35.A NE ASP 202.A OD2 no hydrogen 3.100 N/A ARG 35.A NH2 ASP 202.A OD1 no hydrogen 3.446 N/A LEU 36.A N PHE 33.A O no hydrogen 3.242 N/A PHE 37.A N PHE 33.A O no hydrogen 3.452 N/A TYR 38.A N ILE 34.A O no hydrogen 2.948 N/A GLU 39.A N ARG 35.A O no hydrogen 3.067 N/A LYS 40.A N LEU 36.A O no hydrogen 2.943 N/A LYS 40.A NZ GLU 39.A OE2 no hydrogen 3.048 N/A LYS 40.A NZ ASP 144.A OD1 no hydrogen 3.563 N/A LYS 40.A NZ ASP 144.A OD2 no hydrogen 2.874 N/A LEU 41.A N PHE 37.A O no hydrogen 2.912 N/A VAL 42.A N PHE 37.A O no hydrogen 3.211 N/A ALA 46.A N PRO 43.A O no hydrogen 2.849 N/A VAL 47.A N GLU 44.A O no hydrogen 3.069 N/A GLU 48.A N ILE 23.A O no hydrogen 2.889 N/A TRP 49.A NE1 TYR 38.A OH no hydrogen 2.922 N/A ASN 55.A N GLU 52.A O no hydrogen 3.188 N/A SER 56.A N GLU 53.A O no hydrogen 2.895 N/A SER 56.A OG GLU 53.A O no hydrogen 2.748 N/A SER 56.A OG ILE 58.A O no hydrogen 3.493 N/A HIS 57.A N ARG 24.A O no hydrogen 2.731 N/A ILE 58.A N ARG 24.A O no hydrogen 3.254 N/A SER 59.A N ILE 80.A O no hydrogen 2.955 N/A SER 59.A OG GLU 53.A OE2 no hydrogen 2.884 N/A TRP 60.A N TYR 25.A O no hydrogen 2.823 N/A LYS 61.A N VAL 82.A O no hydrogen 2.771 N/A LYS 61.A NZ GLU 53.A OE1 no hydrogen 2.557 N/A LYS 62.A N GLU 27.A OE1 no hydrogen 2.937 N/A ASP 63.A N ALA 84.A O no hydrogen 2.945 N/A THR 65.A N ASP 63.A OD1 no hydrogen 2.938 N/A THR 65.A OG1 ASP 63.A OD1 no hydrogen 2.628 N/A THR 65.A OG1 ASP 63.A OD2 no hydrogen 3.273 N/A LEU 66.A N ASP 63.A O no hydrogen 3.212 N/A GLU 69.A N ASP 86.A OD2 no hydrogen 2.986 N/A GLY 70.A N PRO 67.A O no hydrogen 2.934 N/A TYR 71.A N ASP 117.A O no hydrogen 2.895 N/A TYR 71.A OH ASP 117.A OD2 no hydrogen 2.658 N/A ARG 72.A N GLU 83.A O no hydrogen 2.827 N/A ARG 72.A NH1 ASP 63.A OD2 no hydrogen 2.828 N/A ARG 72.A NH1 GLU 83.A OE1 no hydrogen 2.870 N/A ARG 72.A NH2 ASP 63.A OD2 no hydrogen 3.347 N/A ILE 73.A N ILE 115.A O no hydrogen 2.816 N/A ARG 74.A N ILE 81.A O no hydrogen 2.907 N/A ARG 74.A NH2 GLU 83.A OE1 no hydrogen 3.082 N/A VAL 75.A N VAL 113.A O no hydrogen 2.876 N/A THR 76.A N ARG 79.A O no hydrogen 2.865 N/A THR 76.A OG1 ARG 79.A O no hydrogen 3.255 N/A GLU 78.A N THR 76.A OG1 no hydrogen 3.141 N/A ARG 79.A N THR 76.A OG1 no hydrogen 3.086 N/A ARG 79.A NH1 VAL 54.A O no hydrogen 2.887 N/A ARG 79.A NH2 GLU 53.A O no hydrogen 3.402 N/A ILE 80.A N HIS 57.A O no hydrogen 2.756 N/A ILE 81.A N ARG 74.A O no hydrogen 2.876 N/A VAL 82.A N SER 59.A O no hydrogen 2.855 N/A GLU 83.A N ARG 72.A O no hydrogen 2.800 N/A ALA 84.A N LYS 61.A O no hydrogen 3.088 N/A GLY 89.A N ASP 86.A OD1 no hydrogen 3.009 N/A PHE 90.A N ASP 86.A O no hydrogen 3.447 N/A ILE 91.A N ASP 87.A O no hydrogen 3.065 N/A TYR 92.A N ALA 88.A O no hydrogen 2.930 N/A ALA 93.A N GLY 89.A O no hydrogen 2.860 N/A ILE 94.A N PHE 90.A O no hydrogen 2.953 N/A GLN 95.A N ILE 91.A O no hydrogen 2.953 N/A GLN 95.A NE2 SER 146.A OG no hydrogen 2.933 N/A SER 96.A N TYR 92.A O no hydrogen 2.969 N/A SER 96.A OG TYR 71.A OH no hydrogen 2.516 N/A SER 96.A OG TYR 92.A O no hydrogen 3.548 N/A LEU 97.A N ALA 93.A O no hydrogen 2.887 N/A ARG 98.A N ILE 94.A O no hydrogen 2.986 N/A ARG 98.A NH1 GLN 95.A OE1 no hydrogen 2.881 N/A ARG 98.A NH2 GLN 461.A OE1 no hydrogen 2.998 N/A TRP 100.A N SER 96.A O no hydrogen 2.861 N/A TRP 100.A N LEU 97.A O no hydrogen 3.165 N/A TRP 100.A NE1 PRO 111.A O no hydrogen 2.875 N/A ASN 101.A N LEU 97.A O no hydrogen 3.080 N/A THR 102.A N ILE 109.A O no hydrogen 2.942 N/A THR 102.A OG1 GLU 104.A OE1 no hydrogen 2.829 N/A GLY 103.A N ASN 101.A OD1 no hydrogen 3.366 N/A GLU 104.A N THR 102.A OG1 no hydrogen 2.915 N/A LEU 108.A N LEU 19.A O no hydrogen 2.929 N/A ILE 109.A N ASN 101.A OD1 no hydrogen 2.941 N/A PHE 110.A N LEU 17.A O no hydrogen 2.835 N/A CYS 112.A N GLY 15.A O no hydrogen 3.009 N/A CYS 112.A SG ASP 14.A O no hydrogen 3.453 N/A VAL 113.A N VAL 75.A O no hydrogen 3.147 N/A GLU 114.A N GLU 11.A O no hydrogen 2.932 N/A ILE 115.A N ILE 73.A O no hydrogen 2.850 N/A THR 116.A N LYS 9.A O no hydrogen 3.001 N/A ASP 117.A N TYR 71.A O no hydrogen 3.033 N/A ARG 120.A N TRP 436.A O no hydrogen 2.870 N/A ARG 120.A NE GLN 435.A O no hydrogen 2.823 N/A ARG 120.A NH1 GLN 435.A O no hydrogen 2.899 N/A TRP 123.A N LEU 406.A O no hydrogen 3.010 N/A TRP 123.A NE1 SER 125.A OG no hydrogen 2.856 N/A ARG 124.A N ASN 149.A OD1 no hydrogen 2.976 N/A ARG 124.A NE LYS 148.A O no hydrogen 2.842 N/A ARG 124.A NH1 GLU 69.A OE1 no hydrogen 2.949 N/A ARG 124.A NH1 VAL 121.A O no hydrogen 2.855 N/A ARG 124.A NH2 GLU 69.A OE2 no hydrogen 2.979 N/A ARG 124.A NH2 LYS 148.A O no hydrogen 3.090 N/A PHE 126.A N TYR 150.A O no hydrogen 3.201 N/A ASP 128.A N LEU 411.A O no hydrogen 3.154 N/A SER 129.A N HIS 154.A O no hydrogen 2.885 N/A SER 129.A OG GLN 134.A OE1 no hydrogen 2.671 N/A GLY 130.A N ASP 128.A OD1 no hydrogen 2.904 N/A ARG 131.A N ASP 128.A OD1 no hydrogen 3.029 N/A ARG 131.A NH2 ASP 128.A OD2 no hydrogen 2.949 N/A TYR 133.A N GLU 183.A O no hydrogen 2.874 N/A GLN 134.A N TYR 188.A OH no hydrogen 3.106 N/A GLN 134.A NE2 ASP 128.A O no hydrogen 3.078 N/A LYS 135.A N GLU 419.A OE2 no hydrogen 2.797 N/A THR 138.A N LYS 135.A O no hydrogen 2.874 N/A THR 138.A OG1 GLU 419.A OE1 no hydrogen 2.432 N/A ILE 139.A N LYS 135.A O no hydrogen 3.031 N/A LYS 140.A N VAL 136.A O no hydrogen 2.925 N/A LYS 140.A NZ GLU 195.A OE2 no hydrogen 2.455 N/A LYS 141.A N SER 137.A O no hydrogen 3.037 N/A LYS 141.A NZ ASP 422.A OD2 no hydrogen 2.728 N/A LYS 141.A NZ GLY 462.A O no hydrogen 3.082 N/A TYR 142.A N THR 138.A O no hydrogen 3.252 N/A TYR 142.A N ILE 139.A O no hydrogen 3.193 N/A TYR 142.A OH ASP 422.A OD1 no hydrogen 2.607 N/A ILE 143.A N ILE 139.A O no hydrogen 3.044 N/A ASP 144.A N LYS 140.A O no hydrogen 2.772 N/A SER 146.A N ILE 143.A O no hydrogen 3.067 N/A SER 146.A OG ARG 203.A O no hydrogen 2.653 N/A LYS 148.A N SER 146.A O no hydrogen 2.930 N/A LYS 148.A NZ SER 96.A OG no hydrogen 2.840 N/A ASN 149.A N ARG 124.A O no hydrogen 2.892 N/A ASN 149.A ND2 GLU 69.A OE2 no hydrogen 3.132 N/A ASN 149.A ND2 LYS 122.A O no hydrogen 2.865 N/A TYR 150.A N ARG 124.A O no hydrogen 3.161 N/A PHE 151.A N THR 206.A O no hydrogen 2.946 N/A HIS 152.A N PHE 126.A O no hydrogen 2.815 N/A HIS 152.A NE2 GLU 210.A OE1 no hydrogen 2.766 N/A TRP 153.A N VAL 208.A O no hydrogen 2.857 N/A TRP 153.A NE1 SER 129.A OG no hydrogen 2.882 N/A HIS 154.A N LEU 127.A O no hydrogen 3.075 N/A HIS 154.A ND1 GLU 210.A OE1 no hydrogen 2.729 N/A HIS 154.A NE2 GLU 157.A OE2 no hydrogen 2.585 N/A LEU 155.A N GLU 210.A O no hydrogen 3.473 N/A GLU 157.A N GLY 160.A O no hydrogen 2.776 N/A GLY 158.A N GLU 157.A OE1 no hydrogen 3.332 N/A GLY 160.A N GLU 157.A O no hydrogen 3.084 N/A TRP 161.A N GLY 175.A O no hydrogen 2.973 N/A TRP 161.A NE1 ILE 163.A O no hydrogen 2.740 N/A ARG 162.A N LEU 155.A O no hydrogen 2.946 N/A ARG 162.A NE SER 129.A O no hydrogen 2.898 N/A ARG 162.A NE GLY 130.A O no hydrogen 3.280 N/A ARG 162.A NH1 ALA 176.A O no hydrogen 3.188 N/A ARG 162.A NH1 GLN 184.A O no hydrogen 2.961 N/A ARG 162.A NH1 GLY 186.A O no hydrogen 2.926 N/A ARG 162.A NH2 GLY 130.A O no hydrogen 2.868 N/A ARG 162.A NH2 GLN 184.A O no hydrogen 3.000 N/A GLU 164.A N TYR 188.A O no hydrogen 3.168 N/A LYS 166.A N GLU 257.A OE1 no hydrogen 2.753 N/A LYS 166.A NZ GLU 164.A OE1 no hydrogen 3.541 N/A ARG 167.A N GLU 257.A OE2 no hydrogen 2.967 N/A TYR 168.A N ILE 165.A O no hydrogen 3.096 N/A PHE 170.A N TYR 223.A OH no hydrogen 3.192 N/A LEU 171.A N TYR 168.A O no hydrogen 3.152 N/A THR 172.A N PRO 169.A O no hydrogen 3.354 N/A THR 172.A OG1 PRO 169.A O no hydrogen 3.376 N/A ARG 173.A N PRO 169.A O no hydrogen 3.071 N/A ILE 174.A N PHE 170.A O no hydrogen 2.919 N/A GLY 175.A N PHE 170.A O no hydrogen 3.212 N/A ALA 176.A N THR 172.A O no hydrogen 3.066 N/A PHE 177.A N ILE 174.A O no hydrogen 3.172 N/A GLN 180.A N GLN 237.A OE1 no hydrogen 3.088 N/A GLN 180.A NE2 VAL 178.A O no hydrogen 3.042 N/A GLY 181.A N GLN 184.A OE1 no hydrogen 2.810 N/A GLN 184.A N GLY 181.A O no hydrogen 3.125 N/A GLN 184.A NE2 ARG 131.A O no hydrogen 3.024 N/A GLN 185.A NE2 GLY 179.A O no hydrogen 2.896 N/A GLN 185.A NE2 GLY 181.A O no hydrogen 2.896 N/A GLY 186.A N ALA 176.A O no hydrogen 2.989 N/A TYR 188.A N ARG 162.A O no hydrogen 2.807 N/A TYR 188.A OH GLN 134.A O no hydrogen 2.514 N/A SER 189.A N GLU 192.A OE1 no hydrogen 2.820 N/A SER 189.A OG GLU 192.A OE1 no hydrogen 3.333 N/A GLN 190.A N GLU 164.A OE1 no hydrogen 2.869 N/A GLN 190.A NE2 GLU 164.A O no hydrogen 2.905 N/A GLN 190.A NE2 GLU 257.A OE1 no hydrogen 2.737 N/A GLU 192.A N SER 189.A OG no hydrogen 3.124 N/A VAL 193.A N SER 189.A O no hydrogen 2.988 N/A LYS 194.A N GLN 190.A O no hydrogen 2.979 N/A GLU 195.A N GLU 191.A O no hydrogen 3.056 N/A ILE 196.A N GLU 192.A O no hydrogen 2.895 N/A ILE 197.A N VAL 193.A O no hydrogen 2.794 N/A GLY 198.A N LYS 194.A O no hydrogen 3.075 N/A TYR 199.A N GLU 195.A O no hydrogen 2.921 N/A ALA 200.A N ILE 196.A O no hydrogen 2.893 N/A ALA 201.A N ILE 197.A O no hydrogen 2.952 N/A ASP 202.A N GLY 198.A O no hydrogen 3.118 N/A ARG 203.A N ALA 200.A O no hydrogen 2.898 N/A ARG 203.A NE TYR 199.A O no hydrogen 2.840 N/A ARG 203.A NH1 GLU 39.A OE1 no hydrogen 3.122 N/A ARG 203.A NH2 GLU 39.A OE1 no hydrogen 3.538 N/A ARG 203.A NH2 GLU 39.A OE2 no hydrogen 3.083 N/A ARG 203.A NH2 ASP 144.A OD1 no hydrogen 2.916 N/A GLY 204.A N ALA 201.A O no hydrogen 3.213 N/A ILE 205.A N ALA 200.A O no hydrogen 2.982 N/A THR 206.A N ASN 149.A O no hydrogen 2.995 N/A VAL 208.A N PHE 151.A O no hydrogen 2.851 N/A GLU 210.A N TRP 153.A O no hydrogen 2.967 N/A ILE 211.A N HIS 267.A O no hydrogen 2.990 N/A ASP 212.A N THR 156.A OG1 no hydrogen 2.855 N/A HIS 215.A ND1 GLU 157.A OE1 no hydrogen 2.792 N/A HIS 215.A NE2 ASP 271.A OD2 no hydrogen 2.740 N/A GLU 217.A N GLU 217.A OE1 no hydrogen 2.889 N/A LEU 220.A N ALA 216.A O no hydrogen 2.737 N/A ASN 221.A N GLU 217.A O no hydrogen 2.983 N/A ASN 221.A ND2 GLU 217.A O no hydrogen 3.218 N/A ASN 221.A ND2 VAL 233.A O no hydrogen 2.675 N/A ALA 222.A N ALA 218.A O no hydrogen 3.274 N/A TYR 223.A N ALA 219.A O no hydrogen 2.844 N/A LEU 226.A N TYR 223.A O no hydrogen 2.905 N/A GLY 227.A N PRO 224.A O no hydrogen 3.023 N/A VAL 231.A N PHE 229.A O no hydrogen 2.624 N/A GLN 237.A NE2 VAL 235.A O no hydrogen 3.357 N/A PHE 240.A N PRO 213.A O no hydrogen 2.903 N/A CYS 241.A N LEU 226.A O no hydrogen 3.088 N/A LYS 244.A N CYS 241.A O no hydrogen 3.432 N/A LYS 244.A NZ CYS 228.A O no hydrogen 2.547 N/A LYS 244.A NZ ASP 281.A OD2 no hydrogen 2.372 N/A THR 247.A N LYS 244.A O no hydrogen 2.909 N/A THR 247.A OG1 LEU 226.A O no hydrogen 3.069 N/A LEU 248.A N LYS 244.A O no hydrogen 3.252 N/A ILE 249.A N ASP 245.A O no hydrogen 2.802 N/A PHE 250.A N SER 246.A O no hydrogen 2.825 N/A LEU 251.A N THR 247.A O no hydrogen 2.882 N/A LYS 252.A N LEU 248.A O no hydrogen 2.822 N/A ASN 253.A N ILE 249.A O no hydrogen 2.918 N/A ASN 253.A ND2 TYR 168.A OH no hydrogen 2.939 N/A VAL 254.A N PHE 250.A O no hydrogen 2.979 N/A LEU 255.A N LEU 251.A O no hydrogen 2.927 N/A ASP 256.A N LYS 252.A O no hydrogen 2.846 N/A GLU 257.A N ASN 253.A O no hydrogen 3.369 N/A VAL 258.A N VAL 254.A O no hydrogen 2.947 N/A CYS 259.A N LEU 255.A O no hydrogen 2.817 N/A CYS 259.A SG LEU 255.A O no hydrogen 3.322 N/A ARG 260.A N ASP 256.A O no hydrogen 3.172 N/A SER 263.A OG TYR 265.A O no hydrogen 2.686 N/A TYR 265.A N SER 263.A OG no hydrogen 3.074 N/A ILE 266.A N LYS 314.A O no hydrogen 2.935 N/A HIS 267.A N PRO 209.A O no hydrogen 2.966 N/A HIS 267.A NE2 GLN 336.A OE1 no hydrogen 2.817 N/A LEU 268.A N ILE 316.A O no hydrogen 2.772 N/A GLY 269.A N HIS 267.A ND1 no hydrogen 2.984 N/A LYS 273.A NZ GLN 298.A OE1 no hydrogen 3.230 N/A TRP 276.A NE1 PHE 240.A O no hydrogen 3.163 N/A ASP 277.A N LYS 273.A O no hydrogen 2.987 N/A CYS 279.A N TRP 276.A O no hydrogen 3.115 N/A CYS 279.A SG ASP 281.A OD2 no hydrogen 3.827 N/A ARG 283.A N CYS 279.A O no hydrogen 2.912 N/A SER 284.A N PRO 280.A O no hydrogen 3.059 N/A ARG 285.A N ASP 281.A O no hydrogen 3.140 N/A ARG 285.A NE ALA 242.A O no hydrogen 3.131 N/A ARG 285.A NH1 ASP 245.A OD1 no hydrogen 2.663 N/A ARG 285.A NH2 ALA 242.A O no hydrogen 3.190 N/A ARG 285.A NH2 ASP 245.A OD1 no hydrogen 2.526 N/A ILE 286.A N CYS 282.A O no hydrogen 3.180 N/A GLU 287.A N ARG 283.A O no hydrogen 3.292 N/A LYS 288.A N SER 284.A O no hydrogen 3.069 N/A GLU 289.A N ARG 285.A O no hydrogen 3.074 N/A LYS 290.A N GLU 287.A O no hydrogen 3.292 N/A LEU 291.A N ILE 286.A O no hydrogen 2.966 N/A LYS 292.A N ASP 296.A OD2 no hydrogen 3.104 N/A ASP 296.A N ASP 293.A OD1 no hydrogen 2.956 N/A LEU 297.A N ASP 293.A O no hydrogen 2.939 N/A GLN 298.A N SER 294.A O no hydrogen 3.143 N/A GLN 298.A NE2 GLY 270.A O no hydrogen 2.585 N/A GLN 298.A NE2 ASP 271.A O no hydrogen 3.645 N/A LEU 299.A N HIS 295.A O no hydrogen 3.140 N/A TRP 300.A N ASP 296.A O no hydrogen 2.885 N/A PHE 301.A N LEU 297.A O no hydrogen 2.802 N/A SER 302.A N GLN 298.A O no hydrogen 2.764 N/A SER 302.A OG GLN 298.A O no hydrogen 2.878 N/A ALA 303.A N LEU 299.A O no hydrogen 2.705 N/A ARG 304.A N TRP 300.A O no hydrogen 2.924 N/A ARG 304.A NH1 ASP 306.A OD2 no hydrogen 3.398 N/A ASP 306.A N ALA 303.A O no hydrogen 2.822 N/A TYR 307.A N ARG 304.A O no hydrogen 3.040 N/A TYR 307.A OH ASP 256.A OD1 no hydrogen 2.311 N/A TYR 307.A OH ASP 256.A OD2 no hydrogen 3.041 N/A LYS 309.A N ALA 305.A O no hydrogen 2.777 N/A LYS 309.A NZ ASP 331.A OD1 no hydrogen 2.692 N/A LYS 309.A NZ ASP 331.A OD2 no hydrogen 3.451 N/A GLN 310.A N ASP 306.A O no hydrogen 3.068 N/A LYS 311.A N LEU 308.A O no hydrogen 2.928 N/A GLY 312.A N LYS 309.A O no hydrogen 2.939 N/A ARG 313.A N LEU 308.A O no hydrogen 2.910 N/A ARG 313.A NH1 PHE 261.A O no hydrogen 2.746 N/A ARG 313.A NH1 SER 263.A O no hydrogen 2.766 N/A ARG 313.A NH2 CYS 259.A O no hydrogen 2.984 N/A LYS 314.A N ALA 264.A O no hydrogen 2.761 N/A ALA 315.A N ASN 332.A O no hydrogen 2.862 N/A ILE 316.A N ILE 266.A O no hydrogen 2.880 N/A PHE 317.A N VAL 334.A O no hydrogen 2.888 N/A TRP 318.A N GLY 269.A O no hydrogen 2.732 N/A TRP 318.A NE1 GLU 210.A OE2 no hydrogen 2.907 N/A GLY 319.A N GLN 336.A O no hydrogen 2.890 N/A VAL 321.A N TRP 318.A O no hydrogen 3.363 N/A ILE 322.A N GLY 319.A O no hydrogen 3.087 N/A TYR 323.A N ASP 320.A O no hydrogen 3.103 N/A TYR 327.A N ASP 296.A OD1 no hydrogen 2.759 N/A LEU 329.A N TYR 356.A OH no hydrogen 3.253 N/A ASN 332.A ND2 ALA 305.A O no hydrogen 2.970 N/A ASN 332.A ND2 ARG 313.A O no hydrogen 2.957 N/A VAL 333.A N PRO 330.A O no hydrogen 3.312 N/A VAL 334.A N ALA 315.A O no hydrogen 2.749 N/A ILE 335.A N PRO 357.A O no hydrogen 2.849 N/A GLN 336.A N PHE 317.A O no hydrogen 2.842 N/A GLN 336.A NE2 SER 408.A OG no hydrogen 2.961 N/A TRP 337.A N ILE 359.A O no hydrogen 2.874 N/A TRP 337.A NE1 ARG 344.A O no hydrogen 2.910 N/A TRP 338.A NE1 ASP 320.A OD1 no hydrogen 2.710 N/A TRP 340.A N TRP 338.A O no hydrogen 3.097 N/A ARG 341.A N ASN 363.A OD1 no hydrogen 3.144 N/A GLY 342.A N ASN 339.A OD1 no hydrogen 2.791 N/A HIS 343.A N ASN 339.A O no hydrogen 2.856 N/A ARG 344.A N TRP 340.A O no hydrogen 2.709 N/A ARG 344.A NH2 TRP 340.A O no hydrogen 3.093 N/A LEU 346.A N HIS 343.A O no hydrogen 3.093 N/A LYS 349.A N ASP 345.A O no hydrogen 2.829 N/A ASN 350.A N LEU 346.A O no hydrogen 2.952 N/A ASN 350.A ND2 ILE 322.A O no hydrogen 2.702 N/A ALA 351.A N ALA 347.A O no hydrogen 2.889 N/A VAL 352.A N LEU 348.A O no hydrogen 3.155 N/A ARG 353.A N LYS 349.A O no hydrogen 3.226 N/A ARG 353.A NH2 ASP 325.A OD1 no hydrogen 3.108 N/A HIS 354.A N ASN 350.A O no hydrogen 3.171 N/A HIS 354.A N ALA 351.A O no hydrogen 3.289 N/A HIS 354.A NE2 ASP 325.A OD1 no hydrogen 3.291 N/A ASN 355.A N VAL 352.A O no hydrogen 3.172 N/A TYR 356.A N ALA 351.A O no hydrogen 2.780 N/A VAL 358.A N LEU 404.A O no hydrogen 2.825 N/A ILE 359.A N ILE 335.A O no hydrogen 2.824 N/A CYS 360.A N GLY 407.A O no hydrogen 2.845 N/A GLY 361.A N TRP 337.A O no hydrogen 2.813 N/A THR 362.A N SER 395.A OG no hydrogen 2.946 N/A THR 362.A OG1 TYR 364.A O no hydrogen 2.583 N/A THR 362.A OG1 SER 395.A OG no hydrogen 2.616 N/A ASN 363.A N TRP 338.A O no hydrogen 2.723 N/A ASN 363.A ND2 ASN 339.A OD1 no hydrogen 3.193 N/A TYR 364.A N ASN 363.A OD1 no hydrogen 2.911 N/A TYR 364.A OH ALA 381.A O no hydrogen 2.514 N/A TYR 365.A N ASN 393.A OD1 no hydrogen 3.152 N/A THR 366.A N THR 362.A O no hydrogen 2.925 N/A THR 366.A OG1 THR 362.A O no hydrogen 2.745 N/A TYR 367.A N ASN 363.A O no hydrogen 3.200 N/A LEU 368.A N ALA 410.A O no hydrogen 2.824 N/A ASN 369.A ND2 TYR 378.A OH no hydrogen 2.916 N/A PHE 370.A N TYR 367.A O no hydrogen 2.961 N/A TRP 375.A N TYR 378.A O no hydrogen 2.997 N/A TRP 375.A NE1 ASP 480.A OD2 no hydrogen 3.281 N/A LYS 376.A NZ ASP 415.A O no hydrogen 3.364 N/A GLY 377.A N ASP 415.A OD2 no hydrogen 3.056 N/A TYR 378.A N TRP 375.A O no hydrogen 2.931 N/A ARG 382.A N THR 379.A O no hydrogen 2.974 N/A ARG 382.A NH1 GLY 377.A O no hydrogen 2.850 N/A THR 383.A OG1 GLN 380.A O no hydrogen 2.763 N/A PHE 384.A N PRO 371.A O no hydrogen 3.249 N/A ASP 385.A N ASP 388.A OD2 no hydrogen 2.967 N/A LEU 386.A N ALA 468.A O no hydrogen 2.922 N/A ASP 388.A N ASP 385.A OD1 no hydrogen 3.148 N/A VAL 389.A N ASP 385.A O no hydrogen 3.133 N/A TYR 390.A N LEU 386.A O no hydrogen 2.972 N/A TYR 390.A OH GLU 442.A O no hydrogen 2.678 N/A LEU 391.A N GLU 387.A O no hydrogen 2.882 N/A ARG 392.A N ASP 388.A O no hydrogen 2.928 N/A ARG 392.A NH2 ASP 388.A OD1 no hydrogen 2.790 N/A ASN 393.A ND2 GLN 435.A OE1 no hydrogen 2.897 N/A SER 395.A N ASN 393.A OD1 no hydrogen 3.174 N/A SER 395.A OG THR 362.A OG1 no hydrogen 2.616 N/A TYR 396.A N ASN 393.A O no hydrogen 3.035 N/A ARG 397.A NE GLU 401.A OE1 no hydrogen 2.994 N/A ARG 397.A NE GLU 401.A OE2 no hydrogen 3.407 N/A ARG 397.A NH2 GLU 401.A OE1 no hydrogen 2.391 N/A LEU 404.A N ASN 402.A OD1 no hydrogen 3.161 N/A ILE 405.A N ASN 402.A O no hydrogen 3.017 N/A LEU 406.A N VAL 358.A O no hydrogen 2.835 N/A SER 409.A N SER 125.A O no hydrogen 2.938 N/A SER 409.A OG SER 125.A O no hydrogen 2.867 N/A ALA 410.A N THR 366.A O no hydrogen 3.012 N/A TRP 412.A N ASN 369.A OD1 no hydrogen 3.335 N/A THR 413.A N ASP 128.A OD2 no hydrogen 3.010 N/A THR 413.A OG1 ASP 128.A O no hydrogen 2.988 N/A VAL 417.A N THR 413.A O no hydrogen 3.425 N/A THR 418.A OG1 SER 420.A OG no hydrogen 3.401 N/A GLU 419.A N GLU 183.A OE1 no hydrogen 2.961 N/A SER 420.A OG THR 418.A OG1 no hydrogen 3.401 N/A ARG 423.A NH1 LYS 478.A O no hydrogen 2.921 N/A ARG 423.A NH1 ASP 480.A OXT no hydrogen 2.818 N/A ARG 423.A NH2 SER 420.A O no hydrogen 2.971 N/A ARG 424.A N ILE 421.A O no hydrogen 3.026 N/A ARG 424.A NH1 TRP 479.A O no hydrogen 2.894 N/A ARG 424.A NH2 TRP 479.A O no hydrogen 3.103 N/A VAL 425.A N ILE 421.A O no hydrogen 3.051 N/A PHE 426.A N ASP 422.A O no hydrogen 2.901 N/A ARG 428.A NH1 PHE 370.A O no hydrogen 2.764 N/A ARG 428.A NH1 PHE 384.A O no hydrogen 2.904 N/A ARG 428.A NH2 PHE 370.A O no hydrogen 2.844 N/A ARG 428.A NH2 ARG 424.A O no hydrogen 2.985 N/A ILE 429.A N VAL 425.A O no hydrogen 2.866 N/A LEU 430.A N PRO 427.A O no hydrogen 2.923 N/A ALA 431.A N ARG 428.A O no hydrogen 3.073 N/A LEU 432.A N ARG 428.A O no hydrogen 3.371 N/A ALA 433.A N ILE 429.A O no hydrogen 2.809 N/A GLU 434.A N LEU 430.A O no hydrogen 2.975 N/A GLN 435.A N ALA 431.A O no hydrogen 2.991 N/A GLN 435.A NE2 VAL 389.A O no hydrogen 2.925 N/A GLN 435.A NE2 TYR 390.A O no hydrogen 3.339 N/A TRP 436.A NE1 ASP 117.A OD1 no hydrogen 2.864 N/A HIS 437.A N GLU 434.A O no hydrogen 2.896 N/A ASN 440.A N SER 438.A O no hydrogen 2.728 N/A GLU 446.A N ASN 443.A OD1 no hydrogen 2.888 N/A PHE 447.A N ASN 443.A O no hydrogen 3.011 N/A TYR 448.A N PHE 444.A O no hydrogen 2.727 N/A GLY 449.A N ASP 445.A O no hydrogen 3.051 N/A LYS 450.A N GLU 446.A O no hydrogen 3.140 N/A LYS 450.A NZ THR 6.A OG1 no hydrogen 2.908 N/A LYS 450.A NZ GLU 442.A OE2 no hydrogen 3.109 N/A VAL 451.A N PHE 447.A O no hydrogen 2.997 N/A LEU 452.A N TYR 448.A O no hydrogen 2.954 N/A SER 453.A N GLY 449.A O no hydrogen 3.013 N/A SER 453.A OG GLY 449.A O no hydrogen 2.880 N/A LYS 454.A N LYS 450.A O no hydrogen 2.965 N/A LYS 454.A N VAL 451.A O no hydrogen 3.296 N/A LYS 454.A NZ GLN 2.A OE1 no hydrogen 3.487 N/A LYS 454.A NZ ILE 3.A O no hydrogen 2.816 N/A LYS 454.A NZ GLN 99.A O no hydrogen 3.189 N/A GLN 455.A N LEU 452.A O no hydrogen 3.454 N/A GLN 455.A NE2 GLU 459.A OE2 no hydrogen 3.016 N/A PHE 458.A N LYS 454.A O no hydrogen 3.081 N/A GLU 459.A N GLN 455.A O no hydrogen 2.893 N/A GLN 460.A N LEU 456.A O no hydrogen 2.871 N/A GLN 461.A N TRP 457.A O no hydrogen 3.243 N/A GLN 461.A N PHE 458.A O no hydrogen 3.038 N/A GLN 461.A NE2 TRP 457.A O no hydrogen 3.035 N/A GLY 462.A N GLU 459.A O no hydrogen 2.923 N/A TYR 463.A N PHE 458.A O no hydrogen 3.248 N/A TYR 463.A OH LYS 141.A O no hydrogen 2.733 N/A SER 464.A N ASP 422.A OD2 no hydrogen 3.324 N/A GLY 466.A N PHE 426.A O no hydrogen 2.763 N/A ALA 468.A N ASP 472.A OD2 no hydrogen 3.209 N/A LEU 469.A N ASP 472.A OD2 no hydrogen 2.999 N/A LYS 470.A N ASP 385.A OD2 no hydrogen 3.004 N/A ASP 472.A N LEU 469.A O no hydrogen 2.788 N/A ALA 473.A N LYS 470.A O no hydrogen 3.111 N/A GLY 474.A N GLU 471.A O no hydrogen 3.362 N/A TRP 479.A NE1 THR 373.A OG1 no hydrogen 2.944 N/A