Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4r5t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A N TYR 373.A O no hydrogen 2.861 N/A ARG 6.A N GLU 371.A O no hydrogen 3.037 N/A ARG 6.A NE GLU 371.A OE1 no hydrogen 2.746 N/A ARG 6.A NH2 GLU 371.A OE1 no hydrogen 3.036 N/A ARG 6.A NH2 GLU 371.A OE2 no hydrogen 2.794 N/A ASP 8.A N TYR 5.A O no hydrogen 3.079 N/A TYR 9.A OH ASP 139.A OD2 no hydrogen 2.886 N/A SER 12.A OG PHE 14.A O no hydrogen 3.458 N/A PHE 14.A N SER 12.A OG no hydrogen 3.011 N/A ILE 15.A N ASP 39.A O no hydrogen 2.927 N/A ASN 17.A N ASP 37.A O no hydrogen 2.873 N/A GLN 18.A N ASP 37.A O no hydrogen 3.443 N/A GLN 18.A NE2 VAL 19.A O no hydrogen 3.268 N/A VAL 19.A N LYS 143.A O no hydrogen 2.670 N/A THR 20.A N VAL 35.A O no hydrogen 2.927 N/A LEU 21.A N ASP 145.A O no hydrogen 2.655 N/A ASN 22.A N ARG 33.A O no hydrogen 2.833 N/A ILE 23.A N THR 147.A O no hydrogen 2.800 N/A ASN 24.A N ILE 31.A O no hydrogen 2.805 N/A ILE 25.A N THR 149.A O no hydrogen 2.846 N/A HIS 26.A N GLU 29.A O no hydrogen 2.786 N/A THR 30.A N ILE 101.A O no hydrogen 2.919 N/A ILE 31.A N ASN 24.A O no hydrogen 2.976 N/A VAL 32.A N VAL 99.A O no hydrogen 2.829 N/A ARG 33.A N ASN 22.A O no hydrogen 2.825 N/A SER 34.A N SER 97.A O no hydrogen 2.934 N/A VAL 35.A N THR 20.A O no hydrogen 3.028 N/A LEU 36.A N PHE 95.A O no hydrogen 2.626 N/A ASP 37.A N GLN 18.A O no hydrogen 2.845 N/A MET 38.A N PHE 93.A O no hydrogen 2.793 N/A ASP 39.A N ILE 15.A O no hydrogen 2.852 N/A ILE 40.A N ASP 39.A OD1 no hydrogen 2.586 N/A SER 41.A N GLY 13.A O no hydrogen 3.514 N/A SER 41.A OG SER 12.A O no hydrogen 2.620 N/A HIS 43.A N SER 41.A OG no hydrogen 3.232 N/A ASN 44.A N SER 41.A O no hydrogen 3.101 N/A ASN 44.A ND2 GLY 13.A O no hydrogen 2.645 N/A VAL 45.A N GLU 47.A OE1 no hydrogen 2.794 N/A GLY 46.A N ASN 44.A OD1 no hydrogen 2.872 N/A GLU 47.A N GLU 47.A OE1 no hydrogen 2.625 N/A LEU 49.A N ILE 83.A O no hydrogen 2.950 N/A PHE 51.A N LEU 81.A O no hydrogen 2.852 N/A ASP 52.A N PHE 134.A O no hydrogen 2.633 N/A GLY 53.A N GLU 79.A O no hydrogen 3.024 N/A VAL 54.A N ARG 129.A O no hydrogen 3.033 N/A GLY 55.A N ASN 78.A O no hydrogen 3.308 N/A LEU 56.A N TYR 76.A OH no hydrogen 3.127 N/A LYS 57.A N ILE 100.A O no hydrogen 3.308 N/A ASN 59.A N GLU 98.A O no hydrogen 2.983 N/A ASN 59.A ND2 GLU 98.A OE1 no hydrogen 2.689 N/A SER 62.A N SER 96.A O no hydrogen 2.930 N/A ILE 63.A N LYS 66.A O no hydrogen 3.334 N/A ASN 64.A N ALA 94.A O no hydrogen 2.828 N/A LYS 66.A N ILE 63.A O no hydrogen 3.296 N/A LEU 68.A N ILE 61.A O no hydrogen 2.899 N/A VAL 69.A N GLU 73.A OE1 no hydrogen 2.562 N/A GLY 71.A N TYR 74.A O no hydrogen 2.891 N/A GLU 73.A N VAL 69.A O no hydrogen 2.931 N/A THR 75.A N THR 82.A O no hydrogen 2.975 N/A TYR 76.A OH GLY 53.A O no hydrogen 2.522 N/A GLU 79.A N ASP 77.A OD1 no hydrogen 2.935 N/A PHE 80.A N ASP 77.A OD1 no hydrogen 2.730 N/A LEU 81.A N PHE 51.A O no hydrogen 2.892 N/A THR 82.A N THR 75.A O no hydrogen 2.864 N/A ILE 83.A N LEU 49.A O no hydrogen 2.879 N/A PHE 84.A N GLU 73.A O no hydrogen 3.216 N/A SER 85.A N ASP 48.A OD1 no hydrogen 2.845 N/A SER 85.A OG GLY 46.A O no hydrogen 3.058 N/A PHE 87.A N PHE 84.A O no hydrogen 2.892 N/A VAL 88.A N SER 85.A O no hydrogen 2.640 N/A PHE 93.A N MET 38.A O no hydrogen 3.096 N/A ALA 94.A N ASN 64.A OD1 no hydrogen 3.196 N/A PHE 95.A N LEU 36.A O no hydrogen 3.034 N/A SER 96.A N SER 62.A O no hydrogen 3.352 N/A SER 97.A N SER 34.A O no hydrogen 2.893 N/A GLU 98.A N GLU 60.A O no hydrogen 2.987 N/A VAL 99.A N VAL 32.A O no hydrogen 2.885 N/A ILE 100.A N LYS 57.A O no hydrogen 2.847 N/A ILE 101.A N THR 30.A O no hydrogen 2.878 N/A THR 105.A N HIS 102.A O no hydrogen 3.136 N/A THR 105.A OG1 HIS 102.A O no hydrogen 3.240 N/A ASN 106.A N PRO 103.A O no hydrogen 3.079 N/A ASN 106.A ND2 THR 110.A O no hydrogen 2.662 N/A ASN 106.A ND2 LEU 112.A O no hydrogen 2.847 N/A GLY 111.A N GLN 122.A O no hydrogen 2.875 N/A TYR 113.A N VAL 120.A O no hydrogen 2.812 N/A TYR 113.A OH ASP 261.A O no hydrogen 2.843 N/A LYS 114.A N PRO 103.A O no hydrogen 3.096 N/A LYS 114.A NZ LYS 116.A O no hydrogen 3.072 N/A SER 115.A N ILE 118.A O no hydrogen 2.615 N/A SER 115.A OG ASP 261.A OD1 no hydrogen 2.583 N/A ILE 118.A N SER 115.A O no hydrogen 2.861 N/A ILE 119.A N ALA 194.A O no hydrogen 2.804 N/A VAL 120.A N TYR 113.A O no hydrogen 2.816 N/A SER 121.A N VAL 192.A O no hydrogen 3.268 N/A GLN 122.A N GLY 111.A O no hydrogen 2.823 N/A GLN 122.A NE2 GLU 124.A O no hydrogen 2.836 N/A CYS 123.A SG PHE 190.A O no hydrogen 3.682 N/A GLY 127.A N CYS 123.A O no hydrogen 2.663 N/A ARG 129.A N ASP 136.A OD2 no hydrogen 3.166 N/A ARG 129.A NE ASP 136.A OD2 no hydrogen 2.693 N/A ARG 129.A NH2 ASP 136.A O no hydrogen 3.012 N/A ARG 130.A N GLY 127.A O no hydrogen 2.979 N/A ILE 131.A N PHE 128.A O no hydrogen 2.827 N/A THR 132.A N PHE 128.A O no hydrogen 3.120 N/A PHE 134.A N ASP 52.A O no hydrogen 3.051 N/A ASP 136.A N ASP 52.A OD2 no hydrogen 2.911 N/A ARG 137.A N ILE 135.A O no hydrogen 2.700 N/A ARG 137.A NE ASP 139.A OD1 no hydrogen 2.835 N/A ARG 137.A NH1 LYS 10.A O no hydrogen 3.503 N/A ARG 137.A NH2 LYS 10.A O no hydrogen 3.193 N/A ARG 137.A NH2 ASP 139.A OD1 no hydrogen 3.510 N/A ARG 137.A NH2 ASP 139.A OD2 no hydrogen 2.601 N/A ASP 139.A N ASP 139.A OD1 no hydrogen 2.553 N/A MET 140.A N ARG 137.A O no hydrogen 3.172 N/A ALA 142.A N LYS 185.A O no hydrogen 3.022 N/A LYS 143.A N ASN 17.A O no hydrogen 3.015 N/A TYR 144.A N ASP 181.A O no hydrogen 3.525 N/A ASP 145.A N VAL 19.A O no hydrogen 2.789 N/A VAL 146.A N PHE 179.A O no hydrogen 2.871 N/A THR 147.A N LEU 21.A O no hydrogen 2.679 N/A VAL 148.A N ALA 177.A O no hydrogen 2.894 N/A THR 149.A N ILE 23.A O no hydrogen 2.963 N/A THR 149.A OG1 ASN 24.A OD1 no hydrogen 2.540 N/A ALA 150.A N HIS 175.A O no hydrogen 3.115 N/A LYS 152.A N GLY 173.A O no hydrogen 2.995 N/A LYS 154.A N ASP 151.A OD2 no hydrogen 3.035 N/A TYR 155.A N ASP 151.A O no hydrogen 2.775 N/A VAL 157.A N GLY 195.A O no hydrogen 3.103 N/A LEU 159.A N VAL 193.A O no hydrogen 2.757 N/A SER 160.A OG ALA 191.A O no hydrogen 2.814 N/A ASN 161.A N SER 160.A OG no hydrogen 2.783 N/A ASN 161.A ND2 LEU 189.A O no hydrogen 3.141 N/A ASN 161.A ND2 LYS 270.A O no hydrogen 3.427 N/A ASP 163.A N ASN 180.A O no hydrogen 2.968 N/A LYS 164.A NZ GLU 167.A OE2 no hydrogen 2.313 N/A VAL 165.A N ARG 178.A O no hydrogen 2.709 N/A PHE 168.A N GLY 176.A O no hydrogen 2.936 N/A ILE 170.A N ARG 174.A O no hydrogen 2.853 N/A ARG 174.A N ILE 170.A O no hydrogen 3.323 N/A ARG 174.A NH1 ILE 25.A O no hydrogen 2.862 N/A ARG 174.A NH2 ILE 25.A O no hydrogen 3.187 N/A ARG 174.A NH2 THR 149.A OG1 no hydrogen 3.107 N/A HIS 175.A N ALA 150.A O no hydrogen 2.963 N/A HIS 175.A NE2 TYR 155.A O no hydrogen 2.712 N/A GLY 176.A N PHE 168.A O no hydrogen 2.721 N/A ALA 177.A N VAL 148.A O no hydrogen 2.941 N/A ARG 178.A N ASN 166.A O no hydrogen 2.839 N/A ARG 178.A NE ASP 145.A OD1 no hydrogen 2.821 N/A ARG 178.A NE ASP 145.A OD2 no hydrogen 3.226 N/A ARG 178.A NH2 ASP 145.A OD2 no hydrogen 2.616 N/A PHE 179.A N VAL 146.A O no hydrogen 2.816 N/A ASN 180.A N ASP 163.A O no hydrogen 2.956 N/A ASP 181.A N TYR 144.A O no hydrogen 2.983 N/A LYS 185.A N ALA 142.A O no hydrogen 2.983 N/A LYS 185.A NZ ASP 181.A OD2 no hydrogen 2.657 N/A CYS 187.A SG ASP 136.A OD1 no hydrogen 3.240 N/A LEU 189.A N PRO 186.A O no hydrogen 3.160 N/A PHE 190.A N CYS 187.A O no hydrogen 3.061 N/A ALA 191.A N ASN 161.A OD1 no hydrogen 3.055 N/A VAL 192.A N SER 121.A OG no hydrogen 3.072 N/A VAL 193.A N LEU 159.A O no hydrogen 2.748 N/A ALA 194.A N ILE 119.A O no hydrogen 2.867 N/A GLY 195.A N VAL 157.A O no hydrogen 3.058 N/A LYS 198.A N SER 219.A O no hydrogen 2.871 N/A LEU 200.A N VAL 217.A O no hydrogen 3.006 N/A ALA 202.A N LEU 215.A O no hydrogen 2.922 N/A TYR 204.A N VAL 213.A O no hydrogen 2.748 N/A TYR 204.A OH GLU 242.A OE1 no hydrogen 2.860 N/A THR 206.A N LYS 211.A O no hydrogen 3.080 N/A THR 206.A OG1 THR 209.A OG1 no hydrogen 3.165 N/A THR 206.A OG1 GLU 248.A OE1 no hydrogen 3.333 N/A THR 206.A OG1 GLU 248.A OE2 no hydrogen 3.182 N/A LYS 207.A N GLU 242.A OE2 no hydrogen 2.913 N/A LYS 207.A NZ ASP 243.A OD1 no hydrogen 2.530 N/A TYR 208.A N GLU 248.A OE2 no hydrogen 2.360 N/A THR 209.A N GLU 248.A OE2 no hydrogen 2.780 N/A THR 209.A OG1 THR 206.A OG1 no hydrogen 3.165 N/A THR 209.A OG1 GLU 248.A OE1 no hydrogen 2.831 N/A LYS 211.A N THR 206.A OG1 no hydrogen 3.172 N/A VAL 213.A N TYR 204.A O no hydrogen 2.689 N/A GLU 214.A N SER 252.A O no hydrogen 2.952 N/A LEU 215.A N ALA 202.A O no hydrogen 2.671 N/A TYR 216.A N LEU 254.A O no hydrogen 2.834 N/A VAL 217.A N LEU 200.A O no hydrogen 2.998 N/A PHE 218.A N LEU 256.A O no hydrogen 2.728 N/A SER 219.A N LYS 198.A O no hydrogen 2.953 N/A SER 219.A OG GLU 220.A O no hydrogen 2.998 N/A LYS 222.A NZ TYR 223.A OH no hydrogen 3.056 N/A LYS 222.A NZ ASP 757.A O no hydrogen 2.879 N/A TYR 223.A N GLU 220.A O no hydrogen 3.120 N/A VAL 224.A N GLU 221.A O no hydrogen 3.371 N/A LYS 226.A N TYR 223.A O no hydrogen 2.973 N/A LYS 226.A NZ ASP 758.A OD2 no hydrogen 2.707 N/A TRP 229.A NE1 TYR 292.A O no hydrogen 2.932 N/A LEU 231.A N LEU 227.A O no hydrogen 3.239 N/A GLU 232.A N GLN 228.A O no hydrogen 2.965 N/A CYS 233.A N TRP 229.A O no hydrogen 2.713 N/A CYS 233.A SG TRP 229.A O no hydrogen 3.323 N/A LEU 234.A N ALA 230.A O no hydrogen 2.924 N/A LYS 235.A N LEU 231.A O no hydrogen 3.109 N/A LYS 235.A NZ GLU 232.A OE2 no hydrogen 3.451 N/A LYS 236.A N GLU 232.A O no hydrogen 2.893 N/A SER 237.A N CYS 233.A O no hydrogen 2.849 N/A SER 237.A OG CYS 233.A O no hydrogen 2.865 N/A MET 238.A N LEU 234.A O no hydrogen 3.010 N/A ALA 239.A N LYS 235.A O no hydrogen 3.122 N/A PHE 240.A N LYS 236.A O no hydrogen 3.007 N/A ASP 241.A N SER 237.A O no hydrogen 3.127 N/A GLU 242.A N MET 238.A O no hydrogen 3.137 N/A ASP 243.A N ALA 239.A O no hydrogen 2.851 N/A TYR 244.A N PHE 240.A O no hydrogen 2.774 N/A PHE 245.A N ASP 241.A O no hydrogen 3.096 N/A GLY 246.A N GLU 242.A O no hydrogen 2.778 N/A LEU 247.A N ASP 241.A O no hydrogen 2.980 N/A TYR 249.A OH ARG 253.A O no hydrogen 2.865 N/A ARG 253.A NE ASN 255.A OD1 no hydrogen 2.922 N/A ARG 253.A NH2 ASN 255.A OD1 no hydrogen 2.945 N/A LEU 254.A N GLU 214.A O no hydrogen 2.872 N/A ASN 255.A N GLY 271.A O no hydrogen 2.985 N/A LEU 256.A N TYR 216.A O no hydrogen 2.843 N/A VAL 257.A N ASN 273.A O no hydrogen 2.803 N/A ALA 258.A N PHE 218.A O no hydrogen 2.979 N/A VAL 259.A N PHE 275.A O no hydrogen 2.902 N/A SER 260.A OG GLU 759.A OE1 no hydrogen 2.749 N/A SER 260.A OG GLU 759.A OE2 no hydrogen 3.240 N/A ASP 261.A N SER 115.A OG no hydrogen 2.839 N/A ASN 263.A ND2 ALA 108.A O no hydrogen 3.026 N/A MET 267.A N ILE 274.A O no hydrogen 2.769 N/A GLU 268.A N GLU 268.A OE1 no hydrogen 2.671 N/A ASN 269.A N ASN 273.A OD1 no hydrogen 3.442 N/A ASN 269.A ND2 LEU 272.A O no hydrogen 3.067 N/A GLY 271.A N GLN 306.A OE1 no hydrogen 2.840 N/A LEU 272.A N ASN 269.A O no hydrogen 2.940 N/A ASN 273.A N ASN 255.A O no hydrogen 2.713 N/A ILE 274.A N MET 267.A O no hydrogen 2.959 N/A PHE 275.A N VAL 257.A O no hydrogen 2.753 N/A ASN 276.A N GLY 265.A O no hydrogen 2.776 N/A ASN 276.A ND2 VAL 264.A O no hydrogen 3.386 N/A ASN 276.A ND2 ASN 796.A OD1 no hydrogen 2.956 N/A ALA 277.A N VAL 259.A O no hydrogen 2.768 N/A ASN 278.A N ASN 276.A OD1 no hydrogen 2.856 N/A SER 279.A N ASN 276.A O no hydrogen 2.787 N/A SER 279.A OG ASN 278.A OD1 no hydrogen 2.954 N/A LEU 280.A N ALA 277.A O no hydrogen 3.137 N/A LEU 281.A N ALA 277.A O no hydrogen 2.962 N/A ALA 282.A N LYS 226.A O no hydrogen 2.920 N/A SER 283.A N SER 287.A OG no hydrogen 3.117 N/A LYS 284.A NZ TYR 682.A O no hydrogen 2.944 N/A LYS 284.A NZ ASP 685.A O no hydrogen 3.138 N/A LYS 284.A NZ HIS 688.A O no hydrogen 3.048 N/A ASN 286.A N SER 283.A OG no hydrogen 3.007 N/A SER 287.A OG SER 283.A O no hydrogen 3.380 N/A ASP 289.A N SER 729.A OG no hydrogen 2.775 N/A SER 291.A N ILE 288.A O no hydrogen 3.112 N/A TYR 292.A N ASP 289.A O no hydrogen 3.033 N/A ARG 294.A N PHE 290.A O no hydrogen 3.044 N/A ARG 294.A NE SER 279.A OG no hydrogen 2.886 N/A ARG 294.A NH2 SER 279.A OG no hydrogen 3.372 N/A ILE 295.A N SER 291.A O no hydrogen 2.854 N/A LEU 296.A N TYR 292.A O no hydrogen 3.129 N/A THR 297.A N ALA 293.A O no hydrogen 2.994 N/A THR 297.A OG1 ALA 293.A O no hydrogen 3.534 N/A THR 297.A OG1 ARG 294.A O no hydrogen 3.125 N/A VAL 298.A N ARG 294.A O no hydrogen 2.995 N/A VAL 299.A N ILE 295.A O no hydrogen 2.785 N/A GLY 300.A N LEU 296.A O no hydrogen 2.967 N/A HIS 301.A N THR 297.A O no hydrogen 2.684 N/A HIS 301.A ND1 GLU 331.A OE1 no hydrogen 2.834 N/A GLU 302.A N VAL 298.A O no hydrogen 3.014 N/A TYR 303.A N VAL 299.A O no hydrogen 3.017 N/A PHE 304.A N GLY 300.A O no hydrogen 2.913 N/A HIS 305.A N HIS 301.A O no hydrogen 3.287 N/A GLN 306.A N TYR 303.A O no hydrogen 2.885 N/A GLN 306.A NE2 GLU 302.A O no hydrogen 3.449 N/A THR 308.A OG1 PHE 304.A O no hydrogen 3.441 N/A THR 308.A OG1 HIS 305.A O no hydrogen 3.371 N/A GLY 309.A N HIS 305.A O no hydrogen 2.607 N/A ASN 310.A N GLN 306.A O no hydrogen 3.082 N/A ASN 310.A ND2 ASP 250.A OD2 no hydrogen 2.818 N/A ARG 311.A NE.B ASN 415.A O no hydrogen 2.555 N/A ARG 311.A NH1.A ASP 250.A OD1 no hydrogen 3.422 N/A ARG 311.A NH1.A ASP 250.A OD2 no hydrogen 3.145 N/A ARG 311.A NH1.A TYR 307.A O no hydrogen 2.924 N/A ARG 311.A NH2.A ASP 250.A OD1 no hydrogen 2.628 N/A VAL 312.A N THR 308.A O no hydrogen 3.240 N/A ARG 315.A N ALA 417.A O no hydrogen 3.369 N/A GLN 319.A N ASP 316.A O no hydrogen 2.938 N/A GLN 319.A NE2 ASP 316.A OD1 no hydrogen 3.232 N/A LEU 320.A N TRP 317.A O no hydrogen 3.067 N/A THR 321.A OG1 VAL 384.A O no hydrogen 2.789 N/A LEU 322.A N GLN 319.A O no hydrogen 2.859 N/A LYS 323.A NZ GLU 124.A OE1 no hydrogen 3.288 N/A LYS 323.A NZ GLU 124.A OE2 no hydrogen 2.648 N/A LYS 323.A NZ GLU 324.A OE2 no hydrogen 2.634 N/A GLU 324.A N LEU 320.A O no hydrogen 2.735 N/A GLY 325.A N THR 321.A O no hydrogen 2.626 N/A THR 327.A N LYS 323.A O no hydrogen 3.312 N/A THR 327.A OG1 LYS 323.A O no hydrogen 2.860 N/A VAL 328.A N GLU 324.A O no hydrogen 2.918 N/A HIS 329.A N GLY 325.A O no hydrogen 3.052 N/A ARG 330.A N LEU 326.A O no hydrogen 2.956 N/A ARG 330.A NH1 ASP 241.A OD1 no hydrogen 3.102 N/A ARG 330.A NH2 ASP 241.A OD1 no hydrogen 3.218 N/A ARG 330.A NH2 ASP 241.A OD2 no hydrogen 3.000 N/A ARG 330.A NH2 PHE 304.A O no hydrogen 3.055 N/A GLU 331.A N THR 327.A O no hydrogen 2.726 N/A ASN 332.A N VAL 328.A O no hydrogen 2.738 N/A LEU 333.A N HIS 329.A O no hydrogen 2.989 N/A PHE 334.A N ARG 330.A O no hydrogen 2.953 N/A SER 335.A N GLU 331.A O no hydrogen 2.892 N/A SER 335.A OG GLU 331.A O no hydrogen 3.362 N/A GLU 336.A N ASN 332.A O no hydrogen 2.956 N/A GLU 337.A N LEU 333.A O no hydrogen 3.036 N/A MET 338.A N PHE 334.A O no hydrogen 2.787 N/A THR 339.A N SER 335.A O no hydrogen 2.845 N/A THR 339.A OG1 SER 335.A O no hydrogen 2.813 N/A THR 339.A OG1 GLU 336.A O no hydrogen 3.549 N/A THR 339.A OG1 THR 344.A OG1 no hydrogen 2.637 N/A LYS 340.A N GLU 336.A O no hydrogen 3.040 N/A LYS 340.A NZ GLU 337.A OE1 no hydrogen 3.528 N/A THR 341.A OG1 THR 344.A OG1 no hydrogen 3.080 N/A THR 344.A N THR 341.A O no hydrogen 3.275 N/A THR 344.A OG1 THR 339.A OG1 no hydrogen 2.637 N/A THR 344.A OG1 THR 341.A O no hydrogen 3.431 N/A THR 344.A OG1 THR 341.A OG1 no hydrogen 3.080 N/A ARG 345.A NE GLY 537.A O no hydrogen 2.897 N/A ARG 345.A NH1 GLU 390.A OE2 no hydrogen 2.865 N/A ARG 345.A NH2 GLU 390.A OE1 no hydrogen 2.840 N/A ARG 345.A NH2 GLY 537.A O no hydrogen 3.015 N/A ARG 345.A NH2 PHE 538.A O no hydrogen 3.023 N/A LEU 346.A N VAL 342.A O no hydrogen 3.254 N/A SER 347.A N THR 343.A O no hydrogen 2.884 N/A SER 347.A OG THR 343.A O no hydrogen 3.407 N/A SER 347.A OG THR 344.A O no hydrogen 2.812 N/A HIS 348.A N THR 344.A O no hydrogen 3.304 N/A VAL 349.A N ARG 345.A O no hydrogen 3.105 N/A ASP 350.A N LEU 346.A O no hydrogen 2.789 N/A LEU 351.A N SER 347.A O no hydrogen 3.021 N/A LEU 352.A N HIS 348.A O no hydrogen 2.955 N/A ARG 353.A N VAL 349.A O no hydrogen 2.962 N/A ARG 353.A NH1 ASN 568.A OD1 no hydrogen 2.792 N/A ARG 353.A NH2 ASN 568.A OD1 no hydrogen 2.894 N/A SER 354.A N ASP 350.A O no hydrogen 3.238 N/A SER 354.A OG ASP 350.A O no hydrogen 2.580 N/A SER 354.A OG LEU 351.A O no hydrogen 3.312 N/A VAL 355.A N LEU 351.A O no hydrogen 3.007 N/A GLN 356.A NE2 ASP 360.A OD2 no hydrogen 3.080 N/A GLN 356.A NE2 THR 383.A OG1 no hydrogen 3.027 N/A PHE 357.A N LEU 352.A O no hydrogen 2.888 N/A LEU 358.A N SER 354.A O no hydrogen 3.194 N/A GLU 359.A N VAL 355.A O no hydrogen 3.103 N/A ASP 360.A N GLN 356.A O no hydrogen 2.846 N/A SER 361.A N PHE 357.A O no hydrogen 3.169 N/A SER 361.A N LEU 358.A O no hydrogen 3.282 N/A SER 361.A OG PHE 357.A O no hydrogen 3.417 N/A SER 361.A OG LEU 358.A O no hydrogen 3.493 N/A SER 362.A N GLU 359.A O no hydrogen 3.103 N/A SER 362.A OG GLU 359.A O no hydrogen 2.792 N/A LEU 364.A N SER 362.A OG no hydrogen 3.029 N/A SER 365.A N SER 362.A O no hydrogen 3.073 N/A SER 365.A OG ASP 360.A O no hydrogen 3.012 N/A SER 365.A OG ASP 360.A OD1 no hydrogen 2.832 N/A HIS 366.A ND1 LEU 364.A O no hydrogen 2.749 N/A HIS 366.A NE2 THR 381.A OG1 no hydrogen 2.767 N/A ARG 369.A N PHE 448.A O no hydrogen 3.033 N/A ARG 369.A NH1 GLU 420.A OE1 no hydrogen 2.584 N/A ARG 369.A NH1 GLU 420.A OE2 no hydrogen 2.889 N/A ARG 369.A NH2 GLU 420.A OE2 no hydrogen 3.144 N/A TYR 373.A N HIS 4.A O no hydrogen 3.012 N/A SER 375.A OG GLU 377.A OE1 no hydrogen 3.195 N/A SER 375.A OG ASN 875.A OD1 no hydrogen 2.387 N/A GLU 377.A N GLU 377.A OE1 no hydrogen 2.315 N/A ASN 378.A N SER 375.A O no hydrogen 2.997 N/A ASN 378.A ND2 ASN 875.A O no hydrogen 3.214 N/A ASN 378.A ND2 GLU 878.A OE1 no hydrogen 2.277 N/A PHE 379.A N MET 376.A O no hydrogen 3.049 N/A TYR 380.A OH GLU 124.A OE2 no hydrogen 2.672 N/A THR 381.A OG1 HIS 366.A NE2 no hydrogen 2.767 N/A THR 382.A OG1 ASP 386.A OD2 no hydrogen 2.657 N/A THR 383.A N GLU 359.A OE1 no hydrogen 3.099 N/A THR 383.A OG1 GLU 359.A OE1 no hydrogen 2.537 N/A VAL 384.A N THR 381.A OG1 no hydrogen 3.062 N/A TYR 385.A N THR 381.A O no hydrogen 2.868 N/A ASP 386.A N THR 382.A O no hydrogen 2.688 N/A LYS 387.A N THR 382.A O no hydrogen 3.223 N/A LYS 387.A NZ ASP 360.A OD2 no hydrogen 3.555 N/A LYS 387.A NZ GLY 452.A O no hydrogen 3.197 N/A GLY 388.A N THR 383.A O no hydrogen 3.072 N/A SER 389.A N TYR 385.A O no hydrogen 2.891 N/A SER 389.A OG TYR 385.A O no hydrogen 3.413 N/A SER 389.A OG ASP 386.A O no hydrogen 2.646 N/A GLU 390.A N ASP 386.A O no hydrogen 3.075 N/A VAL 391.A N LYS 387.A O no hydrogen 2.920 N/A MET 392.A N GLY 388.A O no hydrogen 2.914 N/A ARG 393.A N SER 389.A O no hydrogen 2.638 N/A MET 394.A N GLU 390.A O no hydrogen 2.935 N/A TYR 395.A OH ASN 423.A OD1 no hydrogen 2.458 N/A THR 397.A N ARG 393.A O no hydrogen 3.144 N/A THR 397.A OG1 ARG 393.A O no hydrogen 3.520 N/A ILE 398.A N MET 394.A O no hydrogen 2.847 N/A LEU 399.A N TYR 395.A O no hydrogen 2.880 N/A GLY 400.A N LEU 396.A O no hydrogen 2.650 N/A TYR 404.A N GLY 400.A O no hydrogen 2.858 N/A LYS 405.A N GLU 401.A O no hydrogen 2.923 N/A LYS 406.A N GLU 402.A O no hydrogen 3.093 N/A GLY 407.A N TYR 403.A O no hydrogen 2.874 N/A PHE 408.A N TYR 404.A O no hydrogen 2.831 N/A ASP 409.A N LYS 405.A O no hydrogen 3.163 N/A ILE 410.A N LYS 406.A O no hydrogen 3.049 N/A TYR 411.A N GLY 407.A O no hydrogen 3.061 N/A ILE 412.A N PHE 408.A O no hydrogen 3.146 N/A LYS 413.A N ASP 409.A O no hydrogen 2.966 N/A LYS 414.A N ILE 410.A O no hydrogen 2.788 N/A ASN 415.A N TYR 411.A O no hydrogen 3.212 N/A ASN 415.A ND2 TYR 411.A O no hydrogen 2.818 N/A ALA 417.A N THR 313.A O no hydrogen 2.716 N/A THR 418.A N ASP 421.A OD2 no hydrogen 2.810 N/A THR 418.A OG1 GLU 420.A OE1 no hydrogen 3.301 N/A THR 418.A OG1 ASP 421.A OD2 no hydrogen 3.244 N/A CYS 419.A N GLN 319.A OE1 no hydrogen 3.078 N/A CYS 419.A SG GLN 319.A OE1 no hydrogen 3.581 N/A GLU 420.A N GLU 420.A OE1 no hydrogen 2.516 N/A ASP 421.A N THR 418.A O no hydrogen 2.968 N/A ASP 421.A N THR 418.A OG1 no hydrogen 3.359 N/A PHE 422.A N THR 418.A O no hydrogen 3.480 N/A ASN 423.A N CYS 419.A O no hydrogen 3.009 N/A ASN 423.A ND2 LEU 441.A O no hydrogen 3.019 N/A TYR 424.A N GLU 420.A O no hydrogen 2.818 N/A ALA 425.A N ASP 421.A O no hydrogen 3.004 N/A MET 426.A N PHE 422.A O no hydrogen 2.932 N/A GLU 427.A N ASN 423.A O no hydrogen 2.653 N/A GLN 428.A N TYR 424.A O no hydrogen 2.994 N/A GLN 428.A NE2 TYR 424.A O no hydrogen 3.544 N/A ALA 429.A N ALA 425.A O no hydrogen 3.397 N/A TYR 430.A N MET 426.A O no hydrogen 2.861 N/A TYR 430.A OH GLU 513.A OE1 no hydrogen 2.763 N/A LYS 431.A N GLU 427.A O no hydrogen 2.813 N/A LYS 431.A NZ ASN 437.A O no hydrogen 2.579 N/A LYS 431.A NZ ALA 439.A O no hydrogen 2.718 N/A MET 432.A N GLN 428.A O no hydrogen 3.128 N/A LYS 433.A N ALA 429.A O no hydrogen 2.844 N/A LYS 433.A NZ LEU 399.A O no hydrogen 2.843 N/A LYS 434.A N TYR 430.A O no hydrogen 3.024 N/A LYS 434.A NZ GLU 513.A OE2 no hydrogen 3.424 N/A ASP 436.A N LYS 431.A O no hydrogen 3.181 N/A SER 438.A N ASP 436.A OD2 no hydrogen 2.744 N/A SER 438.A OG ASP 436.A OD2 no hydrogen 2.174 N/A ALA 439.A N ASP 436.A O no hydrogen 2.871 N/A LEU 441.A N GLU 427.A OE1 no hydrogen 2.734 N/A ASN 442.A N ASN 440.A OD1 no hydrogen 2.915 N/A GLN 443.A NE2 PRO 488.A O no hydrogen 2.799 N/A GLN 443.A NE2 THR 515.A O no hydrogen 2.804 N/A TYR 444.A N LEU 441.A O no hydrogen 3.051 N/A TYR 444.A OH VAL 391.A O no hydrogen 2.672 N/A LEU 445.A N ASN 442.A O no hydrogen 3.240 N/A LEU 446.A N GLN 443.A O no hydrogen 2.986 N/A TRP 447.A N TYR 444.A O no hydrogen 2.867 N/A TRP 447.A NE1 PHE 490.A O no hydrogen 2.818 N/A PHE 448.A N LEU 445.A O no hydrogen 2.869 N/A SER 449.A N LEU 446.A O no hydrogen 3.250 N/A GLN 450.A N LEU 446.A O no hydrogen 2.836 N/A GLN 450.A NE2 LYS 487.A O no hydrogen 3.324 N/A SER 451.A N GLN 483.A OE1 no hydrogen 3.299 N/A SER 451.A OG ASP 480.A OD2 no hydrogen 2.661 N/A GLY 452.A N ASP 360.A OD1 no hydrogen 2.912 N/A HIS 455.A N TYR 476.A O no hydrogen 2.669 N/A VAL 456.A N TYR 543.A O no hydrogen 2.806 N/A SER 457.A N ASN 474.A O no hydrogen 2.917 N/A LYS 459.A N HIS 472.A O no hydrogen 2.907 N/A TYR 460.A OH ASP 546.A O no hydrogen 2.625 N/A ASN 461.A N SER 470.A O no hydrogen 3.109 N/A TYR 462.A OH ILE 526.A O no hydrogen 2.446 N/A ASP 463.A N GLN 468.A O no hydrogen 2.950 N/A LYS 466.A N ASP 463.A OD1 no hydrogen 3.023 N/A LYS 466.A NZ ASP 463.A OD2 no hydrogen 3.398 N/A LYS 467.A N ALA 464.A O no hydrogen 3.369 N/A LYS 467.A NZ ALA 464.A O no hydrogen 3.114 N/A GLN 468.A N ASP 463.A O no hydrogen 3.290 N/A GLN 468.A NE2 ASN 524.A OD1 no hydrogen 2.921 N/A TYR 469.A N PHE 523.A O no hydrogen 2.882 N/A SER 470.A N ASN 461.A O no hydrogen 2.826 N/A ILE 471.A N PHE 521.A O no hydrogen 2.788 N/A HIS 472.A N LYS 459.A O no hydrogen 2.765 N/A HIS 472.A ND1.B THR 520.A OG1 no hydrogen 3.068 N/A VAL 473.A N ASP 519.A O no hydrogen 2.847 N/A ASN 474.A N SER 457.A O no hydrogen 2.926 N/A GLN 475.A N GLU 517.A O no hydrogen 2.889 N/A GLN 475.A NE2 LEU 489.A O no hydrogen 2.836 N/A GLN 475.A NE2 LYS 516.A O no hydrogen 3.056 N/A TYR 476.A N HIS 455.A O no hydrogen 3.003 N/A ASP 480.A N GLN 483.A O no hydrogen 3.339 N/A ASN 482.A N ASP 480.A OD1 no hydrogen 2.870 N/A ASN 482.A ND2 SER 365.A O no hydrogen 2.963 N/A ASN 482.A ND2 SER 451.A OG no hydrogen 2.845 N/A GLN 483.A N ASP 480.A OD1 no hydrogen 3.182 N/A GLN 483.A NE2 SER 449.A O no hydrogen 3.038 N/A LYS 486.A NZ SER 451.A O no hydrogen 3.041 N/A LYS 486.A NZ ASP 480.A OD1 no hydrogen 2.813 N/A LYS 486.A NZ ASP 480.A OD2 no hydrogen 3.073 N/A LYS 486.A NZ GLN 483.A OE1 no hydrogen 2.753 N/A LYS 487.A N GLN 450.A OE1 no hydrogen 2.968 N/A LEU 489.A N GLN 475.A OE1 no hydrogen 2.737 N/A ILE 491.A N LEU 514.A O no hydrogen 2.743 N/A ILE 493.A N LEU 512.A O no hydrogen 2.684 N/A SER 494.A N SER 539.A OG no hydrogen 3.040 N/A VAL 495.A N THR 510.A O no hydrogen 2.889 N/A GLY 496.A N SER 533.A O no hydrogen 2.931 N/A ILE 498.A N ILE 531.A O no hydrogen 2.902 N/A ASN 499.A N LYS 504.A O no hydrogen 2.876 N/A GLU 501.A N ASN 499.A OD1 no hydrogen 2.735 N/A GLY 503.A N ASN 499.A O no hydrogen 2.769 N/A LYS 504.A N ASN 502.A OD1 no hydrogen 2.916 N/A MET 506.A N LEU 497.A O no hydrogen 2.734 N/A THR 510.A OG1 SER 508.A O no hydrogen 2.832 N/A LEU 512.A N ILE 493.A O no hydrogen 2.796 N/A LEU 514.A N ILE 491.A O no hydrogen 2.891 N/A SER 518.A OG GLU 517.A OE2 no hydrogen 3.398 N/A ASP 519.A N VAL 473.A O no hydrogen 3.005 N/A THR 520.A N ASP 519.A OD1 no hydrogen 2.891 N/A THR 520.A OG1 HIS 472.A ND1.B no hydrogen 3.068 N/A PHE 521.A N ILE 471.A O no hydrogen 2.857 N/A PHE 523.A N TYR 469.A O no hydrogen 2.717 N/A ILE 526.A N LYS 467.A O no hydrogen 2.902 N/A ILE 531.A N ILE 498.A O no hydrogen 2.890 N/A SER 533.A N GLY 496.A O no hydrogen 2.859 N/A SER 533.A OG ASP 560.A OD1 no hydrogen 3.284 N/A SER 533.A OG ASP 560.A OD2 no hydrogen 2.509 N/A ARG 536.A N SER 494.A O no hydrogen 2.918 N/A ARG 536.A NE SER 533.A OG no hydrogen 2.753 N/A ARG 536.A NH1 GLU 505.A OE1 no hydrogen 2.997 N/A ARG 536.A NH2 GLU 505.A OE1 no hydrogen 2.858 N/A ARG 536.A NH2 GLU 505.A OE2 no hydrogen 3.200 N/A ARG 536.A NH2 ASP 560.A OD1 no hydrogen 2.922 N/A GLY 537.A N ASP 562.A OD2 no hydrogen 2.948 N/A PHE 538.A N PHE 535.A O no hydrogen 2.759 N/A SER 539.A OG PRO 492.A O no hydrogen 2.940 N/A TYR 543.A N PRO 454.A O no hydrogen 2.877 N/A GLU 545.A N VAL 456.A O no hydrogen 2.848 N/A LEU 548.A N ASP 546.A OD1 no hydrogen 2.864 N/A THR 549.A N GLU 552.A OE1 no hydrogen 2.985 N/A THR 549.A OG1 GLU 552.A OE1 no hydrogen 3.380 N/A GLU 552.A N THR 549.A OG1 no hydrogen 3.128 N/A ARG 553.A N THR 549.A O no hydrogen 2.944 N/A ARG 553.A NE ASP 546.A OD1 no hydrogen 3.180 N/A ARG 553.A NE ASP 546.A OD2 no hydrogen 3.113 N/A ARG 553.A NH1 ASP 550.A OD1 no hydrogen 3.130 N/A ARG 553.A NH2 ASP 546.A OD1 no hydrogen 2.675 N/A ILE 554.A N ASP 550.A O no hydrogen 2.735 N/A LEU 555.A N GLU 551.A O no hydrogen 3.084 N/A LEU 556.A N GLU 552.A O no hydrogen 2.982 N/A LEU 557.A N ARG 553.A O no hydrogen 2.827 N/A LYS 558.A N ILE 554.A O no hydrogen 2.944 N/A LYS 558.A NZ TYR 559.A OH no hydrogen 3.274 N/A TYR 559.A N LEU 555.A O no hydrogen 2.917 N/A ASP 560.A N LEU 556.A O no hydrogen 2.841 N/A SER 561.A N ASP 560.A OD1 no hydrogen 2.705 N/A SER 561.A OG GLU 505.A OE2 no hydrogen 2.590 N/A VAL 565.A N ASP 562.A OD2 no hydrogen 3.079 N/A ARG 566.A N ASP 562.A O no hydrogen 3.133 N/A ARG 566.A NE LEU 557.A O no hydrogen 2.816 N/A ARG 566.A NH2 LEU 557.A O no hydrogen 3.019 N/A TYR 567.A N ALA 563.A O no hydrogen 2.972 N/A TYR 567.A OH ASP 350.A OD1 no hydrogen 2.243 N/A ASN 568.A N PHE 564.A O no hydrogen 2.630 N/A SER 569.A N VAL 565.A O no hydrogen 2.807 N/A SER 569.A OG VAL 565.A O no hydrogen 2.803 N/A CYS 570.A N ARG 566.A O no hydrogen 3.019 N/A CYS 570.A SG ILE 626.A O no hydrogen 3.878 N/A THR 571.A N TYR 567.A O no hydrogen 2.897 N/A THR 571.A OG1 TYR 567.A O no hydrogen 2.867 N/A ASN 572.A N ASN 568.A O no hydrogen 2.767 N/A ASN 572.A ND2 ASP 546.A OD2 no hydrogen 2.980 N/A ILE 573.A N SER 569.A O no hydrogen 3.062 N/A TYR 574.A N CYS 570.A O no hydrogen 2.948 N/A TYR 574.A OH ILE 626.A O no hydrogen 2.704 N/A MET 575.A N THR 571.A O no hydrogen 2.771 N/A LYS 576.A N ASN 572.A O no hydrogen 3.050 N/A GLN 577.A N ILE 573.A O no hydrogen 3.176 N/A GLN 577.A NE2 ASN 581.A OD1 no hydrogen 2.513 N/A GLN 577.A NE2 THR 599.A O no hydrogen 2.859 N/A ILE 578.A N TYR 574.A O no hydrogen 2.798 N/A LEU 579.A N MET 575.A O no hydrogen 2.923 N/A MET 580.A N LYS 576.A O no hydrogen 3.069 N/A ASN 581.A N GLN 577.A O no hydrogen 2.890 N/A ASN 581.A ND2 GLU 584.A OE1 no hydrogen 2.976 N/A ASN 581.A ND2 THR 599.A O no hydrogen 3.004 N/A TYR 582.A N ILE 578.A O no hydrogen 2.754 N/A ASN 583.A N LEU 579.A O no hydrogen 3.060 N/A GLU 584.A N MET 580.A O no hydrogen 3.047 N/A PHE 585.A N ASN 581.A O no hydrogen 2.858 N/A LEU 586.A N TYR 582.A O no hydrogen 2.798 N/A LYS 587.A N ASN 583.A O no hydrogen 2.962 N/A ALA 588.A N GLU 584.A O no hydrogen 3.169 N/A LYS 589.A N PHE 585.A O no hydrogen 3.080 N/A LYS 589.A NZ ASP 643.A OD2 no hydrogen 2.753 N/A ASN 590.A N LEU 586.A O no hydrogen 2.826 N/A GLU 591.A N LYS 587.A O no hydrogen 2.831 N/A LYS 592.A N LYS 589.A O no hydrogen 3.395 N/A LEU 593.A N ALA 588.A O no hydrogen 2.900 N/A THR 599.A N GLU 584.A OE1 no hydrogen 3.051 N/A THR 599.A OG1 GLU 584.A OE2 no hydrogen 2.557 N/A VAL 601.A N GLN 657.A OE1 no hydrogen 2.908 N/A PHE 605.A N ASN 602.A OD1 no hydrogen 2.972 N/A ILE 606.A N ASN 602.A O no hydrogen 3.133 N/A ASP 607.A N ALA 603.A O no hydrogen 2.921 N/A ALA 608.A N GLN 604.A O no hydrogen 2.976 N/A ILE 609.A N PHE 605.A O no hydrogen 3.000 N/A LYS 610.A N ILE 606.A O no hydrogen 3.085 N/A LYS 610.A NZ GLU 614.A OE1 no hydrogen 3.233 N/A LYS 610.A NZ GLU 614.A OE2 no hydrogen 3.420 N/A TYR 611.A N ASP 607.A O no hydrogen 2.882 N/A LEU 612.A N ALA 608.A O no hydrogen 3.012 N/A LEU 613.A N ILE 609.A O no hydrogen 2.862 N/A GLU 614.A N LYS 610.A O no hydrogen 2.883 N/A ASP 615.A N LEU 612.A O no hydrogen 3.152 N/A HIS 617.A N ASP 615.A OD1 no hydrogen 2.993 N/A ALA 618.A N ASP 615.A O no hydrogen 3.024 N/A PHE 622.A N ASP 619.A OD2 no hydrogen 2.922 N/A LYS 623.A N ASP 619.A O no hydrogen 2.980 N/A LYS 623.A NZ LEU 613.A O no hydrogen 2.667 N/A LYS 623.A NZ ASP 615.A O no hydrogen 2.924 N/A SER 624.A N ALA 620.A O no hydrogen 3.085 N/A SER 624.A N GLY 621.A O no hydrogen 3.063 N/A SER 624.A OG GLY 621.A O no hydrogen 2.781 N/A TYR 625.A N GLY 621.A O no hydrogen 3.298 N/A ILE 626.A N PHE 622.A O no hydrogen 3.157 N/A SER 628.A N TYR 625.A O no hydrogen 3.288 N/A SER 628.A OG SER 624.A O no hydrogen 2.738 N/A LEU 629.A N TYR 655.A OH no hydrogen 2.897 N/A TYR 634.A N GLN 631.A O no hydrogen 2.943 N/A ILE 635.A N GLN 631.A O no hydrogen 2.891 N/A ILE 636.A N ASP 632.A O no hydrogen 2.940 N/A ASN 637.A N TYR 634.A O no hydrogen 3.250 N/A PHE 638.A N ILE 635.A O no hydrogen 2.892 N/A VAL 639.A N ILE 636.A O no hydrogen 3.318 N/A LEU 642.A N LYS 850.A O no hydrogen 2.838 N/A ASP 643.A N TYR 582.A OH no hydrogen 2.901 N/A VAL 646.A N ASP 643.A OD1 no hydrogen 3.084 N/A LEU 647.A N ASP 643.A O no hydrogen 2.943 N/A ALA 648.A N THR 644.A O no hydrogen 2.879 N/A ASP 649.A N ASP 645.A O no hydrogen 2.984 N/A THR 650.A N VAL 646.A O no hydrogen 2.980 N/A THR 650.A OG1 VAL 646.A O no hydrogen 2.891 N/A LYS 651.A N LEU 647.A O no hydrogen 2.945 N/A LYS 651.A NZ ASP 632.A OD1 no hydrogen 2.928 N/A LYS 651.A NZ ASP 632.A OD2 no hydrogen 3.176 N/A GLU 652.A N ALA 648.A O no hydrogen 3.102 N/A TYR 653.A N ASP 649.A O no hydrogen 3.013 N/A ILE 654.A N THR 650.A O no hydrogen 3.099 N/A TYR 655.A N LYS 651.A O no hydrogen 2.816 N/A LYS 656.A N GLU 652.A O no hydrogen 2.924 N/A LYS 656.A NZ ASP 660.A OD1 no hydrogen 3.170 N/A LYS 656.A NZ ASP 660.A OD2 no hydrogen 3.374 N/A GLN 657.A N TYR 653.A O no hydrogen 2.882 N/A ILE 658.A N ILE 654.A O no hydrogen 3.108 N/A GLY 659.A N TYR 655.A O no hydrogen 2.959 N/A ASP 660.A N LYS 656.A O no hydrogen 2.769 N/A LYS 661.A N ILE 658.A O no hydrogen 3.072 N/A LEU 662.A N ILE 658.A O no hydrogen 2.798 N/A ASN 663.A N GLY 659.A O no hydrogen 2.940 N/A TYR 666.A N LEU 662.A O no hydrogen 2.845 N/A TYR 667.A N ASN 663.A O no hydrogen 2.794 N/A TYR 667.A OH GLU 718.A OE2 no hydrogen 2.386 N/A LYS 668.A N ASP 664.A O no hydrogen 2.969 N/A MET 669.A N VAL 665.A O no hydrogen 3.078 N/A PHE 670.A N TYR 666.A O no hydrogen 2.930 N/A LYS 671.A N TYR 667.A O no hydrogen 3.112 N/A LYS 671.A NZ GLU 718.A OE2 no hydrogen 3.509 N/A SER 672.A N LYS 668.A O no hydrogen 3.041 N/A SER 672.A OG LYS 668.A O no hydrogen 3.366 N/A SER 672.A OG MET 669.A O no hydrogen 3.481 N/A LEU 673.A N MET 669.A O no hydrogen 2.893 N/A GLU 674.A N LYS 671.A O no hydrogen 3.366 N/A ALA 677.A N LEU 673.A O no hydrogen 2.934 N/A ASP 678.A N GLU 674.A O no hydrogen 2.901 N/A THR 681.A N ASP 679.A OD2 no hydrogen 3.245 N/A THR 681.A OG1 ASP 679.A OD1 no hydrogen 3.393 N/A THR 681.A OG1 ASP 679.A OD2 no hydrogen 2.737 N/A PHE 683.A N LEU 680.A O no hydrogen 3.097 N/A ASP 685.A N TYR 682.A O no hydrogen 3.079 N/A SER 687.A N ASP 685.A OD1 no hydrogen 2.970 N/A SER 687.A OG GLU 232.A OE2 no hydrogen 3.197 N/A HIS 688.A N ASP 685.A O no hydrogen 3.329 N/A GLN 693.A N ASP 690.A OD1 no hydrogen 2.974 N/A GLN 693.A NE2 LYS 676.A O no hydrogen 3.294 N/A GLN 693.A NE2 ALA 677.A O no hydrogen 3.063 N/A GLN 693.A NE2 ASP 679.A O no hydrogen 2.947 N/A MET 694.A N ASP 690.A O no hydrogen 3.080 N/A ASN 695.A N PHE 691.A O no hydrogen 2.997 N/A ASN 695.A ND2 THR 343.A OG1 no hydrogen 3.194 N/A MET 696.A N ASP 692.A O no hydrogen 2.984 N/A ARG 697.A N GLN 693.A O no hydrogen 3.111 N/A ARG 697.A NE ASP 289.A OD1 no hydrogen 3.442 N/A ARG 697.A NE ASP 289.A OD2 no hydrogen 2.795 N/A ARG 697.A NH1 ALA 677.A O no hydrogen 2.828 N/A ARG 697.A NH2 ASP 289.A OD1 no hydrogen 2.955 N/A ARG 697.A NH2 ASP 289.A OD2 no hydrogen 3.430 N/A THR 698.A N MET 694.A O no hydrogen 2.908 N/A THR 698.A OG1 MET 694.A O no hydrogen 3.084 N/A LEU 699.A N ASN 695.A O no hydrogen 2.891 N/A ARG 700.A N MET 696.A O no hydrogen 2.914 N/A ARG 700.A NE PHE 670.A O no hydrogen 2.718 N/A ARG 700.A NH2 PHE 670.A O no hydrogen 2.819 N/A ASN 701.A N ARG 697.A O no hydrogen 2.807 N/A ASN 701.A ND2 ASN 730.A OD1 no hydrogen 3.186 N/A THR 702.A N THR 698.A O no hydrogen 2.816 N/A THR 702.A OG1 THR 698.A O no hydrogen 2.745 N/A LEU 703.A N LEU 699.A O no hydrogen 2.873 N/A LEU 704.A N ARG 700.A O no hydrogen 2.795 N/A SER 705.A N ASN 701.A O no hydrogen 3.173 N/A LEU 706.A N THR 702.A O no hydrogen 3.070 N/A LEU 707.A N LEU 703.A O no hydrogen 2.887 N/A SER 708.A N LEU 704.A O no hydrogen 2.900 N/A SER 708.A OG LEU 704.A O no hydrogen 2.561 N/A LYS 709.A N SER 705.A O no hydrogen 3.008 N/A ALA 710.A N LEU 706.A O no hydrogen 3.201 N/A GLN 711.A N SER 708.A O no hydrogen 2.933 N/A GLN 711.A NE2 SER 708.A O no hydrogen 2.992 N/A GLN 711.A NE2 TYR 740.A O no hydrogen 3.678 N/A TYR 712.A N LEU 707.A O no hydrogen 3.093 N/A TYR 712.A OH ASP 664.A OD1 no hydrogen 2.435 N/A ASN 714.A ND2 ASN 717.A OD1 no hydrogen 3.449 N/A ILE 715.A N TYR 712.A O no hydrogen 2.951 N/A ASN 717.A N ASN 714.A O no hydrogen 3.059 N/A ILE 719.A N ILE 715.A O no hydrogen 3.023 N/A ILE 720.A N LEU 716.A O no hydrogen 2.993 N/A GLU 721.A N ASN 717.A O no hydrogen 3.159 N/A HIS 722.A N GLU 718.A O no hydrogen 2.874 N/A HIS 722.A NE2 ASN 701.A OD1 no hydrogen 2.633 N/A SER 723.A N ILE 719.A O no hydrogen 3.116 N/A SER 723.A OG ILE 720.A O no hydrogen 2.527 N/A LYS 724.A N GLU 721.A O no hydrogen 3.243 N/A LYS 724.A NZ GLU 721.A OE2 no hydrogen 3.004 N/A SER 725.A N HIS 722.A O no hydrogen 2.983 N/A TYR 727.A N SER 725.A OG no hydrogen 3.275 N/A TYR 727.A OH ASP 679.A O no hydrogen 2.818 N/A ASN 730.A ND2 ASP 678.A OD1 no hydrogen 2.892 N/A ASN 730.A ND2 SER 725.A OG no hydrogen 2.962 N/A TRP 731.A N TYR 727.A O no hydrogen 2.973 N/A LEU 732.A N PRO 728.A O no hydrogen 2.744 N/A THR 733.A N SER 729.A O no hydrogen 3.142 N/A THR 733.A OG1 SER 729.A O no hydrogen 2.579 N/A SER 734.A N ASN 730.A O no hydrogen 2.853 N/A SER 734.A OG TRP 731.A O no hydrogen 2.829 N/A SER 736.A N LEU 732.A O no hydrogen 3.241 N/A SER 736.A OG THR 733.A O no hydrogen 3.359 N/A VAL 737.A N THR 733.A O no hydrogen 3.003 N/A SER 738.A N SER 734.A O no hydrogen 3.088 N/A SER 738.A OG LEU 735.A O no hydrogen 2.657 N/A ALA 739.A N SER 736.A O no hydrogen 3.295 N/A TYR 740.A N VAL 737.A O no hydrogen 3.518 N/A TYR 740.A OH ASP 773.A OD2 no hydrogen 2.553 N/A PHE 741.A N SER 738.A O no hydrogen 2.831 N/A TYR 744.A OH SER 772.A OG no hydrogen 2.854 N/A LEU 747.A N LYS 743.A O no hydrogen 3.056 N/A TYR 748.A N TYR 744.A O no hydrogen 2.647 N/A ASP 749.A N PHE 745.A O no hydrogen 2.937 N/A LYS 750.A N GLU 746.A O no hydrogen 3.068 N/A LYS 750.A NZ SER 723.A O no hydrogen 3.393 N/A LYS 750.A NZ SER 723.A OG no hydrogen 3.216 N/A THR 751.A N LEU 747.A O no hydrogen 2.809 N/A THR 751.A OG1 LEU 747.A O no hydrogen 2.713 N/A THR 751.A OG1 TYR 748.A O no hydrogen 3.255 N/A TYR 752.A N TYR 748.A O no hydrogen 2.947 N/A LYS 753.A N ASP 749.A O no hydrogen 2.994 N/A LEU 754.A N LYS 750.A O no hydrogen 3.162 N/A SER 755.A N TYR 752.A O no hydrogen 2.989 N/A SER 755.A OG THR 751.A O no hydrogen 2.639 N/A LYS 756.A N TYR 752.A O no hydrogen 2.910 N/A LYS 756.A NZ ASP 757.A OD1 no hydrogen 3.151 N/A LYS 756.A NZ ASP 757.A OD2 no hydrogen 3.526 N/A ASP 758.A N SER 755.A O no hydrogen 3.270 N/A GLU 759.A N TYR 223.A OH no hydrogen 3.029 N/A LEU 761.A N ASP 758.A OD1 no hydrogen 2.822 N/A LEU 762.A N ASP 758.A O no hydrogen 2.842 N/A GLN 763.A N GLU 759.A O no hydrogen 3.328 N/A GLN 763.A NE2 ASP 797.A OD1 no hydrogen 2.952 N/A GLU 764.A N LEU 760.A O no hydrogen 3.094 N/A TRP 765.A N LEU 761.A O no hydrogen 2.956 N/A TRP 765.A NE1 THR 751.A OG1 no hydrogen 2.940 N/A LEU 766.A N LEU 762.A O no hydrogen 2.884 N/A LYS 767.A N GLN 763.A O no hydrogen 2.981 N/A THR 768.A N GLU 764.A O no hydrogen 2.924 N/A THR 768.A OG1 GLU 764.A O no hydrogen 2.868 N/A VAL 769.A N TRP 765.A O no hydrogen 2.996 N/A SER 770.A N LEU 766.A O no hydrogen 2.761 N/A SER 770.A OG VAL 801.A O no hydrogen 2.584 N/A ARG 771.A N LYS 767.A O no hydrogen 2.947 N/A SER 772.A N VAL 769.A O no hydrogen 2.850 N/A SER 772.A OG TYR 744.A OH no hydrogen 2.854 N/A SER 772.A OG THR 768.A O no hydrogen 2.964 N/A ARG 774.A N SER 772.A O no hydrogen 2.889 N/A ARG 774.A NE ASP 776.A OD1 no hydrogen 2.885 N/A ARG 774.A NH1 ALA 739.A O no hydrogen 3.022 N/A ARG 774.A NH2 ASP 776.A OD1 no hydrogen 3.495 N/A ARG 774.A NH2 ASP 776.A OD2 no hydrogen 3.074 N/A TYR 778.A OH ARG 811.A O no hydrogen 2.884 N/A ILE 780.A N ASP 776.A O no hydrogen 2.981 N/A LEU 781.A N ILE 777.A O no hydrogen 2.924 N/A LYS 782.A N TYR 778.A O no hydrogen 3.156 N/A LYS 783.A N GLU 779.A O no hydrogen 3.066 N/A LYS 783.A NZ GLU 787.A OE1 no hydrogen 2.827 N/A LYS 783.A NZ GLU 787.A OE2 no hydrogen 2.611 N/A LEU 784.A N ILE 780.A O no hydrogen 3.062 N/A GLU 785.A N LEU 781.A O no hydrogen 2.903 N/A ASN 786.A N LYS 782.A O no hydrogen 3.143 N/A GLU 787.A N LYS 783.A O no hydrogen 2.826 N/A VAL 788.A N LEU 784.A O no hydrogen 2.912 N/A LEU 789.A N LEU 784.A O no hydrogen 2.772 N/A LYS 790.A N GLU 785.A O no hydrogen 2.739 N/A LYS 790.A NZ ASN 786.A O no hydrogen 2.867 N/A SER 792.A N LEU 789.A O no hydrogen 3.225 N/A SER 792.A OG ASP 797.A OD2 no hydrogen 2.725 N/A ASN 794.A N SER 792.A OG no hydrogen 3.205 N/A ASN 794.A ND2 SER 260.A O no hydrogen 3.531 N/A ASN 796.A N ASN 794.A OD1 no hydrogen 2.902 N/A ASN 796.A ND2 ASN 276.A OD1 no hydrogen 2.962 N/A ASN 796.A ND2 GLN 763.A OE1 no hydrogen 3.383 N/A ILE 798.A N ASN 794.A O no hydrogen 3.114 N/A ARG 799.A N PRO 795.A O no hydrogen 2.853 N/A ARG 799.A NH1 PHE 262.A O no hydrogen 3.342 N/A ARG 799.A NH1 ASN 796.A OD1 no hydrogen 2.978 N/A ARG 799.A NH2 ASN 263.A O no hydrogen 2.870 N/A ARG 799.A NH2 GLN 840.A OE1 no hydrogen 2.621 N/A ALA 800.A N ASN 796.A O no hydrogen 3.054 N/A VAL 801.A N ASP 797.A O no hydrogen 3.065 N/A TYR 802.A N ILE 798.A O no hydrogen 3.209 N/A TYR 802.A OH GLU 785.A OE2 no hydrogen 2.684 N/A LEU 803.A N ARG 799.A O no hydrogen 3.074 N/A PHE 805.A N SER 770.A OG no hydrogen 2.900 N/A THR 806.A N TYR 802.A O no hydrogen 3.295 N/A THR 806.A N LEU 803.A O no hydrogen 2.965 N/A THR 806.A OG1 LEU 803.A O no hydrogen 2.507 N/A ASN 807.A N PRO 804.A O no hydrogen 2.909 N/A ASN 808.A N PHE 805.A O no hydrogen 2.892 N/A ARG 810.A NH1 ASP 645.A OD2.A no hydrogen 3.395 N/A ARG 810.A NH1 ASP 649.A OD1 no hydrogen 3.144 N/A ARG 810.A NH2 ASP 649.A OD1 no hydrogen 2.880 N/A ARG 811.A N ASN 808.A O no hydrogen 3.179 N/A ARG 811.A N ASN 808.A OD1 no hydrogen 2.958 N/A PHE 812.A N ASN 808.A O no hydrogen 2.835 N/A HIS 813.A ND1 TYR 820.A OH no hydrogen 2.805 N/A ASP 814.A N ARG 811.A O no hydrogen 2.890 N/A SER 816.A N ASP 814.A OD1 no hydrogen 3.276 N/A SER 816.A OG ASP 814.A OD1 no hydrogen 2.702 N/A GLY 817.A N ASP 814.A O no hydrogen 2.877 N/A LYS 818.A N SER 816.A OG no hydrogen 3.036 N/A TYR 820.A OH HIS 813.A ND1 no hydrogen 2.805 N/A LYS 821.A N GLY 817.A O no hydrogen 2.863 N/A LEU 822.A N LYS 818.A O no hydrogen 2.969 N/A ILE 823.A N GLY 819.A O no hydrogen 3.151 N/A ALA 824.A N TYR 820.A O no hydrogen 2.971 N/A GLU 825.A N LYS 821.A O no hydrogen 2.959 N/A VAL 826.A N LEU 822.A O no hydrogen 3.050 N/A ILE 827.A N ILE 823.A O no hydrogen 2.800 N/A THR 828.A N ALA 824.A O no hydrogen 2.989 N/A THR 828.A OG1 ALA 824.A O no hydrogen 3.258 N/A LYS 829.A N GLU 825.A O no hydrogen 3.013 N/A THR 830.A N VAL 826.A O no hydrogen 2.891 N/A THR 830.A OG1 VAL 826.A O no hydrogen 2.614 N/A ASP 831.A N ILE 827.A O no hydrogen 2.835 N/A PHE 833.A N THR 830.A O no hydrogen 2.977 N/A ASN 834.A N THR 830.A O no hydrogen 2.877 N/A ASN 834.A ND2 TYR 107.A O no hydrogen 3.426 N/A ASN 834.A ND2 ASN 263.A OD1 no hydrogen 2.945 N/A VAL 837.A N ASN 834.A OD1 no hydrogen 3.007 N/A ALA 838.A N ASN 834.A O no hydrogen 2.951 N/A THR 839.A N PRO 835.A O no hydrogen 2.945 N/A THR 839.A OG1 PRO 835.A O no hydrogen 3.265 N/A GLN 840.A N MET 836.A O no hydrogen 3.072 N/A GLN 840.A NE2 ASN 263.A O no hydrogen 3.101 N/A LEU 841.A N VAL 837.A O no hydrogen 3.003 N/A CYS 842.A N THR 839.A O no hydrogen 3.112 N/A CYS 842.A SG ALA 838.A O no hydrogen 3.540 N/A GLU 843.A N GLN 840.A O no hydrogen 3.293 N/A PHE 845.A N CYS 842.A O no hydrogen 2.789 N/A LYS 846.A N GLU 843.A O no hydrogen 3.079 N/A LYS 846.A NZ GLU 359.A OE2 no hydrogen 2.656 N/A TRP 848.A N PHE 845.A O no hydrogen 2.954 N/A TRP 848.A NE1 LEU 883.A O no hydrogen 2.871 N/A LYS 850.A N LEU 847.A O no hydrogen 2.891 N/A LYS 850.A NZ SER 361.A O no hydrogen 3.051 N/A ASP 852.A N LEU 642.A O no hydrogen 2.855 N/A ARG 855.A N ASP 852.A OD2 no hydrogen 3.146 N/A ARG 855.A NE HIS 813.A O no hydrogen 2.798 N/A ARG 855.A NH1 ASP 852.A OD1 no hydrogen 2.844 N/A ARG 855.A NH2 ASP 645.A OD2.B no hydrogen 2.409 N/A ARG 855.A NH2 HIS 813.A O no hydrogen 3.152 N/A GLN 856.A N ASP 852.A O no hydrogen 2.963 N/A GLN 856.A NE2 ASN 641.A OD1 no hydrogen 3.657 N/A GLN 856.A NE2 LEU 851.A O no hydrogen 2.691 N/A GLU 857.A N THR 853.A O no hydrogen 3.218 N/A LEU 858.A N LYS 854.A O no hydrogen 2.996 N/A MET 859.A N ARG 855.A O no hydrogen 2.992 N/A LEU 860.A N GLN 856.A O no hydrogen 2.857 N/A ASN 861.A N GLU 857.A O no hydrogen 2.908 N/A GLU 862.A N LEU 858.A O no hydrogen 3.168 N/A MET 863.A N MET 859.A O no hydrogen 2.983 N/A ASN 864.A N LEU 860.A O no hydrogen 2.881 N/A THR 865.A N ASN 861.A O no hydrogen 2.953 N/A THR 865.A OG1 ASN 861.A O no hydrogen 2.942 N/A MET 866.A N GLU 862.A O no hydrogen 3.033 N/A LEU 867.A N MET 863.A O no hydrogen 2.857 N/A GLN 868.A N ASN 864.A O no hydrogen 3.057 N/A GLN 868.A N THR 865.A O no hydrogen 2.909 N/A GLU 869.A N MET 866.A O no hydrogen 3.162 N/A ILE 872.A N GLU 869.A O no hydrogen 3.132 N/A SER 873.A N ASP 831.A OD2 no hydrogen 2.868 N/A SER 873.A OG ASP 831.A OD1 no hydrogen 2.702 N/A SER 873.A OG ASP 831.A OD2 no hydrogen 3.489 N/A LEU 876.A N SER 873.A OG no hydrogen 3.020 N/A LYS 877.A N SER 873.A O no hydrogen 3.131 N/A GLU 878.A N ASN 874.A O no hydrogen 3.097 N/A TYR 879.A N ASN 875.A O no hydrogen 3.267 N/A LEU 880.A N LEU 876.A O no hydrogen 2.910 N/A LEU 881.A N LYS 877.A O no hydrogen 2.845 N/A ARG 882.A N GLU 878.A O no hydrogen 3.008 N/A ARG 882.A NE GLU 878.A OE2 no hydrogen 3.226 N/A ARG 882.A NH2 GLU 878.A OE2 no hydrogen 3.501 N/A LEU 883.A N TYR 879.A O no hydrogen 2.931 N/A THR 884.A N LEU 880.A O no hydrogen 2.973 N/A THR 884.A OG1 LEU 880.A O no hydrogen 2.785 N/A ASN 885.A N ARG 882.A O no hydrogen 3.199 N/A LYS 886.A N LEU 881.A O no hydrogen 2.899 N/A