Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5uri_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ GLU 54.A O no hydrogen 2.735 N/A LYS 4.A NZ TYR 56.A O no hydrogen 3.236 N/A LYS 4.A NZ ASP 90.A OD2 no hydrogen 2.820 N/A GLU 5.A N GLU 55.A O no hydrogen 2.674 N/A GLU 10.A N SER 7.A OG no hydrogen 3.128 N/A LYS 11.A N SER 7.A O no hydrogen 3.193 N/A LYS 11.A NZ TYR 56.A OH no hydrogen 3.074 N/A MET 12.A N PHE 8.A O no hydrogen 2.860 N/A LYS 13.A N VAL 9.A O no hydrogen 2.852 N/A LYS 13.A NZ GLU 10.A OE2 no hydrogen 2.826 N/A LYS 13.A NZ GLU 66.A OE2 no hydrogen 2.509 N/A LYS 14.A N GLU 10.A O no hydrogen 3.122 N/A THR 15.A N LYS 11.A O no hydrogen 3.096 N/A THR 15.A OG1 LYS 11.A O no hydrogen 2.957 N/A GLY 16.A N LYS 13.A O no hydrogen 3.254 N/A ARG 17.A N MET 12.A O no hydrogen 2.808 N/A ASN 18.A N ARG 47.A O no hydrogen 2.957 N/A ILE 19.A N ARG 47.A O no hydrogen 3.418 N/A ILE 20.A N LEU 71.A O no hydrogen 3.059 N/A VAL 21.A N MET 49.A O no hydrogen 2.671 N/A PHE 22.A N VAL 73.A O no hydrogen 2.943 N/A TYR 23.A N ALA 51.A O no hydrogen 3.202 N/A GLY 24.A N CYS 75.A O no hydrogen 2.710 N/A THR 27.A OG1 TYR 79.A OH no hydrogen 2.941 N/A GLU 32.A N GLY 28.A O no hydrogen 3.093 N/A PHE 33.A N THR 29.A O no hydrogen 3.024 N/A ALA 34.A N ALA 30.A O no hydrogen 2.832 N/A ASN 35.A N GLU 31.A O no hydrogen 2.883 N/A ARG 36.A N GLU 32.A O no hydrogen 3.087 N/A ARG 36.A NH1 GLU 152.A OE1 no hydrogen 3.037 N/A ARG 36.A NH1 GLU 152.A OE2 no hydrogen 3.513 N/A ARG 36.A NH2 GLU 152.A OE2 no hydrogen 3.104 N/A LEU 37.A N PHE 33.A O no hydrogen 2.840 N/A SER 38.A N ALA 34.A O no hydrogen 2.864 N/A LYS 39.A N ASN 35.A O no hydrogen 3.068 N/A ASP 40.A N ARG 36.A O no hydrogen 3.082 N/A ALA 41.A N LEU 37.A O no hydrogen 3.256 N/A HIS 42.A N LYS 39.A O no hydrogen 2.915 N/A ARG 43.A N ASP 40.A O no hydrogen 2.700 N/A ARG 43.A NH2 ASP 40.A OD1 no hydrogen 3.531 N/A TYR 44.A N ALA 41.A O no hydrogen 2.907 N/A GLY 45.A N HIS 42.A O no hydrogen 3.295 N/A MET 46.A N ALA 41.A O no hydrogen 3.104 N/A ARG 47.A N ASN 18.A OD1 no hydrogen 2.988 N/A ARG 47.A NH1 HIS 42.A ND1 no hydrogen 3.231 N/A MET 49.A N ILE 19.A O no hydrogen 3.157 N/A SER 50.A OG ASN 35.A OD1 no hydrogen 2.783 N/A ALA 51.A N VAL 21.A O no hydrogen 2.901 N/A GLU 54.A N ASP 52.A OD1 no hydrogen 2.941 N/A GLU 55.A N ASP 52.A O no hydrogen 3.078 N/A TYR 56.A N PRO 53.A O no hydrogen 3.284 N/A ALA 59.A N ASP 57.A OD1 no hydrogen 3.322 N/A ASP 60.A N ASP 57.A O no hydrogen 2.930 N/A LEU 61.A N LEU 58.A O no hydrogen 2.902 N/A SER 62.A N ALA 59.A O no hydrogen 3.392 N/A SER 62.A OG ALA 59.A O no hydrogen 3.560 N/A SER 63.A N ASP 60.A O no hydrogen 2.943 N/A LEU 64.A N LEU 61.A O no hydrogen 2.786 N/A GLU 66.A N SER 63.A O no hydrogen 3.080 N/A ILE 67.A N LEU 64.A O no hydrogen 2.967 N/A SER 70.A N ILE 67.A O no hydrogen 3.209 N/A SER 70.A OG LEU 64.A O no hydrogen 2.917 N/A SER 70.A OG ILE 67.A O no hydrogen 3.227 N/A LEU 71.A N ASN 18.A O no hydrogen 2.777 N/A VAL 72.A N LYS 106.A O no hydrogen 3.089 N/A VAL 73.A N ILE 20.A O no hydrogen 3.002 N/A PHE 74.A N ALA 108.A O no hydrogen 3.086 N/A CYS 75.A N PHE 22.A O no hydrogen 3.006 N/A MET 76.A N PHE 110.A O no hydrogen 3.114 N/A ALA 77.A N GLY 24.A O no hydrogen 2.984 N/A THR 78.A N LEU 112.A O no hydrogen 3.300 N/A TYR 79.A N ASP 83.A O no hydrogen 2.648 N/A TYR 79.A OH THR 27.A OG1 no hydrogen 2.941 N/A ASP 83.A N TYR 79.A O no hydrogen 2.743 N/A THR 85.A OG1 ASN 87.A OD1 no hydrogen 2.661 N/A ASP 86.A N GLN 26.A OE1 no hydrogen 3.158 N/A ASN 87.A ND2 TYR 23.A O no hydrogen 3.247 N/A ASN 87.A ND2 ASP 52.A OD1 no hydrogen 2.729 N/A ALA 88.A N THR 85.A O no hydrogen 2.672 N/A GLN 89.A N ASP 86.A O no hydrogen 3.480 N/A TYR 92.A N ALA 88.A O no hydrogen 2.853 N/A ASP 93.A N GLN 89.A O no hydrogen 2.948 N/A TRP 94.A N ASP 90.A O no hydrogen 2.925 N/A LEU 95.A N PHE 91.A O no hydrogen 2.919 N/A GLN 96.A N TYR 92.A O no hydrogen 3.112 N/A GLU 97.A N ASP 93.A O no hydrogen 3.153 N/A THR 98.A N TRP 94.A O no hydrogen 2.789 N/A VAL 100.A N THR 98.A OG1 no hydrogen 3.035 N/A LEU 102.A N LEU 134.A O no hydrogen 2.861 N/A THR 103.A N ASP 101.A OD2 no hydrogen 3.310 N/A THR 103.A OG1 ASP 101.A OD1 no hydrogen 3.112 N/A THR 103.A OG1 ASP 101.A OD2 no hydrogen 2.453 N/A VAL 105.A N LEU 102.A O no hydrogen 3.042 N/A LYS 106.A NZ GLN 137.A OE1 no hydrogen 2.509 N/A PHE 107.A N GLN 137.A O no hydrogen 3.020 N/A ALA 108.A N VAL 72.A O no hydrogen 2.992 N/A PHE 110.A N PHE 74.A O no hydrogen 2.968 N/A GLY 111.A N GLY 143.A O no hydrogen 2.625 N/A LEU 112.A N MET 76.A O no hydrogen 2.811 N/A GLY 113.A N GLY 145.A O no hydrogen 2.929 N/A LYS 115.A N ASP 146.A OD1 no hydrogen 2.708 N/A LYS 115.A NZ ASP 146.A OD2 no hydrogen 3.137 N/A THR 116.A N ASN 114.A OD1 no hydrogen 3.124 N/A THR 116.A OG1 ASN 114.A OD1 no hydrogen 3.525 N/A TYR 117.A N ASN 114.A O no hydrogen 2.875 N/A ASN 121.A ND2 GLY 145.A O no hydrogen 3.337 N/A MET 123.A N THR 78.A OG1 no hydrogen 2.960 N/A LYS 125.A N ASN 121.A O no hydrogen 3.091 N/A LYS 125.A NZ PHE 120.A O no hydrogen 3.357 N/A TYR 126.A N ALA 122.A O no hydrogen 2.933 N/A VAL 127.A N MET 123.A O no hydrogen 2.952 N/A ASP 128.A N GLY 124.A O no hydrogen 2.943 N/A GLN 129.A N LYS 125.A O no hydrogen 3.032 N/A ARG 130.A N TYR 126.A O no hydrogen 2.826 N/A ARG 130.A NE LEU 95.A O no hydrogen 2.773 N/A ARG 130.A NH2 LEU 95.A O no hydrogen 3.339 N/A LEU 131.A N VAL 127.A O no hydrogen 3.151 N/A GLN 133.A N GLN 129.A O no hydrogen 3.164 N/A LEU 134.A N ARG 130.A O no hydrogen 2.927 N/A GLY 135.A N GLU 132.A O no hydrogen 3.101 N/A ALA 136.A N LEU 131.A O no hydrogen 2.871 N/A GLN 137.A N VAL 105.A O no hydrogen 2.886 N/A ARG 138.A NE ASP 128.A OD1 no hydrogen 2.630 N/A ARG 138.A NH1 GLU 132.A OE2 no hydrogen 3.443 N/A ARG 138.A NH2 ASP 128.A O no hydrogen 3.062 N/A ARG 138.A NH2 ASP 128.A OD1 no hydrogen 3.367 N/A ARG 138.A NH2 ASP 128.A OD2 no hydrogen 2.997 N/A ARG 138.A NH2 GLU 132.A OE2 no hydrogen 3.042 N/A ILE 139.A N PHE 107.A O no hydrogen 2.827 N/A GLY 143.A N VAL 109.A O no hydrogen 2.823 N/A GLY 145.A N GLY 111.A O no hydrogen 2.794 N/A ASP 146.A N ASP 154.A OD2 no hydrogen 3.038 N/A ASP 147.A N GLY 113.A O no hydrogen 2.876 N/A ASP 148.A N ASP 146.A OD1 no hydrogen 3.138 N/A GLU 153.A N ASN 150.A OD1 no hydrogen 2.866 N/A ASP 154.A N ASN 150.A O no hydrogen 3.215 N/A PHE 155.A N LEU 151.A O no hydrogen 2.887 N/A ILE 156.A N GLU 152.A O no hydrogen 3.010 N/A THR 157.A N GLU 153.A O no hydrogen 2.933 N/A THR 157.A OG1 GLU 153.A O no hydrogen 2.911 N/A TRP 158.A N ASP 154.A O no hydrogen 3.089 N/A TRP 158.A NE1 GLU 141.A O no hydrogen 3.010 N/A ARG 159.A N PHE 155.A O no hydrogen 2.856 N/A ARG 159.A NE ASP 40.A OD2 no hydrogen 2.654 N/A ARG 159.A NH2 ASP 40.A OD1 no hydrogen 2.499 N/A ARG 159.A NH2 ASP 40.A OD2 no hydrogen 3.170 N/A GLU 160.A N ILE 156.A O no hydrogen 2.740 N/A GLN 161.A N TRP 158.A O no hydrogen 3.186 N/A PHE 162.A N TRP 158.A O no hydrogen 2.916 N/A TRP 163.A N ARG 159.A O no hydrogen 3.390 N/A TRP 163.A NE1 ASP 40.A OD2 no hydrogen 3.123 N/A ALA 165.A N GLN 161.A O no hydrogen 3.229 N/A VAL 166.A N PHE 162.A O no hydrogen 2.926 N/A CYS 167.A N TRP 163.A O no hydrogen 2.855 N/A CYS 167.A SG TRP 163.A O no hydrogen 3.379 N/A GLU 168.A N PRO 164.A O no hydrogen 2.824 N/A PHE 169.A N ALA 165.A O no hydrogen 3.058 N/A PHE 170.A N VAL 166.A O no hydrogen 2.956 N/A GLY 171.A N GLU 168.A O no hydrogen 3.465 N/A VAL 172.A N CYS 167.A O no hydrogen 2.937 N/A SER 178.A OG GLU 325.A OE2 no hydrogen 3.347 N/A ARG 180.A NE GLU 383.A OE2 no hydrogen 3.081 N/A ARG 180.A NH1 ASP 379.A OD2 no hydrogen 2.470 N/A ARG 180.A NH2 ASP 379.A OD2 no hydrogen 2.954 N/A ARG 180.A NH2 GLU 383.A OE2 no hydrogen 3.296 N/A GLN 181.A N GLU 383.A OE1 no hydrogen 2.778 N/A GLN 181.A NE2 GLN 181.A O no hydrogen 3.635 N/A GLN 181.A NE2 ASN 287.A OD1 no hydrogen 3.170 N/A TYR 182.A N GLU 383.A OE2 no hydrogen 3.127 N/A GLU 183.A N ASN 286.A O no hydrogen 2.757 N/A VAL 185.A N SER 284.A O no hydrogen 3.032 N/A HIS 187.A N ILE 282.A O no hydrogen 2.939 N/A HIS 187.A NE2 SER 284.A OG no hydrogen 2.490 N/A LYS 194.A N ASP 191.A O no hydrogen 3.109 N/A VAL 195.A N VAL 192.A O no hydrogen 2.773 N/A TYR 196.A N PRO 301.A O no hydrogen 2.921 N/A TYR 196.A OH GLY 201.A O no hydrogen 3.373 N/A THR 197.A N GLU 199.A OE1 no hydrogen 2.550 N/A THR 197.A OG1 GLU 199.A OE1 no hydrogen 3.316 N/A GLU 199.A N GLU 199.A OE1 no hydrogen 2.636 N/A LYS 204.A N GLU 199.A OE2 no hydrogen 2.793 N/A SER 205.A N ARG 202.A O no hydrogen 2.809 N/A SER 205.A OG ASN 217.A OD1 no hydrogen 2.740 N/A GLU 207.A N LYS 204.A O no hydrogen 3.268 N/A ASN 208.A N LYS 204.A O no hydrogen 2.917 N/A GLN 209.A NE2 SER 205.A O no hydrogen 3.090 N/A GLN 209.A NE2 PRO 218.A O no hydrogen 3.176 N/A ASP 214.A N ASN 217.A O no hydrogen 2.661 N/A LYS 216.A N ASP 214.A OD1 no hydrogen 3.192 N/A ASN 217.A N ASP 214.A OD1 no hydrogen 3.003 N/A ASN 217.A ND2 LYS 210.A O no hydrogen 3.066 N/A ASN 217.A ND2 PRO 212.A O no hydrogen 3.167 N/A PHE 219.A N MET 444.A O no hydrogen 2.865 N/A LEU 220.A N GLN 209.A OE1 no hydrogen 3.112 N/A ALA 221.A N VAL 442.A O no hydrogen 3.243 N/A VAL 223.A N ALA 440.A O no hydrogen 2.679 N/A THR 224.A N GLU 241.A O no hydrogen 2.875 N/A ASN 226.A ND2 LEU 431.A O no hydrogen 2.892 N/A ASN 226.A ND2 ARG 432.A O no hydrogen 3.301 N/A ASN 226.A ND2 LYS 434.A O no hydrogen 2.773 N/A ARG 227.A N HIS 239.A O no hydrogen 2.767 N/A LYS 228.A NZ GLY 232.A O no hydrogen 2.888 N/A LEU 229.A N LEU 237.A O no hydrogen 2.559 N/A ASN 230.A ND2 ARG 235.A O no hydrogen 2.689 N/A GLN 231.A NE2 TYR 506.A O no hydrogen 3.262 N/A GLY 232.A N GLU 504.A O no hydrogen 3.039 N/A GLU 234.A N GLU 504.A OE1 no hydrogen 3.186 N/A LEU 237.A N ASN 230.A OD1 no hydrogen 2.777 N/A MET 238.A N ALA 410.A O no hydrogen 2.818 N/A HIS 239.A N ARG 227.A O no hydrogen 2.677 N/A HIS 239.A ND1 TYR 508.A OH no hydrogen 2.486 N/A HIS 239.A NE2 GLU 241.A OE1 no hydrogen 2.741 N/A LEU 240.A N ILE 408.A O no hydrogen 2.937 N/A GLU 241.A N ALA 225.A O no hydrogen 2.733 N/A LEU 242.A N VAL 406.A O no hydrogen 2.858 N/A ASP 243.A N ALA 222.A O no hydrogen 2.990 N/A ILE 244.A N ASN 404.A O no hydrogen 2.735 N/A SER 245.A N ASP 243.A OD1 no hydrogen 2.902 N/A SER 245.A OG ASP 243.A OD1 no hydrogen 2.533 N/A SER 247.A OG ILE 244.A O no hydrogen 2.547 N/A ILE 249.A N SER 247.A OG no hydrogen 3.124 N/A TYR 251.A OH SER 397.A OG no hydrogen 2.621 N/A TYR 251.A OH HIS 402.A O no hydrogen 2.745 N/A TYR 251.A OH SER 405.A O no hydrogen 2.724 N/A GLU 252.A N ASP 255.A OD2 no hydrogen 2.958 N/A SER 253.A OG SER 397.A O no hydrogen 3.392 N/A SER 253.A OG GLU 479.A OE1 no hydrogen 3.068 N/A ASP 255.A N GLU 252.A O no hydrogen 2.942 N/A HIS 256.A N ARG 447.A O no hydrogen 3.105 N/A HIS 256.A NE2 ASP 608.A OD1 no hydrogen 2.836 N/A VAL 257.A N TYR 393.A O no hydrogen 2.759 N/A ALA 258.A N PHE 445.A O no hydrogen 2.727 N/A VAL 259.A N ARG 391.A O no hydrogen 3.058 N/A TYR 260.A N PRO 443.A O no hydrogen 3.046 N/A TYR 260.A OH ALA 215.A O no hydrogen 2.606 N/A ASN 263.A N THR 309.A O no hydrogen 2.866 N/A ASN 263.A ND2 LEU 308.A O no hydrogen 2.517 N/A ASN 263.A ND2 LEU 312.A O no hydrogen 2.902 N/A LEU 267.A N ASP 264.A O no hydrogen 2.795 N/A LEU 267.A N ASP 264.A OD1 no hydrogen 2.837 N/A VAL 268.A N ASP 264.A O no hydrogen 3.013 N/A ASN 269.A N SER 265.A O no hydrogen 2.924 N/A GLN 270.A N ALA 266.A O no hydrogen 2.991 N/A ILE 271.A N LEU 267.A O no hydrogen 3.181 N/A GLY 272.A N VAL 268.A O no hydrogen 3.159 N/A GLU 273.A N ASN 269.A O no hydrogen 2.652 N/A ILE 274.A N GLN 270.A O no hydrogen 2.783 N/A LEU 275.A N ILE 271.A O no hydrogen 3.150 N/A LEU 275.A N GLY 272.A O no hydrogen 2.934 N/A GLY 276.A N GLU 273.A O no hydrogen 2.831 N/A ALA 277.A N GLY 272.A O no hydrogen 3.088 N/A ASP 280.A N ASP 278.A OD1 no hydrogen 2.551 N/A VAL 281.A N ASP 278.A O no hydrogen 3.340 N/A MET 283.A N THR 302.A O no hydrogen 2.812 N/A SER 284.A N VAL 185.A O no hydrogen 3.171 N/A SER 284.A OG HIS 187.A NE2 no hydrogen 2.490 N/A ASN 286.A N GLU 183.A O no hydrogen 2.998 N/A ASN 287.A N LYS 295.A O no hydrogen 2.870 N/A ASN 287.A ND2 LYS 294.A O no hydrogen 2.731 N/A LEU 288.A N GLN 181.A O no hydrogen 2.866 N/A ASP 289.A N ASN 287.A OD1 no hydrogen 2.782 N/A GLU 291.A N ASP 289.A OD1 no hydrogen 2.833 N/A SER 292.A N ASP 289.A O no hydrogen 3.282 N/A SER 292.A N ASP 289.A OD1 no hydrogen 3.279 N/A LYS 294.A N SER 292.A OG no hydrogen 2.883 N/A LYS 294.A NZ GLU 31.A OE2 no hydrogen 3.506 N/A LYS 295.A NZ GLU 290.A O no hydrogen 3.506 N/A HIS 296.A ND1 LEU 285.A O no hydrogen 2.764 N/A CYS 300.A SG PHE 298.A O no hydrogen 3.127 N/A THR 302.A N MET 283.A O no hydrogen 2.910 N/A THR 302.A OG1 TYR 196.A O no hydrogen 2.889 N/A THR 303.A OG1 THR 306.A OG1 no hydrogen 2.907 N/A ARG 305.A N LEU 279.A O no hydrogen 2.851 N/A ARG 305.A NE ASP 280.A OD1 no hydrogen 2.877 N/A ARG 305.A NH1 ASN 269.A OD1 no hydrogen 2.802 N/A ARG 305.A NH2 ASP 280.A OD2 no hydrogen 3.151 N/A THR 306.A N THR 303.A OG1 no hydrogen 3.018 N/A THR 306.A OG1 THR 303.A OG1 no hydrogen 2.907 N/A ALA 307.A N THR 303.A O no hydrogen 2.909 N/A LEU 308.A N TYR 304.A O no hydrogen 2.780 N/A THR 309.A N ARG 305.A O no hydrogen 2.931 N/A THR 309.A OG1 ARG 305.A O no hydrogen 2.456 N/A TYR 310.A N THR 306.A O no hydrogen 2.854 N/A TYR 311.A N ALA 307.A O no hydrogen 2.930 N/A TYR 311.A OH GLU 199.A O no hydrogen 2.647 N/A LEU 312.A N ALA 307.A O no hydrogen 2.841 N/A ASP 313.A N PRO 386.A O no hydrogen 2.802 N/A THR 315.A N ASP 313.A OD1 no hydrogen 3.275 N/A ASN 316.A N ASP 313.A OD1 no hydrogen 2.929 N/A ASN 316.A ND2 ASP 313.A OD2 no hydrogen 2.844 N/A ARG 319.A NH1 GLU 152.A OE1 no hydrogen 3.316 N/A THR 320.A N GLU 152.A OE2 no hydrogen 2.961 N/A THR 320.A OG1 GLU 152.A OE2 no hydrogen 2.562 N/A VAL 322.A N ARG 319.A O no hydrogen 2.959 N/A LEU 323.A N ARG 319.A O no hydrogen 3.260 N/A TYR 324.A N THR 320.A O no hydrogen 2.840 N/A GLU 325.A N ASN 321.A O no hydrogen 2.917 N/A LEU 326.A N VAL 322.A O no hydrogen 3.102 N/A ALA 327.A N LEU 323.A O no hydrogen 3.236 N/A GLN 328.A NE2 SER 178.A OG no hydrogen 3.354 N/A GLN 328.A NE2 GLU 325.A O no hydrogen 2.687 N/A TYR 329.A N LEU 326.A O no hydrogen 2.704 N/A TYR 329.A OH HIS 380.A ND1 no hydrogen 2.754 N/A ALA 330.A N ALA 327.A O no hydrogen 3.188 N/A SER 331.A N SER 373.A O no hydrogen 2.877 N/A SER 334.A OG GLU 332.A OE2 no hydrogen 3.071 N/A GLN 336.A N GLU 332.A O no hydrogen 2.949 N/A GLN 336.A NE2 ALA 330.A O no hydrogen 3.361 N/A GLU 337.A N PRO 333.A O no hydrogen 2.874 N/A HIS 338.A N SER 334.A O no hydrogen 3.177 N/A LEU 339.A N GLU 335.A O no hydrogen 3.187 N/A HIS 340.A N GLN 336.A O no hydrogen 2.865 N/A LYS 341.A N GLU 337.A O no hydrogen 2.833 N/A MET 342.A N LEU 339.A O no hydrogen 3.331 N/A SER 344.A N LYS 341.A O no hydrogen 3.109 N/A SER 344.A OG LYS 341.A O no hydrogen 2.625 N/A SER 345.A OG GLU 160.A OE1 no hydrogen 2.722 N/A SER 345.A OG GLU 160.A OE2 no hydrogen 3.040 N/A LYS 350.A NZ SER 345.A O no hydrogen 3.222 N/A GLU 351.A N GLY 347.A O no hydrogen 3.004 N/A LEU 352.A N GLU 348.A O no hydrogen 2.728 N/A TYR 353.A N GLY 349.A O no hydrogen 2.855 N/A TYR 353.A OH PRO 318.A O no hydrogen 2.809 N/A LEU 354.A N LYS 350.A O no hydrogen 2.843 N/A SER 355.A N GLU 351.A O no hydrogen 2.925 N/A SER 355.A OG GLU 351.A O no hydrogen 3.396 N/A TRP 356.A N LEU 352.A O no hydrogen 2.943 N/A VAL 358.A N TYR 353.A O no hydrogen 3.181 N/A GLU 359.A N LEU 354.A O no hydrogen 2.761 N/A ARG 361.A N VAL 358.A O no hydrogen 2.890 N/A ARG 361.A NE TYR 415.A OH no hydrogen 3.214 N/A ARG 361.A NH1 ASN 316.A OD1 no hydrogen 3.188 N/A ARG 362.A N VAL 357.A O no hydrogen 2.969 N/A ARG 362.A NE ASP 370.A OD2 no hydrogen 2.508 N/A ARG 362.A NH1 TRP 356.A O no hydrogen 2.795 N/A ARG 362.A NH2 ASP 370.A OD2 no hydrogen 2.926 N/A ALA 366.A N HIS 363.A ND1 no hydrogen 3.264 N/A ILE 367.A N HIS 363.A O no hydrogen 3.173 N/A LEU 368.A N ILE 364.A O no hydrogen 3.159 N/A GLN 369.A N LEU 365.A O no hydrogen 3.013 N/A GLN 369.A N ALA 366.A O no hydrogen 3.075 N/A ASP 370.A N ALA 366.A O no hydrogen 2.814 N/A SER 373.A N GLU 335.A OE2 no hydrogen 2.982 N/A SER 373.A OG GLU 335.A OE2 no hydrogen 2.537 N/A LEU 374.A N TYR 371.A O no hydrogen 2.959 N/A ARG 375.A N TYR 329.A O no hydrogen 3.021 N/A ARG 375.A NH1 LEU 368.A O no hydrogen 2.932 N/A ARG 375.A NH1 LEU 374.A O no hydrogen 2.620 N/A HIS 380.A N PRO 377.A O no hydrogen 3.067 N/A HIS 380.A ND1 TYR 329.A OH no hydrogen 2.754 N/A LEU 381.A N PRO 377.A O no hydrogen 3.243 N/A CYS 382.A N ILE 378.A O no hydrogen 3.205 N/A CYS 382.A SG ILE 378.A O no hydrogen 3.439 N/A GLU 383.A N HIS 380.A O no hydrogen 3.159 N/A LEU 384.A N HIS 380.A O no hydrogen 3.241 N/A LEU 384.A N LEU 381.A O no hydrogen 3.232 N/A LEU 385.A N LEU 381.A O no hydrogen 2.978 N/A ARG 387.A NE TYR 311.A O no hydrogen 2.753 N/A ARG 387.A NH1 PRO 297.A O no hydrogen 3.506 N/A LEU 388.A N TYR 311.A O no hydrogen 2.909 N/A GLN 389.A NE2 ARG 387.A O no hydrogen 2.805 N/A ARG 391.A N VAL 259.A O no hydrogen 2.995 N/A ARG 391.A NH2 GLN 389.A O no hydrogen 2.569 N/A TYR 393.A N VAL 257.A O no hydrogen 2.843 N/A SER 394.A OG ASP 608.A OD2 no hydrogen 2.967 N/A ILE 395.A N ASP 255.A O no hydrogen 3.027 N/A ALA 396.A N HIS 407.A O no hydrogen 2.844 N/A SER 397.A OG TYR 251.A OH no hydrogen 2.621 N/A SER 397.A OG SER 405.A O no hydrogen 3.517 N/A SER 398.A N GLN 478.A OE1 no hydrogen 2.883 N/A SER 398.A OG GLU 479.A OE1 no hydrogen 2.534 N/A SER 399.A OG TYR 251.A O no hydrogen 2.716 N/A SER 399.A OG GLU 252.A OE2 no hydrogen 3.265 N/A LYS 400.A N SER 398.A OG no hydrogen 3.068 N/A VAL 401.A N SER 398.A O no hydrogen 3.238 N/A HIS 402.A N SER 398.A O no hydrogen 2.629 N/A SER 405.A N HIS 402.A O no hydrogen 3.326 N/A SER 405.A OG LEU 242.A O no hydrogen 3.177 N/A VAL 406.A N LEU 242.A O no hydrogen 2.726 N/A ILE 408.A N LEU 240.A O no hydrogen 2.879 N/A ALA 410.A N MET 238.A O no hydrogen 3.101 N/A ALA 412.A N HIS 236.A O no hydrogen 2.879 N/A VAL 413.A N THR 428.A OG1 no hydrogen 3.067 N/A TYR 415.A N ASN 423.A O no hydrogen 3.001 N/A ALA 417.A N ARG 421.A O no hydrogen 3.221 N/A SER 419.A N ALA 360.A O no hydrogen 3.232 N/A GLY 420.A N ALA 417.A O no hydrogen 2.843 N/A ARG 421.A NH1 GLN 369.A OE1 no hydrogen 2.687 N/A ARG 421.A NH1 ASP 370.A OD1 no hydrogen 3.136 N/A ARG 421.A NH2 ASP 370.A OD1 no hydrogen 3.340 N/A ARG 421.A NH2 ASP 370.A OD2 no hydrogen 2.806 N/A ARG 421.A NH2 SER 419.A O no hydrogen 3.014 N/A ASN 423.A N TYR 415.A O no hydrogen 2.934 N/A GLY 425.A N VAL 413.A O no hydrogen 2.703 N/A THR 428.A OG1 GLY 425.A O no hydrogen 3.466 N/A SER 429.A N GLY 425.A O no hydrogen 3.067 N/A SER 429.A OG GLY 425.A O no hydrogen 2.631 N/A TRP 430.A N VAL 426.A O no hydrogen 3.291 N/A LEU 431.A N ALA 427.A O no hydrogen 2.754 N/A ARG 432.A N THR 428.A O no hydrogen 2.773 N/A ALA 433.A N SER 429.A O no hydrogen 3.158 N/A LYS 434.A N LEU 431.A O no hydrogen 3.027 N/A LYS 434.A NZ LEU 441.A O no hydrogen 3.242 N/A VAL 442.A N ALA 221.A O no hydrogen 2.741 N/A MET 444.A N PHE 219.A O no hydrogen 2.905 N/A PHE 445.A N ALA 258.A O no hydrogen 2.929 N/A ARG 447.A N HIS 256.A O no hydrogen 2.906 N/A ARG 447.A NE ASP 86.A OD2 no hydrogen 3.126 N/A ARG 447.A NH2 ASP 86.A OD2 no hydrogen 2.936 N/A SER 449.A N ASP 255.A OD1 no hydrogen 2.888 N/A SER 449.A OG GLY 254.A O no hydrogen 2.508 N/A PHE 451.A N SER 449.A OG no hydrogen 3.204 N/A ARG 452.A NH1 ASP 255.A OD1 no hydrogen 2.610 N/A ARG 452.A NH2 ASP 255.A OD1 no hydrogen 2.931 N/A SER 457.A OG GLU 489.A O no hydrogen 2.728 N/A THR 459.A N LYS 456.A O no hydrogen 2.986 N/A THR 459.A OG1 LYS 456.A O no hydrogen 3.327 N/A VAL 461.A N GLU 492.A O no hydrogen 2.995 N/A ILE 462.A N HIS 559.A O no hydrogen 2.836 N/A MET 463.A N LEU 494.A O no hydrogen 2.911 N/A VAL 464.A N TYR 561.A O no hydrogen 2.742 N/A GLY 465.A N TYR 496.A O no hydrogen 3.096 N/A GLY 467.A N GLY 498.A O no hydrogen 2.758 N/A GLY 469.A N PRO 466.A O no hydrogen 2.714 N/A ILE 470.A N GLY 467.A O no hydrogen 3.523 N/A ALA 471.A N THR 468.A O no hydrogen 3.059 N/A MET 474.A N ALA 471.A O no hydrogen 3.178 N/A PHE 476.A N PRO 472.A O no hydrogen 3.150 N/A ILE 477.A N PHE 473.A O no hydrogen 2.855 N/A GLN 478.A N MET 474.A O no hydrogen 3.216 N/A GLU 479.A N GLY 475.A O no hydrogen 2.935 N/A ARG 480.A N PHE 476.A O no hydrogen 2.780 N/A ARG 480.A NE THR 493.A OG1 no hydrogen 3.081 N/A ARG 480.A NH1 THR 459.A O no hydrogen 3.289 N/A ARG 480.A NH2 THR 459.A O no hydrogen 3.239 N/A ARG 480.A NH2 THR 493.A OG1 no hydrogen 3.111 N/A ALA 481.A N ILE 477.A O no hydrogen 2.657 N/A TRP 482.A N GLN 478.A O no hydrogen 2.673 N/A LEU 483.A N GLU 479.A O no hydrogen 2.816 N/A ARG 484.A N ARG 480.A O no hydrogen 3.060 N/A ARG 484.A NH2 ASP 518.A O no hydrogen 2.541 N/A GLU 485.A N ALA 481.A O no hydrogen 3.094 N/A GLN 486.A N TRP 482.A O no hydrogen 2.857 N/A GLY 487.A N ARG 484.A O no hydrogen 3.315 N/A LYS 488.A N LEU 483.A O no hydrogen 2.924 N/A GLY 491.A N SER 457.A O no hydrogen 3.093 N/A THR 493.A N THR 522.A OG1 no hydrogen 2.806 N/A THR 493.A OG1 GLY 491.A O no hydrogen 3.400 N/A LEU 494.A N VAL 461.A O no hydrogen 2.916 N/A LEU 495.A N GLN 523.A O no hydrogen 3.136 N/A TYR 496.A N MET 463.A O no hydrogen 2.730 N/A TYR 496.A OH ASP 545.A OD2 no hydrogen 2.351 N/A TYR 497.A N ASN 525.A O no hydrogen 3.005 N/A TYR 497.A OH ASP 505.A O no hydrogen 3.176 N/A CYS 499.A N ALA 527.A O no hydrogen 3.121 N/A CYS 499.A SG ARG 501.A O no hydrogen 3.729 N/A ARG 500.A N ASP 505.A OD1 no hydrogen 3.030 N/A ARG 500.A NH1 GLU 234.A OE1 no hydrogen 2.669 N/A ARG 501.A N ASP 505.A OD1 no hydrogen 3.456 N/A SER 502.A N GLU 531.A OE1 no hydrogen 2.935 N/A SER 502.A OG GLU 531.A OE1 no hydrogen 2.952 N/A GLU 504.A N ARG 501.A O no hydrogen 3.151 N/A ASP 505.A N ARG 501.A O no hydrogen 3.304 N/A TYR 506.A N GLN 231.A OE1 no hydrogen 3.376 N/A LEU 507.A N TYR 497.A OH no hydrogen 2.863 N/A TYR 508.A OH HIS 239.A ND1 no hydrogen 2.486 N/A ARG 509.A NE GLU 510.A OE2 no hydrogen 3.083 N/A ARG 509.A NH2 GLU 510.A OE2 no hydrogen 3.463 N/A GLU 511.A N GLU 511.A OE1 no hydrogen 2.658 N/A LEU 512.A N TYR 508.A O no hydrogen 2.856 N/A ALA 513.A N ARG 509.A O no hydrogen 3.095 N/A ARG 514.A N GLU 510.A O no hydrogen 2.908 N/A PHE 515.A N GLU 511.A O no hydrogen 3.055 N/A HIS 516.A N LEU 512.A O no hydrogen 3.258 N/A LYS 517.A N ALA 513.A O no hydrogen 3.042 N/A ASP 518.A N ARG 514.A O no hydrogen 2.897 N/A GLY 519.A N HIS 516.A O no hydrogen 3.038 N/A LEU 521.A N PHE 515.A O no hydrogen 3.005 N/A THR 522.A N THR 493.A O no hydrogen 2.841 N/A GLN 523.A N THR 493.A O no hydrogen 3.450 N/A ASN 525.A N LEU 495.A O no hydrogen 3.105 N/A ASN 525.A ND2 GLN 523.A OE1 no hydrogen 2.863 N/A ALA 527.A N TYR 497.A O no hydrogen 2.781 N/A SER 529.A N CYS 499.A O no hydrogen 2.819 N/A SER 529.A OG CYS 499.A O no hydrogen 3.305 N/A ARG 530.A N ARG 500.A O no hydrogen 2.815 N/A GLN 532.A NE2 PHE 528.A O no hydrogen 2.763 N/A GLN 532.A NE2 GLN 532.A O no hydrogen 3.690 N/A GLN 532.A NE2 HIS 534.A O no hydrogen 2.871 N/A TYR 537.A N HIS 540.A ND1 no hydrogen 2.681 N/A GLN 539.A N GLN 539.A OE1 no hydrogen 2.627 N/A HIS 540.A N TYR 537.A O no hydrogen 2.852 N/A LEU 541.A N VAL 538.A O no hydrogen 2.760 N/A LEU 542.A N VAL 538.A O no hydrogen 3.167 N/A LYS 543.A N GLN 539.A O no hydrogen 2.969 N/A ARG 544.A N HIS 540.A O no hydrogen 3.192 N/A ARG 544.A NE ASP 545.A OD1 no hydrogen 2.763 N/A ARG 544.A NH2 ASP 545.A OD1 no hydrogen 3.556 N/A ARG 544.A NH2 ASP 545.A OD2 no hydrogen 3.135 N/A ASP 545.A N LEU 541.A O no hydrogen 3.031 N/A ARG 546.A N LYS 543.A O no hydrogen 3.220 N/A ARG 546.A NH1 LYS 543.A O no hydrogen 2.623 N/A HIS 548.A NE2 GLU 492.A OE1 no hydrogen 2.515 N/A LEU 549.A N ASP 545.A O no hydrogen 2.895 N/A TRP 550.A N ARG 546.A O no hydrogen 2.966 N/A LYS 551.A N GLU 547.A O no hydrogen 3.324 N/A LEU 552.A N HIS 548.A O no hydrogen 3.069 N/A ILE 553.A N LEU 549.A O no hydrogen 2.760 N/A HIS 554.A N TRP 550.A O no hydrogen 2.616 N/A GLU 555.A N LYS 551.A O no hydrogen 3.194 N/A GLY 556.A N LYS 551.A O no hydrogen 3.235 N/A ALA 558.A N LEU 552.A O no hydrogen 2.999 N/A HIS 559.A N PRO 460.A O no hydrogen 2.879 N/A HIS 559.A ND1 TYR 561.A OH no hydrogen 3.264 N/A ILE 560.A N ARG 604.A O no hydrogen 2.708 N/A TYR 561.A N ILE 462.A O no hydrogen 2.741 N/A TYR 561.A OH ARG 452.A O no hydrogen 2.567 N/A VAL 562.A N SER 606.A O no hydrogen 2.793 N/A CYS 563.A N VAL 464.A O no hydrogen 3.025 N/A CYS 563.A SG GLY 469.A O no hydrogen 3.260 N/A CYS 563.A SG ASP 608.A O no hydrogen 3.412 N/A CYS 563.A SG ASP 608.A OD2 no hydrogen 3.771 N/A GLY 564.A N ASP 608.A O no hydrogen 3.350 N/A ALA 566.A N TRP 610.A O no hydrogen 3.169 N/A ASN 568.A N ARG 567.A O no hydrogen 2.246 N/A LYS 571.A N ARG 567.A O no hydrogen 2.746 N/A LYS 571.A NZ THR 116.A O no hydrogen 3.458 N/A ASP 572.A N ASN 568.A O no hydrogen 3.106 N/A VAL 573.A N MET 569.A O no hydrogen 3.014 N/A GLN 574.A N ALA 570.A O no hydrogen 2.869 N/A GLN 574.A NE2 GLU 118.A OE1 no hydrogen 3.394 N/A GLN 574.A NE2 TYR 578.A OH no hydrogen 2.784 N/A ASN 575.A N LYS 571.A O no hydrogen 2.852 N/A THR 576.A N ASP 572.A O no hydrogen 2.966 N/A THR 576.A OG1 ASP 572.A O no hydrogen 3.281 N/A PHE 577.A N VAL 573.A O no hydrogen 3.083 N/A TYR 578.A N GLN 574.A O no hydrogen 2.957 N/A ASP 579.A N ASN 575.A O no hydrogen 2.867 N/A ILE 580.A N THR 576.A O no hydrogen 2.858 N/A VAL 581.A N PHE 577.A O no hydrogen 3.013 N/A ALA 582.A N TYR 578.A O no hydrogen 2.797 N/A GLU 583.A N ASP 579.A O no hydrogen 3.159 N/A PHE 584.A N ILE 580.A O no hydrogen 3.054 N/A MET 587.A N ALA 582.A O no hydrogen 3.091 N/A GLU 588.A N GLN 591.A OE1 no hydrogen 3.465 N/A ALA 592.A N GLU 588.A O no hydrogen 2.930 N/A ALA 592.A N HIS 589.A O no hydrogen 2.994 N/A VAL 593.A N HIS 589.A O no hydrogen 2.770 N/A ASP 594.A N THR 590.A O no hydrogen 3.156 N/A TYR 595.A N GLN 591.A O no hydrogen 3.056 N/A VAL 596.A N ALA 592.A O no hydrogen 2.943 N/A LYS 597.A N VAL 593.A O no hydrogen 2.807 N/A LYS 598.A N ASP 594.A O no hydrogen 2.762 N/A LEU 599.A N TYR 595.A O no hydrogen 3.076 N/A MET 600.A N VAL 596.A O no hydrogen 3.370 N/A MET 600.A N LYS 597.A O no hydrogen 3.089 N/A THR 601.A N LYS 597.A O no hydrogen 3.276 N/A THR 601.A OG1 LYS 598.A O no hydrogen 2.817 N/A LYS 602.A N LYS 598.A O no hydrogen 2.886 N/A GLY 603.A N MET 600.A O no hydrogen 3.243 N/A ARG 604.A N LEU 599.A O no hydrogen 2.674 N/A ARG 604.A NE ALA 558.A O no hydrogen 3.132 N/A ARG 604.A NH2 ILE 553.A O no hydrogen 2.927 N/A ARG 604.A NH2 ALA 558.A O no hydrogen 2.828 N/A SER 606.A N ILE 560.A O no hydrogen 2.766 N/A ASP 608.A N VAL 562.A O no hydrogen 2.813 N/A TRP 610.A N GLY 564.A O no hydrogen 3.171 N/A