Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4g0v_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 7.A N VAL 48.A O no hydrogen 2.967 N/A ALA 9.A N TYR 98.A OH no hydrogen 2.827 N/A ASN 10.A N ARG 43.A O no hydrogen 3.157 N/A ASN 10.A ND2 ASP 44.A OD1 no hydrogen 3.394 N/A ASP 11.A N ASP 44.A O no hydrogen 3.054 N/A ALA 12.A N ALA 9.A O no hydrogen 3.125 N/A GLY 13.A N SER 17.A OG no hydrogen 3.060 N/A GLY 14.A N ASP 11.A O no hydrogen 3.339 N/A SER 17.A N GLY 14.A O no hydrogen 3.413 N/A SER 17.A OG GLY 14.A O no hydrogen 2.949 N/A SER 17.A OG LEU 96.A O no hydrogen 3.316 N/A SER 17.A OG ARG 97.A O no hydrogen 3.525 N/A GLU 19.A N HIS 16.A O no hydrogen 2.852 N/A CYS 20.A N SER 17.A O no hydrogen 2.703 N/A CYS 20.A SG HIS 16.A O no hydrogen 3.660 N/A CYS 20.A SG ASP 44.A O no hydrogen 3.761 N/A THR 21.A N ARG 45.A O no hydrogen 2.758 N/A LEU 22.A N LYS 100.A O no hydrogen 2.782 N/A ILE 23.A N GLY 47.A O no hydrogen 2.764 N/A LEU 24.A N MET 102.A O no hydrogen 2.892 N/A THR 25.A N PHE 49.A O no hydrogen 3.080 N/A THR 25.A OG1 GLY 27.A O no hydrogen 3.030 N/A GLU 26.A N MET 104.A O no hydrogen 2.900 N/A GLY 27.A N LEU 51.A O no hydrogen 2.704 N/A LYS 31.A N GLY 27.A O no hydrogen 3.325 N/A LYS 31.A NZ LYS 5.A O no hydrogen 3.013 N/A LYS 31.A NZ ASP 7.A OD1 no hydrogen 2.984 N/A SER 32.A N ASP 28.A O no hydrogen 2.816 N/A SER 32.A OG ASP 28.A O no hydrogen 3.473 N/A LEU 33.A N SER 29.A O no hydrogen 3.054 N/A ALA 34.A N ALA 30.A O no hydrogen 3.046 N/A VAL 35.A N LYS 31.A O no hydrogen 2.824 N/A SER 36.A N SER 32.A O no hydrogen 2.863 N/A SER 36.A OG SER 32.A O no hydrogen 3.292 N/A GLY 37.A N LEU 33.A O no hydrogen 3.105 N/A LEU 38.A N VAL 35.A O no hydrogen 3.408 N/A GLY 42.A N LEU 38.A O no hydrogen 3.278 N/A ARG 43.A N VAL 40.A O no hydrogen 3.229 N/A ARG 43.A NH1 ASP 7.A OD2 no hydrogen 3.115 N/A ARG 45.A NH1 ASP 11.A OD2 no hydrogen 2.986 N/A ARG 45.A NH2 GLU 19.A OE1 no hydrogen 2.667 N/A GLY 47.A N THR 21.A O no hydrogen 2.929 N/A VAL 48.A N ASP 7.A O no hydrogen 2.984 N/A PHE 49.A N ILE 23.A O no hydrogen 2.900 N/A LEU 51.A N THR 25.A O no hydrogen 2.858 N/A LYS 54.A NZ ASP 110.A OD1 no hydrogen 2.789 N/A LYS 54.A NZ HIS 113.A ND1 no hydrogen 3.140 N/A ASN 57.A ND2 PHE 164.A O no hydrogen 2.973 N/A ARG 59.A N ASN 57.A OD1 no hydrogen 3.223 N/A ARG 59.A NE ASN 120.A OD1 no hydrogen 2.639 N/A ARG 59.A NH2 ASN 120.A OD1 no hydrogen 2.855 N/A ARG 59.A NH2 HIS 123.A ND1 no hydrogen 2.986 N/A ALA 61.A N VAL 58.A O no hydrogen 3.153 N/A GLN 65.A N SER 62.A OG no hydrogen 3.062 N/A ILE 66.A N SER 62.A O no hydrogen 3.072 N/A MET 67.A N HIS 63.A O no hydrogen 2.851 N/A GLU 68.A N LYS 64.A O no hydrogen 2.938 N/A ILE 72.A N ASN 69.A OD1 no hydrogen 2.633 N/A ASN 73.A N ASN 69.A O no hydrogen 3.225 N/A ASN 73.A ND2 MET 67.A O no hydrogen 2.989 N/A ASN 74.A N ALA 70.A O no hydrogen 2.998 N/A ILE 75.A N GLU 71.A O no hydrogen 3.187 N/A ILE 76.A N ILE 72.A O no hydrogen 3.014 N/A LYS 77.A N ASN 73.A O no hydrogen 3.074 N/A LYS 77.A NZ ASN 73.A OD1 no hydrogen 3.041 N/A ILE 78.A N ASN 74.A O no hydrogen 2.998 N/A VAL 79.A N ILE 75.A O no hydrogen 2.973 N/A GLY 80.A N ILE 76.A O no hydrogen 2.907 N/A LEU 81.A N ILE 76.A O no hydrogen 3.034 N/A LYS 85.A N GLN 82.A O no hydrogen 3.442 N/A LYS 85.A NZ SER 92.A O no hydrogen 3.318 N/A LYS 85.A NZ THR 95.A OG1 no hydrogen 2.456 N/A TYR 87.A N SER 128.A OG no hydrogen 2.847 N/A ASP 88.A N SER 86.A OG no hydrogen 3.248 N/A ASP 89.A N ASP 88.A OD1 no hydrogen 2.937 N/A GLU 91.A N ASP 89.A OD1 no hydrogen 2.746 N/A SER 92.A N ASP 89.A OD1 no hydrogen 2.575 N/A SER 92.A OG ASP 89.A O no hydrogen 3.146 N/A SER 92.A OG ASP 89.A OD1 no hydrogen 3.136 N/A LYS 94.A NZ GLU 91.A OE2 no hydrogen 3.510 N/A THR 95.A N SER 92.A O no hydrogen 3.537 N/A THR 95.A OG1 SER 92.A O no hydrogen 2.848 N/A ARG 97.A N VAL 79.A O no hydrogen 2.698 N/A ARG 97.A NH1 ASP 8.A OD2 no hydrogen 3.036 N/A ARG 97.A NH1 ILE 78.A O no hydrogen 2.881 N/A ARG 97.A NH2 ASP 8.A OD1 no hydrogen 2.705 N/A ARG 97.A NH2 ASP 8.A OD2 no hydrogen 3.564 N/A TYR 98.A OH ASP 8.A OD2 no hydrogen 2.584 N/A GLY 99.A N CYS 20.A O no hydrogen 2.827 N/A LYS 100.A N CYS 20.A O no hydrogen 3.147 N/A ILE 101.A N PHE 134.A O no hydrogen 2.947 N/A MET 102.A N LEU 22.A O no hydrogen 2.706 N/A ILE 103.A N GLU 136.A O no hydrogen 3.003 N/A MET 104.A N LEU 24.A O no hydrogen 2.779 N/A THR 105.A OG1 ASP 106.A O no hydrogen 2.952 N/A ASP 106.A N GLU 26.A OE1 no hydrogen 2.660 N/A GLN 109.A N GLN 109.A OE1 no hydrogen 2.708 N/A GLN 109.A NE2 SER 210.A OG no hydrogen 2.863 N/A GLY 111.A N ASP 108.A OD1 no hydrogen 2.893 N/A SER 112.A N ASP 108.A O no hydrogen 3.031 N/A SER 112.A OG ASP 108.A O no hydrogen 3.378 N/A SER 112.A OG GLU 203.A OE2 no hydrogen 2.888 N/A HIS 113.A N GLN 109.A O no hydrogen 3.068 N/A ILE 114.A N ASP 110.A O no hydrogen 3.102 N/A LYS 115.A N GLY 111.A O no hydrogen 3.016 N/A LYS 115.A NZ GLU 137.A OE1 no hydrogen 2.819 N/A LYS 115.A NZ GLU 203.A OE2 no hydrogen 2.851 N/A GLY 116.A N SER 112.A O no hydrogen 2.858 N/A LEU 117.A N HIS 113.A O no hydrogen 2.865 N/A LEU 118.A N ILE 114.A O no hydrogen 2.882 N/A ILE 119.A N LYS 115.A O no hydrogen 2.847 N/A ASN 120.A N GLY 116.A O no hydrogen 2.763 N/A ASN 120.A ND2 ASN 57.A OD1 no hydrogen 3.122 N/A PHE 121.A N LEU 117.A O no hydrogen 3.081 N/A ILE 122.A N LEU 118.A O no hydrogen 3.151 N/A HIS 123.A N ILE 119.A O no hydrogen 2.851 N/A HIS 123.A NE2 ASP 157.A OD2 no hydrogen 2.981 N/A HIS 124.A N ASN 120.A O no hydrogen 3.034 N/A ASN 125.A N PHE 121.A O no hydrogen 3.317 N/A TRP 126.A N ILE 122.A O no hydrogen 2.763 N/A TRP 126.A NE1 GLN 82.A O no hydrogen 2.829 N/A LEU 129.A N TRP 126.A O no hydrogen 2.985 N/A LEU 130.A N PRO 127.A O no hydrogen 2.841 N/A LYS 131.A N SER 128.A O no hydrogen 3.060 N/A HIS 132.A NE2 TYR 87.A O no hydrogen 2.698 N/A GLU 136.A N ILE 101.A O no hydrogen 2.903 N/A GLU 137.A N ILE 147.A O no hydrogen 2.821 N/A PHE 138.A N ILE 103.A O no hydrogen 2.932 N/A ILE 139.A N HIS 145.A O no hydrogen 3.035 N/A THR 140.A N GLN 107.A OE1 no hydrogen 3.258 N/A ARG 144.A N ASP 141.A O no hydrogen 2.739 N/A ARG 146.A NE GLU 136.A OE1 no hydrogen 2.671 N/A ARG 146.A NH1 GLU 143.A OE2 no hydrogen 2.663 N/A ARG 146.A NH2 GLU 136.A OE1 no hydrogen 3.303 N/A ARG 146.A NH2 GLU 136.A OE2 no hydrogen 2.763 N/A ILE 147.A N GLU 137.A O no hydrogen 2.977 N/A LEU 148.A N LYS 192.A O no hydrogen 2.962 N/A PHE 149.A N LEU 135.A O no hydrogen 3.084 N/A ARG 150.A N LEU 194.A O no hydrogen 3.032 N/A TYR 151.A OH ASP 157.A OD1 no hydrogen 2.752 N/A GLU 155.A N GLU 155.A OE1 no hydrogen 2.648 N/A ASP 156.A N GLY 153.A O no hydrogen 2.889 N/A ALA 158.A N PRO 154.A O no hydrogen 3.056 N/A ALA 159.A N GLU 155.A O no hydrogen 3.308 N/A ILE 160.A N ASP 156.A O no hydrogen 3.343 N/A THR 161.A N ASP 157.A O no hydrogen 3.166 N/A THR 161.A OG1 ASP 157.A O no hydrogen 3.133 N/A LEU 162.A N ALA 158.A O no hydrogen 2.847 N/A ALA 163.A N ALA 159.A O no hydrogen 3.220 N/A PHE 164.A N ILE 160.A O no hydrogen 3.139 N/A SER 165.A N THR 161.A O no hydrogen 3.030 N/A SER 165.A OG GLU 60.A OE2 no hydrogen 2.690 N/A LYS 166.A N GLU 60.A OE1 no hydrogen 2.865 N/A LYS 167.A N SER 165.A OG no hydrogen 3.108 N/A LYS 168.A N SER 165.A O no hydrogen 2.963 N/A ARG 172.A N LYS 168.A O no hydrogen 3.015 N/A ARG 172.A NH1 LEU 162.A O no hydrogen 2.768 N/A ARG 172.A NH1 SER 165.A O no hydrogen 2.894 N/A ARG 172.A NH2 SER 165.A O no hydrogen 2.879 N/A LYS 173.A N ILE 169.A O no hydrogen 3.058 N/A LYS 173.A NZ GLY 360.A O no hydrogen 2.874 N/A GLU 174.A N ASP 170.A O no hydrogen 3.195 N/A TRP 175.A N ASP 171.A O no hydrogen 2.740 N/A TRP 175.A NE1 ASN 201.A OD1 no hydrogen 3.073 N/A LEU 176.A N ARG 172.A O no hydrogen 2.801 N/A THR 177.A N LYS 173.A O no hydrogen 2.825 N/A THR 177.A OG1 LYS 173.A O no hydrogen 2.498 N/A ASN 178.A N GLU 174.A O no hydrogen 2.863 N/A PHE 179.A N TRP 175.A O no hydrogen 3.110 N/A MET 180.A N LEU 176.A O no hydrogen 2.783 N/A GLU 181.A N THR 177.A O no hydrogen 2.900 N/A ASP 182.A N ASN 178.A O no hydrogen 2.920 N/A ARG 183.A N PHE 179.A O no hydrogen 3.030 N/A ARG 183.A NH2 GLU 213.A OE2 no hydrogen 2.963 N/A ARG 184.A N MET 180.A O no hydrogen 3.160 N/A ARG 184.A N GLU 181.A O no hydrogen 3.220 N/A GLN 185.A N GLU 181.A O no hydrogen 3.018 N/A ARG 186.A N ASP 182.A O no hydrogen 3.022 N/A ARG 187.A N ARG 183.A O no hydrogen 3.159 N/A LEU 188.A N ARG 184.A O no hydrogen 3.419 N/A LEU 188.A N GLN 185.A O no hydrogen 3.094 N/A HIS 189.A N GLN 185.A O no hydrogen 3.313 N/A LYS 192.A NZ GLU 143.A O no hydrogen 2.851 N/A LYS 192.A NZ GLU 143.A OE2 no hydrogen 3.073 N/A LYS 192.A NZ ARG 146.A O no hydrogen 3.016 N/A LEU 194.A N LEU 148.A O no hydrogen 3.024 N/A TYR 196.A N ASP 156.A OD1 no hydrogen 3.004 N/A ASN 197.A ND2 GLU 155.A O no hydrogen 2.877 N/A ASP 198.A N THR 195.A OG1 no hydrogen 3.163 N/A PHE 199.A N THR 195.A O no hydrogen 3.051 N/A ILE 200.A N TYR 196.A O no hydrogen 2.962 N/A ASN 201.A N ASN 197.A O no hydrogen 3.042 N/A LYS 202.A N ASP 198.A O no hydrogen 2.957 N/A GLU 203.A N PHE 199.A O no hydrogen 2.756 N/A LEU 204.A N PHE 199.A O no hydrogen 2.885 N/A ILE 205.A N ILE 200.A O no hydrogen 3.215 N/A LEU 206.A N GLU 203.A O no hydrogen 3.038 N/A PHE 207.A N LEU 204.A O no hydrogen 2.732 N/A SER 208.A N LEU 204.A O no hydrogen 2.977 N/A SER 208.A OG LEU 204.A O no hydrogen 3.461 N/A ASN 209.A N ILE 205.A O no hydrogen 2.881 N/A ASN 209.A ND2 GLU 213.A OE2 no hydrogen 3.056 N/A SER 210.A N LEU 206.A O no hydrogen 3.101 N/A SER 210.A OG LEU 206.A O no hydrogen 3.299 N/A ASP 211.A N PHE 207.A O no hydrogen 2.688 N/A ASN 212.A N SER 208.A O no hydrogen 3.361 N/A ASN 212.A ND2 THR 359.A O no hydrogen 3.039 N/A GLU 213.A N ASN 209.A O no hydrogen 2.988 N/A ARG 214.A N SER 210.A O no hydrogen 2.993 N/A ARG 214.A NH1 ASP 110.A OD1 no hydrogen 3.535 N/A ARG 214.A NH1 ASP 110.A OD2 no hydrogen 2.854 N/A ARG 214.A NH2 ASP 110.A OD1 no hydrogen 2.909 N/A SER 215.A N ASN 212.A O no hydrogen 3.275 N/A SER 215.A OG ASP 211.A O no hydrogen 2.725 N/A SER 215.A OG ASP 211.A OD1 no hydrogen 3.364 N/A SER 215.A OG ILE 357.A O no hydrogen 3.344 N/A ILE 216.A N ASN 212.A O no hydrogen 2.964 N/A SER 218.A N PHE 223.A O no hydrogen 2.861 N/A LEU 219.A N PHE 504.A O no hydrogen 2.875 N/A VAL 220.A N SER 218.A OG no hydrogen 2.976 N/A GLY 222.A N SER 218.A O no hydrogen 2.903 N/A PHE 223.A N ASP 221.A OD1 no hydrogen 3.002 N/A LYS 224.A N GLN 227.A OE1 no hydrogen 2.810 N/A LYS 224.A NZ GLU 355.A O no hydrogen 2.554 N/A ARG 228.A N LYS 224.A O no hydrogen 2.848 N/A ARG 228.A NE ASP 221.A OD2 no hydrogen 2.696 N/A ARG 228.A NH2 ASP 221.A OD1 no hydrogen 2.997 N/A ARG 228.A NH2 ASP 221.A OD2 no hydrogen 3.374 N/A LYS 229.A N PRO 225.A O no hydrogen 2.963 N/A LYS 229.A NZ SER 256.A O no hydrogen 2.874 N/A LYS 229.A NZ GLU 338.A OE1 no hydrogen 2.826 N/A VAL 230.A N GLY 226.A O no hydrogen 3.074 N/A LEU 231.A N GLN 227.A O no hydrogen 3.061 N/A PHE 232.A N ARG 228.A O no hydrogen 2.856 N/A THR 233.A N LYS 229.A O no hydrogen 2.919 N/A THR 233.A OG1 LYS 229.A O no hydrogen 2.860 N/A CYS 234.A N VAL 230.A O no hydrogen 3.024 N/A CYS 234.A SG VAL 230.A O no hydrogen 3.279 N/A PHE 235.A N LEU 231.A O no hydrogen 2.816 N/A LYS 236.A N PHE 232.A O no hydrogen 3.050 N/A ARG 237.A N THR 233.A O no hydrogen 2.911 N/A ARG 237.A NE SER 251.A OG no hydrogen 3.041 N/A ARG 237.A NH1 ASP 239.A OD2 no hydrogen 3.000 N/A ARG 237.A NH2 SER 251.A OG no hydrogen 3.234 N/A ASN 238.A N CYS 234.A O no hydrogen 2.971 N/A GLU 242.A N GLU 242.A OE1 no hydrogen 2.705 N/A VAL 243.A N THR 309.A O no hydrogen 2.922 N/A VAL 245.A N ILE 307.A O no hydrogen 2.895 N/A ALA 246.A N PRO 304.A O no hydrogen 2.920 N/A LEU 248.A N LYS 244.A O no hydrogen 2.818 N/A ALA 249.A N VAL 245.A O no hydrogen 2.862 N/A GLY 250.A N ALA 246.A O no hydrogen 3.147 N/A SER 251.A N GLN 247.A O no hydrogen 3.020 N/A VAL 252.A N LEU 248.A O no hydrogen 2.850 N/A ALA 253.A N ALA 249.A O no hydrogen 3.015 N/A GLU 254.A N GLY 250.A O no hydrogen 2.990 N/A MET 255.A N SER 251.A O no hydrogen 2.861 N/A SER 256.A N VAL 252.A O no hydrogen 2.814 N/A SER 256.A OG VAL 252.A O no hydrogen 2.725 N/A TYR 258.A N ALA 253.A O no hydrogen 3.382 N/A HIS 259.A NE2 ASP 332.A OD1 no hydrogen 2.894 N/A MET 266.A N GLU 262.A O no hydrogen 2.905 N/A MET 267.A N GLN 263.A O no hydrogen 2.932 N/A THR 268.A N ALA 264.A O no hydrogen 2.897 N/A THR 268.A OG1 ALA 264.A O no hydrogen 3.332 N/A ILE 269.A N LEU 265.A O no hydrogen 2.805 N/A VAL 270.A N MET 266.A O no hydrogen 3.070 N/A ASN 271.A N MET 267.A O no hydrogen 3.025 N/A LEU 272.A N THR 268.A O no hydrogen 3.008 N/A ALA 273.A N VAL 270.A O no hydrogen 3.121 N/A GLN 274.A NE2 PHE 291.A O no hydrogen 2.843 N/A SER 279.A N PHE 276.A O no hydrogen 3.081 N/A SER 279.A OG PHE 276.A O no hydrogen 2.764 N/A ASN 280.A ND2 ASN 271.A O no hydrogen 2.830 N/A ASN 280.A ND2 GLN 274.A O no hydrogen 2.691 N/A ASN 281.A ND2 TYR 368.A O no hydrogen 2.745 N/A ASN 281.A ND2 ASN 392.A O no hydrogen 2.928 N/A ILE 282.A N ASN 352.A OD1 no hydrogen 2.858 N/A ASN 283.A ND2 LEU 285.A O no hydrogen 2.814 N/A GLN 286.A N MET 310.A O no hydrogen 2.761 N/A GLN 286.A NE2 LEU 311.A O no hydrogen 2.880 N/A ILE 288.A N GLN 286.A O no hydrogen 3.034 N/A ILE 288.A N PHE 308.A O no hydrogen 3.071 N/A GLY 292.A N GLN 290.A OE1 no hydrogen 2.652 N/A THR 293.A N ASP 300.A OD1 no hydrogen 2.925 N/A THR 293.A OG1 ASP 300.A OD1 no hydrogen 3.500 N/A THR 293.A OG1 ASP 300.A OD2 no hydrogen 2.613 N/A ARG 294.A NH1 THR 465.A O no hydrogen 2.986 N/A ARG 294.A NH2 GLU 426.A OE1 no hydrogen 2.699 N/A LEU 295.A N THR 293.A OG1 no hydrogen 3.086 N/A GLY 298.A N THR 293.A O no hydrogen 2.995 N/A LYS 299.A N HIS 296.A O no hydrogen 3.182 N/A ASP 300.A N ASP 300.A OD1 no hydrogen 2.677 N/A ALA 301.A N GLY 298.A O no hydrogen 3.001 N/A ALA 302.A N GLN 290.A O no hydrogen 2.939 N/A TYR 306.A N SER 303.A O no hydrogen 2.769 N/A PHE 308.A N ILE 288.A O no hydrogen 2.899 N/A THR 309.A N VAL 243.A O no hydrogen 2.834 N/A THR 309.A OG1 GLN 286.A O no hydrogen 2.512 N/A SER 312.A N LEU 284.A O no hydrogen 2.806 N/A THR 313.A OG1 GLU 652.A OE2 no hydrogen 2.541 N/A LEU 314.A N SER 312.A OG no hydrogen 3.129 N/A ALA 315.A N SER 312.A O no hydrogen 3.135 N/A ARG 316.A NH1 PHE 319.A O no hydrogen 2.680 N/A ARG 316.A NH1 ASP 324.A OD1 no hydrogen 3.248 N/A ARG 316.A NH2 ASP 324.A OD2 no hydrogen 2.955 N/A LEU 318.A N LEU 314.A O no hydrogen 2.896 N/A PHE 319.A N ALA 315.A O no hydrogen 2.790 N/A ASP 323.A N PRO 320.A O no hydrogen 3.024 N/A ASP 324.A N ALA 321.A O no hydrogen 2.826 N/A ASN 325.A N VAL 322.A O no hydrogen 3.294 N/A ASN 325.A ND2 VAL 322.A O no hydrogen 2.815 N/A LEU 326.A N ASP 323.A O no hydrogen 2.801 N/A LEU 327.A N ASP 324.A O no hydrogen 3.156 N/A LEU 330.A N GLU 338.A O no hydrogen 2.977 N/A ASP 332.A N GLN 335.A O no hydrogen 2.855 N/A GLN 335.A N ASP 332.A O no hydrogen 3.390 N/A GLN 335.A NE2 GLU 254.A O no hydrogen 3.220 N/A VAL 337.A N LEU 330.A O no hydrogen 2.723 N/A GLU 338.A N GLU 338.A OE1 no hydrogen 2.959 N/A GLU 340.A N LYS 328.A O no hydrogen 2.955 N/A TRP 341.A NE1 HIS 506.A O no hydrogen 3.126 N/A TYR 342.A N ASP 221.A OD2 no hydrogen 2.882 N/A ILE 345.A N LEU 318.A O no hydrogen 2.962 N/A LEU 350.A N PRO 347.A O no hydrogen 2.890 N/A ILE 351.A N MET 348.A O no hydrogen 2.989 N/A ASN 352.A N MET 348.A O no hydrogen 3.362 N/A ASN 352.A ND2 ILE 282.A O no hydrogen 2.722 N/A ALA 354.A N LEU 365.A O no hydrogen 3.196 N/A GLY 356.A N CYS 363.A O no hydrogen 2.918 N/A GLY 358.A N TRP 361.A O no hydrogen 2.977 N/A THR 359.A N ASN 212.A OD1 no hydrogen 2.817 N/A THR 359.A OG1 ASP 211.A OD2 no hydrogen 2.914 N/A CYS 363.A N GLY 356.A O no hydrogen 2.620 N/A CYS 363.A SG VAL 502.A O no hydrogen 3.070 N/A LYS 364.A N SER 500.A O no hydrogen 3.279 N/A LEU 365.A N ALA 354.A O no hydrogen 2.897 N/A ASN 367.A N TYR 393.A OH no hydrogen 3.216 N/A ASN 367.A ND2 SER 279.A O no hydrogen 2.993 N/A ASN 367.A ND2 ASN 281.A OD1 no hydrogen 2.957 N/A ARG 371.A NE ASP 654.A OD1 no hydrogen 3.248 N/A ARG 371.A NH1 GLU 657.A OE1 no hydrogen 2.720 N/A ARG 371.A NH2 ASP 654.A OD1 no hydrogen 2.638 N/A ARG 371.A NH2 GLU 657.A OE1 no hydrogen 2.811 N/A GLU 372.A N ASP 369.A OD2 no hydrogen 2.838 N/A ILE 373.A N ASP 369.A O no hydrogen 3.075 N/A VAL 374.A N ALA 370.A O no hydrogen 2.983 N/A ASN 375.A N ARG 371.A O no hydrogen 2.909 N/A ASN 376.A N GLU 372.A O no hydrogen 2.864 N/A ASN 376.A ND2 HIS 387.A O no hydrogen 2.818 N/A VAL 377.A N ILE 373.A O no hydrogen 2.904 N/A ARG 378.A N VAL 374.A O no hydrogen 2.889 N/A ARG 379.A N ASN 375.A O no hydrogen 2.926 N/A ARG 379.A NE ASP 385.A O no hydrogen 2.811 N/A ARG 379.A NH2 ASP 385.A O no hydrogen 2.748 N/A MET 380.A N ASN 376.A O no hydrogen 3.055 N/A LEU 381.A N VAL 377.A O no hydrogen 2.988 N/A ASP 382.A N ARG 378.A O no hydrogen 3.167 N/A ASP 382.A N ARG 379.A O no hydrogen 2.924 N/A GLY 383.A N MET 380.A O no hydrogen 3.080 N/A LEU 384.A N ARG 379.A O no hydrogen 3.133 N/A HIS 387.A N ASN 376.A OD1 no hydrogen 2.750 N/A MET 389.A N GLN 517.A OE1.A no hydrogen 3.064 N/A ASN 392.A N ASN 367.A O no hydrogen 2.865 N/A LYS 394.A N ASN 281.A OD1 no hydrogen 2.843 N/A LYS 394.A NZ GLU 660.A OE1 no hydrogen 2.722 N/A PHE 396.A N TYR 393.A O no hydrogen 3.115 N/A LYS 397.A N GLU 426.A OE2 no hydrogen 2.874 N/A THR 399.A N SER 411.A O no hydrogen 3.234 N/A GLN 401.A N ALA 409.A O no hydrogen 2.925 N/A LEU 403.A N GLN 407.A O no hydrogen 2.945 N/A ASN 406.A ND2 ASN 499.A OD1 no hydrogen 3.362 N/A ASN 406.A ND2 GLU 514.A O no hydrogen 2.821 N/A TYR 408.A N LEU 496.A O no hydrogen 2.938 N/A ALA 409.A N GLN 401.A O no hydrogen 2.828 N/A VAL 410.A N THR 494.A O no hydrogen 2.907 N/A SER 411.A N THR 399.A O no hydrogen 3.067 N/A GLY 412.A N LEU 492.A O no hydrogen 2.812 N/A GLU 413.A N GLU 426.A O no hydrogen 2.926 N/A PHE 415.A N GLU 423.A O no hydrogen 2.920 N/A VAL 417.A N THR 421.A O no hydrogen 2.818 N/A ASP 418.A N THR 421.A O no hydrogen 3.412 N/A ARG 419.A NH1 GLU 482.A OE2 no hydrogen 3.278 N/A ARG 419.A NH2 GLU 482.A OE1 no hydrogen 3.234 N/A ARG 419.A NH2 GLU 482.A OE2 no hydrogen 3.096 N/A ASN 420.A N ASP 418.A OD1 no hydrogen 2.671 N/A THR 421.A N ASP 418.A O no hydrogen 3.426 N/A THR 421.A OG1 ASP 418.A OD1 no hydrogen 2.749 N/A THR 421.A OG1 ASP 418.A OD2 no hydrogen 3.201 N/A VAL 422.A N VAL 471.A O no hydrogen 2.907 N/A GLU 423.A N PHE 415.A O no hydrogen 2.958 N/A ILE 424.A N PHE 469.A O no hydrogen 2.789 N/A THR 425.A N GLU 413.A O no hydrogen 3.024 N/A THR 425.A OG1 GLU 413.A OE1 no hydrogen 3.139 N/A LEU 427.A N GLU 426.A OE1 no hydrogen 2.898 N/A ARG 430.A NH2 GLU 355.A OE1 no hydrogen 2.802 N/A THR 431.A N PRO 428.A O no hydrogen 2.872 N/A THR 433.A N ARG 294.A O no hydrogen 3.060 N/A THR 433.A OG1 ARG 294.A O no hydrogen 3.533 N/A GLN 434.A N LEU 295.A O no hydrogen 2.914 N/A GLN 434.A NE2 GLU 438.A OE2 no hydrogen 3.235 N/A TYR 436.A N TRP 432.A O no hydrogen 2.938 N/A TYR 436.A OH PHE 490.A O no hydrogen 2.533 N/A LYS 437.A N THR 433.A O no hydrogen 3.104 N/A LYS 437.A NZ GLU 460.A OE2 no hydrogen 3.022 N/A GLU 438.A N GLN 434.A O no hydrogen 3.042 N/A GLN 439.A N VAL 435.A O no hydrogen 2.896 N/A VAL 440.A N TYR 436.A O no hydrogen 2.792 N/A LEU 441.A N TYR 436.A O no hydrogen 3.247 N/A GLU 442.A N LYS 437.A O no hydrogen 2.973 N/A MET 444.A N VAL 440.A O no hydrogen 3.047 N/A LEU 445.A N LEU 441.A O no hydrogen 2.751 N/A ASN 446.A N GLU 442.A O no hydrogen 2.764 N/A ASN 446.A ND2 GLU 442.A OE1 no hydrogen 2.864 N/A GLY 447.A N PRO 443.A O no hydrogen 2.736 N/A THR 448.A N THR 451.A O no hydrogen 2.813 N/A THR 448.A OG1 THR 451.A OG1 no hydrogen 2.542 N/A LYS 450.A N THR 448.A OG1 no hydrogen 3.194 N/A LYS 450.A NZ ASP 449.A OD2 no hydrogen 3.297 N/A THR 451.A OG1 THR 448.A OG1 no hydrogen 2.542 N/A LEU 454.A N MET 444.A O no hydrogen 2.706 N/A ILE 455.A N MET 444.A O no hydrogen 3.245 N/A SER 456.A N LYS 472.A O no hydrogen 2.627 N/A SER 456.A OG LYS 472.A O no hydrogen 3.419 N/A ASP 457.A N LYS 472.A O no hydrogen 3.391 N/A TYR 458.A OH GLU 442.A OE2 no hydrogen 2.693 N/A LYS 459.A N VAL 470.A O no hydrogen 2.963 N/A TYR 461.A N LYS 468.A O no hydrogen 2.856 N/A HIS 462.A NE2 GLU 460.A OE1 no hydrogen 2.912 N/A THR 463.A OG1 THR 466.A OG1 no hydrogen 2.456 N/A THR 465.A N THR 463.A OG1 no hydrogen 3.350 N/A THR 466.A OG1 THR 463.A OG1 no hydrogen 2.456 N/A LYS 468.A N HIS 462.A ND1 no hydrogen 2.953 N/A PHE 469.A N ILE 424.A O no hydrogen 2.853 N/A VAL 470.A N LYS 459.A O no hydrogen 2.905 N/A VAL 471.A N VAL 422.A O no hydrogen 2.835 N/A LYS 472.A N ASP 457.A O no hydrogen 2.805 N/A LYS 472.A NZ THR 421.A OG1 no hydrogen 2.562 N/A MET 473.A N ASN 420.A O no hydrogen 2.921 N/A THR 474.A OG1 GLU 476.A OE2 no hydrogen 3.267 N/A LYS 477.A N THR 474.A OG1 no hydrogen 3.154 N/A LEU 478.A N THR 474.A O no hydrogen 3.058 N/A ALA 479.A N GLU 475.A O no hydrogen 3.079 N/A GLN 480.A N GLU 476.A O no hydrogen 3.131 N/A ALA 481.A N LYS 477.A O no hydrogen 2.904 N/A GLU 482.A N LEU 478.A O no hydrogen 2.925 N/A ALA 483.A N ALA 479.A O no hydrogen 3.109 N/A ALA 484.A N GLN 480.A O no hydrogen 2.995 N/A GLY 485.A N GLU 482.A O no hydrogen 3.097 N/A VAL 489.A N GLY 485.A O no hydrogen 2.809 N/A PHE 490.A N LEU 486.A O no hydrogen 2.910 N/A LYS 491.A N LYS 488.A O no hydrogen 3.288 N/A LEU 492.A N HIS 487.A O no hydrogen 2.931 N/A GLN 493.A NE2 SER 411.A OG no hydrogen 3.190 N/A THR 494.A N VAL 410.A O no hydrogen 2.900 N/A LEU 496.A N TYR 408.A O no hydrogen 2.862 N/A THR 497.A OG1 GLN 407.A OE1 no hydrogen 2.911 N/A CYS 498.A N ASN 406.A O no hydrogen 2.745 N/A SER 500.A OG ALA 362.A O no hydrogen 2.574 N/A VAL 502.A N SER 500.A O no hydrogen 2.925 N/A LEU 503.A N LYS 511.A O no hydrogen 3.012 N/A PHE 504.A N PRO 217.A O no hydrogen 3.208 N/A ASP 505.A N CYS 509.A O no hydrogen 2.817 N/A HIS 506.A ND1 GLU 522.A OE2 no hydrogen 3.344 N/A MET 507.A N ASP 505.A OD1 no hydrogen 2.752 N/A GLY 508.A N ASP 505.A O no hydrogen 3.000 N/A CYS 509.A N ASP 505.A OD1 no hydrogen 3.037 N/A LYS 511.A N LEU 503.A O no hydrogen 2.879 N/A LYS 512.A NZ ASN 499.A O no hydrogen 2.870 N/A LYS 512.A NZ GLU 514.A OE2 no hydrogen 3.446 N/A TYR 513.A N MET 501.A O no hydrogen 2.844 N/A TYR 513.A OH GLU 522.A OE1 no hydrogen 2.786 N/A GLN 517.A NE2.A HIS 387.A O no hydrogen 3.272 N/A ASP 518.A N THR 515.A O no hydrogen 3.182 N/A ASP 518.A N THR 515.A OG1 no hydrogen 3.283 N/A LEU 520.A N VAL 516.A O no hydrogen 2.918 N/A LYS 521.A N GLN 517.A O no hydrogen 2.898 N/A LYS 521.A NZ ASP 525.A OD1 no hydrogen 3.250 N/A GLU 522.A N ASP 518.A O no hydrogen 3.053 N/A PHE 523.A N ILE 519.A O no hydrogen 2.948 N/A PHE 524.A N LEU 520.A O no hydrogen 2.958 N/A ASP 525.A N LYS 521.A O no hydrogen 3.123 N/A LEU 526.A N GLU 522.A O no hydrogen 3.447 N/A ARG 527.A N PHE 523.A O no hydrogen 2.884 N/A ARG 527.A NE ARG 527.A O no hydrogen 3.054 N/A ARG 527.A NH1 ASP 323.A OD2 no hydrogen 2.751 N/A ARG 527.A NH2 ASP 323.A OD1 no hydrogen 3.364 N/A ARG 527.A NH2 ASP 323.A OD2 no hydrogen 2.943 N/A LEU 528.A N PHE 524.A O no hydrogen 2.834 N/A SER 529.A N ASP 525.A O no hydrogen 3.134 N/A SER 529.A OG ASP 525.A O no hydrogen 3.436 N/A SER 529.A OG LEU 526.A O no hydrogen 2.879 N/A TYR 530.A N LEU 526.A O no hydrogen 2.977 N/A TYR 531.A N ARG 527.A O no hydrogen 3.056 N/A TYR 531.A OH ASP 645.A OD2 no hydrogen 2.619 N/A GLY 532.A N LEU 528.A O no hydrogen 3.253 N/A LEU 533.A N SER 529.A O no hydrogen 3.095 N/A ARG 534.A N TYR 530.A O no hydrogen 2.858 N/A ARG 534.A NH1 ASP 323.A OD1 no hydrogen 3.359 N/A ARG 534.A NH1 ASP 645.A OD2 no hydrogen 2.987 N/A ARG 534.A NH2 ASP 645.A OD1 no hydrogen 3.072 N/A ARG 534.A NH2 ASP 645.A OD2 no hydrogen 2.588 N/A LYS 535.A N TYR 531.A O no hydrogen 3.064 N/A LYS 535.A NZ LYS 634.A O no hydrogen 3.021 N/A LYS 535.A NZ LYS 636.A O no hydrogen 2.904 N/A GLU 536.A N GLY 532.A O no hydrogen 3.082 N/A TRP 537.A N LEU 533.A O no hydrogen 2.843 N/A LEU 538.A N ARG 534.A O no hydrogen 2.821 N/A VAL 539.A N LYS 535.A O no hydrogen 2.849 N/A GLY 540.A N GLU 536.A O no hydrogen 3.110 N/A MET 541.A N TRP 537.A O no hydrogen 2.977 N/A LEU 542.A N LEU 538.A O no hydrogen 2.833 N/A GLY 543.A N VAL 539.A O no hydrogen 2.892 N/A ALA 544.A N GLY 540.A O no hydrogen 2.804 N/A GLU 545.A N MET 541.A O no hydrogen 2.859 N/A SER 546.A N LEU 542.A O no hydrogen 2.749 N/A THR 547.A N GLY 543.A O no hydrogen 2.876 N/A THR 547.A OG1 GLY 543.A O no hydrogen 3.297 N/A LYS 548.A N ALA 544.A O no hydrogen 2.832 N/A LYS 548.A NZ ASP 586.A OD1 no hydrogen 3.174 N/A LYS 548.A NZ ASP 586.A OD2 no hydrogen 3.136 N/A LEU 549.A N GLU 545.A O no hydrogen 3.102 N/A ASN 550.A N SER 546.A O no hydrogen 2.957 N/A ASN 551.A N THR 547.A O no hydrogen 3.107 N/A ASN 551.A ND2 THR 547.A O no hydrogen 3.006 N/A ASN 551.A ND2 GLU 584.A OE2 no hydrogen 3.317 N/A GLN 552.A N LYS 548.A O no hydrogen 3.098 N/A GLN 552.A NE2 TYR 602.A O no hydrogen 2.779 N/A ALA 553.A N LEU 549.A O no hydrogen 2.733 N/A ARG 554.A N ASN 550.A O no hydrogen 2.830 N/A ARG 554.A NE GLU 558.A OE2 no hydrogen 2.882 N/A ARG 554.A NH1 ARG 581.A O no hydrogen 2.911 N/A ARG 554.A NH2 GLU 558.A OE2 no hydrogen 3.081 N/A ARG 554.A NH2 ARG 581.A O no hydrogen 2.594 N/A PHE 555.A N ASN 551.A O no hydrogen 3.041 N/A ILE 556.A N GLN 552.A O no hydrogen 3.170 N/A LEU 557.A N ALA 553.A O no hydrogen 3.272 N/A GLU 558.A N ARG 554.A O no hydrogen 3.041 N/A LYS 559.A N PHE 555.A O no hydrogen 2.817 N/A LYS 559.A NZ GLU 567.A OE2 no hydrogen 3.123 N/A ILE 560.A N ILE 556.A O no hydrogen 2.867 N/A GLY 562.A N LYS 559.A O no hydrogen 3.064 N/A LYS 563.A NZ GLN 561.A OE1 no hydrogen 2.334 N/A ILE 566.A N GLU 567.A OE1 no hydrogen 3.143 N/A GLU 567.A N GLU 567.A OE1 no hydrogen 2.567 N/A ARG 569.A N ILE 566.A O no hydrogen 3.011 N/A ARG 569.A NH1 THR 565.A O no hydrogen 3.428 N/A ASP 573.A N SER 570.A OG no hydrogen 3.360 N/A LEU 574.A N SER 570.A O no hydrogen 2.909 N/A ILE 575.A N LYS 571.A O no hydrogen 2.867 N/A GLN 576.A N LYS 572.A O no hydrogen 3.001 N/A MET 577.A N ASP 573.A O no hydrogen 2.971 N/A LEU 578.A N LEU 574.A O no hydrogen 2.978 N/A VAL 579.A N ILE 575.A O no hydrogen 3.010 N/A GLN 580.A N GLN 576.A O no hydrogen 2.920 N/A ARG 581.A N LEU 578.A O no hydrogen 3.331 N/A ARG 581.A NE GLU 558.A OE1 no hydrogen 3.244 N/A ARG 581.A NH2 GLU 558.A OE1 no hydrogen 3.161 N/A GLY 582.A N VAL 579.A O no hydrogen 2.756 N/A TYR 583.A N LEU 578.A O no hydrogen 2.964 N/A TYR 583.A OH GLU 558.A OE1 no hydrogen 2.719 N/A GLU 584.A N ASN 551.A OD1 no hydrogen 2.826 N/A ASP 586.A N ASP 599.A O no hydrogen 2.935 N/A LYS 589.A N ASP 586.A OD1 no hydrogen 2.884 N/A LYS 589.A NZ ASP 599.A OD1 no hydrogen 2.984 N/A ALA 590.A N ASP 586.A O no hydrogen 2.877 N/A TRP 591.A N PRO 587.A O no hydrogen 2.833 N/A LYS 592.A N VAL 588.A O no hydrogen 3.026 N/A GLU 593.A N LYS 589.A O no hydrogen 2.950 N/A ALA 594.A N ALA 590.A O no hydrogen 2.905 N/A GLN 595.A N TRP 591.A O no hydrogen 3.166 N/A ASP 599.A N SER 585.A OG no hydrogen 2.762 N/A ASN 601.A N ASP 599.A OD2 no hydrogen 3.036 N/A ASN 601.A ND2 ASP 599.A OD2 no hydrogen 3.226 N/A TYR 602.A OH GLU 584.A O no hydrogen 2.589 N/A ILE 603.A N PHE 600.A O no hydrogen 2.948 N/A LEU 604.A N PHE 600.A O no hydrogen 3.059 N/A ASN 605.A N ASN 601.A O no hydrogen 2.779 N/A MET 606.A N ILE 603.A O no hydrogen 2.949 N/A SER 610.A N SER 607.A O no hydrogen 3.174 N/A SER 610.A OG SER 607.A O no hydrogen 2.762 N/A LEU 611.A N LEU 608.A O no hydrogen 3.005 N/A THR 612.A N TRP 609.A O no hydrogen 2.916 N/A THR 612.A OG1 TRP 609.A O no hydrogen 2.761 N/A LYS 613.A NZ GLU 617.A OE2 no hydrogen 2.667 N/A GLU 614.A N GLU 614.A OE1 no hydrogen 2.733 N/A LYS 615.A NZ GLU 618.A OE1 no hydrogen 3.047 N/A LYS 615.A NZ GLU 618.A OE2 no hydrogen 3.409 N/A VAL 616.A N THR 612.A O no hydrogen 2.836 N/A GLU 617.A N LYS 613.A O no hydrogen 3.113 N/A GLU 618.A N GLU 614.A O no hydrogen 2.878 N/A LEU 619.A N LYS 615.A O no hydrogen 3.002 N/A ILE 620.A N VAL 616.A O no hydrogen 3.019 N/A LYS 621.A N GLU 617.A O no hydrogen 3.007 N/A GLN 622.A N GLU 618.A O no hydrogen 3.097 N/A ARG 623.A N LEU 619.A O no hydrogen 3.043 N/A ARG 623.A NE ASP 624.A OD1 no hydrogen 3.006 N/A ARG 623.A NH2 ASP 624.A OD1 no hydrogen 3.000 N/A ASP 624.A N ILE 620.A O no hydrogen 3.022 N/A ALA 625.A N LYS 621.A O no hydrogen 2.847 N/A LYS 626.A N GLN 622.A O no hydrogen 2.989 N/A LYS 626.A NZ GLU 545.A OE1 no hydrogen 2.649 N/A LYS 626.A NZ GLU 629.A OE1 no hydrogen 2.882 N/A GLY 627.A N ARG 623.A O no hydrogen 3.179 N/A ARG 628.A N ASP 624.A O no hydrogen 3.099 N/A GLU 629.A N ALA 625.A O no hydrogen 2.937 N/A VAL 630.A N LYS 626.A O no hydrogen 2.856 N/A ASN 631.A N GLY 627.A O no hydrogen 3.209 N/A ASP 632.A N ARG 628.A O no hydrogen 2.807 N/A LEU 633.A N GLU 629.A O no hydrogen 3.167 N/A LYS 634.A N VAL 630.A O no hydrogen 3.013 N/A ARG 635.A N ASN 631.A O no hydrogen 3.154 N/A LYS 636.A N LEU 633.A O no hydrogen 2.953 N/A LYS 636.A NZ GLU 644.A OE1 no hydrogen 3.465 N/A LYS 636.A NZ GLU 644.A OE2 no hydrogen 2.671 N/A SER 637.A N ASP 640.A OD2 no hydrogen 3.045 N/A ASP 640.A N SER 637.A OG no hydrogen 3.036 N/A LEU 641.A N SER 637.A O no hydrogen 2.980 N/A TRP 642.A N PRO 638.A O no hydrogen 2.904 N/A TRP 642.A NE1 ILE 345.A O no hydrogen 2.942 N/A LYS 643.A N SER 639.A O no hydrogen 2.764 N/A GLU 644.A N ASP 640.A O no hydrogen 2.916 N/A ASP 645.A N LEU 641.A O no hydrogen 3.142 N/A LEU 646.A N TRP 642.A O no hydrogen 2.968 N/A ALA 647.A N LYS 643.A O no hydrogen 3.007 N/A ALA 648.A N GLU 644.A O no hydrogen 3.007 N/A PHE 649.A N ASP 645.A O no hydrogen 2.910 N/A VAL 650.A N LEU 646.A O no hydrogen 2.980 N/A GLU 651.A N ALA 647.A O no hydrogen 3.013 N/A GLU 652.A N ALA 648.A O no hydrogen 3.245 N/A LEU 653.A N PHE 649.A O no hydrogen 2.746 N/A ASP 654.A N VAL 650.A O no hydrogen 2.863 N/A LYS 655.A N GLU 651.A O no hydrogen 3.123 N/A LYS 655.A NZ GLU 652.A OE2 no hydrogen 3.514 N/A VAL 656.A N GLU 652.A O no hydrogen 2.784 N/A GLU 657.A N LEU 653.A O no hydrogen 2.923 N/A SER 658.A N ASP 654.A O no hydrogen 2.932 N/A GLN 659.A N LYS 655.A O no hydrogen 3.045 N/A GLU 660.A N VAL 656.A O no hydrogen 3.031 N/A ARG 661.A N GLU 657.A O no hydrogen 3.191 N/A GLU 662.A N SER 658.A O no hydrogen 3.213 N/A ASP 663.A N GLN 659.A O no hydrogen 2.776 N/A