Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n5c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N ILE 3.A O no hydrogen 3.176 N/A ASP 8.A N ILE 4.A O no hydrogen 2.929 N/A GLN 9.A N ASP 5.A O no hydrogen 2.882 N/A ALA 10.A N VAL 6.A O no hydrogen 2.955 N/A LEU 11.A N VAL 7.A O no hydrogen 2.967 N/A ARG 12.A N ASP 8.A O no hydrogen 2.877 N/A ARG 12.A NH1 GLN 9.A OE1 no hydrogen 2.734 N/A ALA 13.A N GLN 9.A O no hydrogen 2.953 N/A ARG 14.A N ALA 10.A O no hydrogen 2.938 N/A ARG 14.A NH1 HIS 39.A ND1 no hydrogen 2.881 N/A ARG 14.A NH2 GLY 18.A O no hydrogen 3.377 N/A LEU 15.A N LEU 11.A O no hydrogen 2.905 N/A LEU 16.A N ARG 12.A O no hydrogen 3.028 N/A LEU 16.A N ALA 13.A O no hydrogen 2.997 N/A GLY 17.A N ARG 14.A O no hydrogen 3.133 N/A GLY 18.A N ALA 13.A O no hydrogen 2.665 N/A SER 23.A N ASP 29.A OD1 no hydrogen 2.559 N/A SER 23.A OG ASP 29.A OD1 no hydrogen 3.146 N/A ASP 29.A N PHE 25.A O no hydrogen 2.766 N/A SER 30.A N ASP 26.A O no hydrogen 2.891 N/A VAL 31.A N SER 27.A O no hydrogen 2.887 N/A LEU 32.A N LEU 28.A O no hydrogen 2.878 N/A ASN 33.A N ASP 29.A O no hydrogen 2.927 N/A LEU 34.A N SER 30.A O no hydrogen 2.899 N/A GLN 35.A N VAL 31.A O no hydrogen 2.899 N/A GLN 35.A NE2 TYR 123.A OH no hydrogen 2.471 N/A PHE 36.A N LEU 32.A O no hydrogen 2.891 N/A ARG 37.A N ASN 33.A O no hydrogen 2.956 N/A LEU 38.A N LEU 34.A O no hydrogen 2.941 N/A HIS 39.A N GLN 35.A O no hydrogen 2.883 N/A TYR 40.A N PHE 36.A O no hydrogen 2.842 N/A HIS 41.A N ARG 37.A O no hydrogen 3.062 N/A HIS 41.A ND1 ARG 37.A O no hydrogen 2.935 N/A VAL 42.A N LEU 38.A O no hydrogen 2.871 N/A ILE 43.A N HIS 39.A O no hydrogen 2.844 N/A GLY 44.A N TYR 40.A O no hydrogen 3.014 N/A SER 45.A N HIS 41.A O no hydrogen 3.476 N/A VAL 52.A N ALA 49.A O no hydrogen 2.560 N/A CYS 53.A N ALA 49.A O no hydrogen 2.847 N/A CYS 53.A SG PRO 48.A O no hydrogen 3.545 N/A CYS 53.A SG ALA 49.A O no hydrogen 4.034 N/A ASP 54.A N LYS 50.A O no hydrogen 2.859 N/A VAL 55.A N PRO 51.A O no hydrogen 3.003 N/A LEU 56.A N VAL 52.A O no hydrogen 2.933 N/A LEU 57.A N CYS 53.A O no hydrogen 2.871 N/A LYS 58.A N ASP 54.A O no hydrogen 2.973 N/A GLU 59.A N VAL 55.A O no hydrogen 2.898 N/A SER 60.A N LEU 56.A O no hydrogen 2.843 N/A SER 60.A OG LEU 56.A O no hydrogen 2.410 N/A GLN 61.A N LEU 57.A O no hydrogen 2.868 N/A ASN 62.A N LYS 58.A O no hydrogen 2.911 N/A ASN 62.A ND2 LYS 58.A O no hydrogen 2.359 N/A LEU 63.A N GLU 59.A O no hydrogen 2.827 N/A GLU 64.A N SER 60.A O no hydrogen 2.852 N/A LYS 65.A N GLN 61.A O no hydrogen 2.938 N/A ASN 66.A N ASN 62.A O no hydrogen 2.944 N/A ASN 66.A ND2 ASN 62.A O no hydrogen 2.684 N/A GLU 69.A N GLU 69.A OE1 no hydrogen 2.596 N/A ASN 71.A N GLU 68.A O no hydrogen 2.840 N/A TYR 73.A N LEU 70.A O no hydrogen 2.709 N/A THR 77.A OG1 PRO 74.A O no hydrogen 2.995 N/A LYS 78.A NZ ASN 114.A O no hydrogen 3.286 N/A VAL 80.A N ILE 76.A O no hydrogen 2.994 N/A GLU 81.A N THR 77.A O no hydrogen 2.966 N/A LYS 82.A N LYS 78.A O no hydrogen 2.938 N/A LYS 82.A NZ THR 115.A OG1 no hydrogen 2.841 N/A LYS 82.A NZ ASP 124.A OD1 no hydrogen 3.166 N/A LYS 82.A NZ ASP 124.A OD2 no hydrogen 2.681 N/A ILE 83.A N LEU 79.A O no hydrogen 3.012 N/A LEU 84.A N VAL 80.A O no hydrogen 2.987 N/A PHE 85.A N GLU 81.A O no hydrogen 2.936 N/A ASN 86.A N LYS 82.A O no hydrogen 2.947 N/A ASN 86.A ND2 LEU 127.A O no hydrogen 3.123 N/A ASN 86.A ND2 GLU 130.A OE2 no hydrogen 3.150 N/A CYS 87.A N ILE 83.A O no hydrogen 2.960 N/A CYS 87.A SG ILE 83.A O no hydrogen 3.378 N/A LEU 88.A N LEU 84.A O no hydrogen 2.895 N/A GLY 89.A N PHE 85.A O no hydrogen 2.920 N/A ILE 90.A N ASN 86.A O no hydrogen 2.919 N/A LEU 91.A N CYS 87.A O no hydrogen 2.939 N/A PHE 92.A N LEU 88.A O no hydrogen 2.903 N/A PHE 93.A N GLY 89.A O no hydrogen 2.942 N/A HIS 94.A N ILE 90.A O no hydrogen 2.904 N/A HIS 94.A NE2 TYR 134.A OH no hydrogen 3.324 N/A ARG 95.A N LEU 91.A O no hydrogen 2.925 N/A GLY 96.A N PHE 92.A O no hydrogen 3.266 N/A GLN 97.A N PHE 92.A O no hydrogen 2.792 N/A SER 101.A N GLN 97.A O no hydrogen 3.096 N/A SER 101.A OG PHE 98.A O no hydrogen 2.588 N/A GLN 102.A N PHE 98.A O no hydrogen 2.892 N/A ARG 103.A N GLN 99.A O no hydrogen 2.895 N/A CYS 104.A N GLU 100.A O no hydrogen 2.955 N/A CYS 104.A SG GLU 100.A O no hydrogen 3.518 N/A LEU 105.A N SER 101.A O no hydrogen 2.885 N/A LEU 106.A N GLN 102.A O no hydrogen 2.883 N/A HIS 107.A N ARG 103.A O no hydrogen 2.929 N/A SER 108.A N CYS 104.A O no hydrogen 2.926 N/A SER 108.A OG LYS 82.A O no hydrogen 3.079 N/A SER 108.A OG ASN 86.A OD1 no hydrogen 2.941 N/A LEU 109.A N LEU 105.A O no hydrogen 2.887 N/A LYS 110.A N LEU 106.A O no hydrogen 2.902 N/A ILE 111.A N HIS 107.A O no hydrogen 2.943 N/A HIS 112.A N SER 108.A O no hydrogen 2.895 N/A ASN 113.A N LEU 109.A O no hydrogen 2.921 N/A ASN 114.A N LYS 110.A O no hydrogen 3.257 N/A THR 115.A N HIS 112.A O no hydrogen 3.217 N/A THR 115.A OG1 ILE 111.A O no hydrogen 3.040 N/A THR 115.A OG1 HIS 112.A O no hydrogen 2.500 N/A LYS 117.A NZ ALA 116.A O no hydrogen 3.473 N/A THR 118.A OG1 ASP 8.A OD1 no hydrogen 3.210 N/A GLN 122.A N ALA 119.A O no hydrogen 2.954 N/A TYR 123.A N LEU 120.A O no hydrogen 2.912 N/A ARG 125.A N GLU 121.A O no hydrogen 2.926 N/A TYR 126.A N GLN 122.A O no hydrogen 2.965 N/A TYR 126.A OH GLN 35.A OE1 no hydrogen 2.502 N/A TYR 126.A OH GLU 130.A OE1 no hydrogen 2.543 N/A LEU 127.A N TYR 123.A O no hydrogen 2.899 N/A ILE 128.A N ASP 124.A O no hydrogen 2.924 N/A VAL 129.A N ARG 125.A O no hydrogen 2.988 N/A GLU 130.A N TYR 126.A O no hydrogen 2.907 N/A ASN 131.A N LEU 127.A O no hydrogen 2.917 N/A ASN 131.A ND2 ASN 86.A OD1 no hydrogen 3.094 N/A ASN 131.A ND2 LEU 105.A O no hydrogen 2.908 N/A LEU 132.A N ILE 128.A O no hydrogen 2.884 N/A TYR 133.A N VAL 129.A O no hydrogen 2.927 N/A TYR 134.A N GLU 130.A O no hydrogen 2.976 N/A TYR 134.A OH HIS 94.A NE2 no hydrogen 3.324 N/A ARG 135.A N ASN 131.A O no hydrogen 2.907 N/A ARG 135.A NE ASN 131.A OD1 no hydrogen 2.413 N/A ARG 135.A NH1 GLU 151.A OE1 no hydrogen 3.164 N/A ARG 135.A NH1 GLU 151.A OE2 no hydrogen 3.378 N/A ARG 135.A NH2 GLU 151.A OE1 no hydrogen 2.721 N/A GLY 136.A N LEU 132.A O no hydrogen 2.920 N/A LEU 137.A N TYR 133.A O no hydrogen 2.933 N/A VAL 138.A N TYR 134.A O no hydrogen 2.928 N/A SER 139.A OG GLY 136.A O no hydrogen 3.177 N/A ASN 146.A N ASN 143.A O no hydrogen 2.901 N/A VAL 147.A N ILE 144.A O no hydrogen 2.964 N/A TYR 149.A N GLN 145.A O no hydrogen 2.883 N/A LYS 150.A N ASN 146.A O no hydrogen 3.027 N/A GLU 151.A N VAL 147.A O no hydrogen 2.951 N/A LEU 152.A N PHE 148.A O no hydrogen 2.906 N/A LEU 153.A N TYR 149.A O no hydrogen 3.073 N/A ALA 154.A N LYS 150.A O no hydrogen 2.987 N/A HIS 155.A N GLU 151.A O no hydrogen 2.914 N/A VAL 156.A N LEU 152.A O no hydrogen 3.030 N/A ILE 159.A N HIS 247.A NE2 no hydrogen 2.970 N/A GLU 162.A N ASP 337.A OD2 no hydrogen 2.934 N/A ASN 164.A N PRO 161.A O no hydrogen 2.923 N/A ASN 164.A ND2 GLN 122.A O no hydrogen 3.512 N/A GLY 165.A N LEU 15.A O no hydrogen 3.035 N/A LEU 167.A N ASN 164.A OD1 no hydrogen 3.343 N/A PHE 168.A N ASN 164.A O no hydrogen 3.158 N/A GLU 169.A N GLY 165.A O no hydrogen 2.891 N/A TYR 170.A N LEU 166.A O no hydrogen 2.974 N/A TYR 170.A OH HIS 39.A NE2 no hydrogen 3.152 N/A TYR 170.A OH GLU 130.A OE1 no hydrogen 3.205 N/A ILE 171.A N LEU 167.A O no hydrogen 2.912 N/A SER 172.A N PHE 168.A O no hydrogen 2.927 N/A SER 172.A OG PHE 168.A O no hydrogen 3.044 N/A SER 172.A OG GLU 169.A O no hydrogen 2.357 N/A LEU 173.A N GLU 169.A O no hydrogen 2.915 N/A ILE 174.A N TYR 170.A O no hydrogen 2.937 N/A VAL 175.A N ILE 171.A O no hydrogen 2.897 N/A ALA 176.A N SER 172.A O no hydrogen 2.893 N/A LYS 177.A N LEU 173.A O no hydrogen 2.982 N/A LYS 177.A NZ TYR 133.A OH no hydrogen 3.425 N/A LEU 178.A N ILE 174.A O no hydrogen 3.099 N/A LEU 178.A N VAL 175.A O no hydrogen 3.181 N/A LEU 186.A N GLN 182.A O no hydrogen 3.423 N/A ALA 187.A N ILE 183.A O no hydrogen 2.868 N/A GLU 188.A N GLN 184.A O no hydrogen 2.931 N/A ASN 189.A N ASP 185.A O no hydrogen 2.885 N/A ASN 189.A ND2 TYR 149.A OH no hydrogen 2.738 N/A PHE 190.A N LEU 186.A O no hydrogen 2.932 N/A LYS 191.A N GLU 188.A O no hydrogen 3.106 N/A THR 192.A N ALA 187.A O no hydrogen 3.054 N/A THR 192.A OG1 PHE 190.A O no hydrogen 3.241 N/A ASN 196.A N THR 193.A O no hydrogen 3.292 N/A PHE 198.A N ASN 196.A OD1 no hydrogen 2.978 N/A ILE 199.A N ASN 196.A OD1 no hydrogen 3.316 N/A LEU 200.A N ASN 196.A O no hydrogen 3.223 N/A PHE 201.A N PRO 197.A O no hydrogen 2.903 N/A LEU 202.A N PHE 198.A O no hydrogen 2.911 N/A TYR 203.A N ILE 199.A O no hydrogen 2.939 N/A LYS 205.A N LEU 202.A O no hydrogen 2.937 N/A LYS 205.A NZ VAL 175.A O no hydrogen 3.202 N/A LYS 205.A NZ LEU 178.A O no hydrogen 2.536 N/A LYS 206.A NZ ILE 215.A O no hydrogen 3.311 N/A GLN 208.A N ILE 204.A O no hydrogen 2.886 N/A GLN 208.A NE2 SER 172.A O no hydrogen 2.317 N/A SER 209.A N LYS 205.A O no hydrogen 3.226 N/A SER 209.A OG LYS 205.A O no hydrogen 3.507 N/A LYS 213.A NZ ASN 181.A OD1 no hydrogen 3.062 N/A TYR 221.A N ASN 217.A O no hydrogen 2.976 N/A LEU 222.A N ASP 218.A O no hydrogen 2.921 N/A LYS 223.A N ASP 219.A O no hydrogen 2.902 N/A PHE 224.A N LEU 220.A O no hydrogen 2.942 N/A GLY 225.A N TYR 221.A O no hydrogen 2.901 N/A GLN 226.A N LEU 222.A O no hydrogen 2.890 N/A ASN 227.A N LYS 223.A O no hydrogen 2.909 N/A ASN 227.A ND2 GLU 195.A OE2 no hydrogen 2.835 N/A VAL 228.A N PHE 224.A O no hydrogen 2.953 N/A LEU 229.A N GLY 225.A O no hydrogen 2.884 N/A LEU 230.A N GLN 226.A O no hydrogen 2.901 N/A LYS 231.A N ASN 227.A O no hydrogen 3.000 N/A ALA 232.A N LEU 229.A O no hydrogen 3.158 N/A GLU 246.A N ASP 242.A O no hydrogen 3.098 N/A HIS 247.A N GLU 243.A O no hydrogen 2.896 N/A PHE 248.A N ALA 244.A O no hydrogen 2.897 N/A ASN 249.A N LEU 245.A O no hydrogen 2.958 N/A LEU 252.A N PHE 248.A O no hydrogen 2.945 N/A GLN 253.A N ASN 249.A O no hydrogen 2.903 N/A GLN 253.A NE2 GLU 285.A O no hydrogen 3.300 N/A GLN 253.A NE2 GLU 285.A OE1 no hydrogen 3.018 N/A TYR 254.A N VAL 250.A O no hydrogen 3.041 N/A TYR 255.A N PHE 251.A O no hydrogen 2.872 N/A PHE 256.A N LEU 252.A O no hydrogen 2.887 N/A LYS 257.A N GLN 253.A O no hydrogen 2.962 N/A PHE 258.A N TYR 254.A O no hydrogen 2.973 N/A THR 259.A N TYR 255.A O no hydrogen 2.913 N/A THR 259.A OG1 PHE 256.A O no hydrogen 2.786 N/A HIS 260.A N PHE 256.A O no hydrogen 2.946 N/A HIS 260.A N LYS 257.A O no hydrogen 3.190 N/A ILE 261.A N LYS 257.A O no hydrogen 2.925 N/A LYS 262.A N PHE 258.A O no hydrogen 2.980 N/A LYS 263.A N HIS 260.A O no hydrogen 3.065 N/A VAL 266.A N ASN 299.A OD1 no hydrogen 3.227 N/A ASN 267.A N ASP 218.A OD2 no hydrogen 3.214 N/A SER 269.A N ASN 267.A OD1 no hydrogen 2.894 N/A SER 269.A OG ASN 267.A OD1 no hydrogen 2.221 N/A TRP 270.A N ASN 267.A O no hydrogen 3.110 N/A TRP 270.A NE1 ASP 218.A OD1 no hydrogen 2.304 N/A TYR 271.A N PRO 268.A O no hydrogen 2.933 N/A PHE 273.A N SER 269.A O no hydrogen 3.503 N/A ILE 274.A N TRP 270.A O no hydrogen 3.039 N/A ILE 275.A N TYR 271.A O no hydrogen 3.086 N/A SER 276.A N ASN 272.A O no hydrogen 2.981 N/A SER 276.A OG ASN 272.A O no hydrogen 3.443 N/A SER 277.A N PHE 273.A O no hydrogen 2.763 N/A SER 277.A OG PHE 273.A O no hydrogen 2.955 N/A LYS 279.A N SER 276.A O no hydrogen 2.862 N/A LYS 279.A NZ ALA 232.A O no hydrogen 3.446 N/A THR 280.A OG1 SER 277.A O no hydrogen 2.689 N/A PHE 281.A N ASN 241.A OD1 no hydrogen 2.958 N/A SER 283.A OG GLU 246.A OE1 no hydrogen 2.713 N/A SER 283.A OG GLU 246.A OE2 no hydrogen 3.439 N/A VAL 286.A N SER 283.A OG no hydrogen 3.160 N/A SER 287.A N SER 283.A O no hydrogen 3.390 N/A SER 287.A OG SER 283.A O no hydrogen 2.672 N/A LYS 288.A N ILE 284.A O no hydrogen 2.969 N/A LYS 288.A NZ SER 340.A O no hydrogen 3.032 N/A THR 289.A N GLU 285.A O no hydrogen 2.935 N/A THR 289.A OG1 ASN 249.A O no hydrogen 2.661 N/A THR 289.A OG1 GLU 285.A O no hydrogen 2.626 N/A ALA 290.A N VAL 286.A O no hydrogen 2.895 N/A LEU 292.A N THR 289.A O no hydrogen 2.924 N/A PHE 293.A N ALA 290.A O no hydrogen 2.895 N/A GLN 294.A NE2 ASP 298.A OD2 no hydrogen 2.933 N/A ASN 295.A N PHE 291.A O no hydrogen 2.968 N/A LEU 296.A N LEU 292.A O no hydrogen 2.867 N/A SER 297.A N PHE 293.A O no hydrogen 2.915 N/A SER 297.A OG LYS 306.A O no hydrogen 3.324 N/A ASP 298.A N GLN 294.A O no hydrogen 2.954 N/A ASN 299.A N ASN 295.A O no hydrogen 2.916 N/A SER 300.A N SER 297.A O no hydrogen 3.309 N/A SER 300.A OG ASP 302.A O no hydrogen 3.005 N/A LYS 306.A N ASP 302.A O no hydrogen 3.051 N/A LYS 307.A N GLU 303.A O no hydrogen 2.952 N/A THR 308.A N ILE 304.A O no hydrogen 2.908 N/A THR 308.A OG1 ILE 304.A O no hydrogen 2.610 N/A PHE 309.A N LYS 305.A O no hydrogen 2.936 N/A LYS 310.A N LYS 306.A O no hydrogen 2.934 N/A LYS 310.A NZ GLN 294.A OE1 no hydrogen 2.712 N/A LYS 310.A NZ ASN 351.A O no hydrogen 2.406 N/A ARG 311.A N LYS 307.A O no hydrogen 2.922 N/A GLU 312.A N THR 308.A O no hydrogen 2.931 N/A SER 313.A N PHE 309.A O no hydrogen 2.911 N/A ILE 314.A N LYS 310.A O no hydrogen 2.971 N/A LEU 315.A N ARG 311.A O no hydrogen 2.914 N/A ASN 316.A N GLU 312.A O no hydrogen 2.943 N/A PHE 317.A N SER 313.A O no hydrogen 2.960 N/A VAL 318.A N ILE 314.A O no hydrogen 2.971 N/A ASN 319.A N LEU 315.A O no hydrogen 2.934 N/A PHE 320.A N ASN 316.A O no hydrogen 2.923 N/A VAL 321.A N PHE 317.A O no hydrogen 2.939 N/A LYS 322.A N VAL 318.A O no hydrogen 2.960 N/A TYR 323.A N ASN 319.A O no hydrogen 2.921 N/A ASN 324.A N PHE 320.A O no hydrogen 2.967 N/A ASP 325.A N VAL 321.A O no hydrogen 2.915 N/A LYS 326.A N LYS 322.A O no hydrogen 2.946 N/A TYR 327.A N TYR 323.A O no hydrogen 2.947 N/A TYR 328.A N ASN 324.A O no hydrogen 2.912 N/A GLN 329.A N ASP 325.A O no hydrogen 2.889 N/A LEU 330.A N LYS 326.A O no hydrogen 2.976 N/A HIS 331.A N TYR 327.A O no hydrogen 3.029 N/A ASP 332.A N TYR 327.A O no hydrogen 3.289 N/A SER 340.A N ASP 337.A OD1 no hydrogen 3.111 N/A PHE 341.A N ASP 337.A O no hydrogen 3.010 N/A ILE 342.A N ILE 338.A O no hydrogen 2.849 N/A ASP 343.A N ILE 339.A O no hydrogen 2.874 N/A ALA 344.A N SER 340.A O no hydrogen 2.877 N/A TYR 345.A N PHE 341.A O no hydrogen 2.970 N/A SER 346.A N ILE 342.A O no hydrogen 2.885 N/A SER 346.A OG ILE 342.A O no hydrogen 2.752 N/A PHE 347.A N ASP 343.A O no hydrogen 2.879 N/A ILE 348.A N ALA 344.A O no hydrogen 2.970 N/A LEU 349.A N TYR 345.A O no hydrogen 2.931 N/A GLN 350.A N SER 346.A O no hydrogen 2.896 N/A ASN 351.A N PHE 347.A O no hydrogen 2.962 N/A ASN 351.A ND2 PHE 347.A O no hydrogen 2.649 N/A SER 352.A OG ILE 348.A O no hydrogen 2.204 N/A SER 353.A N ASP 356.A OD2 no hydrogen 2.982 N/A SER 353.A OG THR 355.A OG1 no hydrogen 3.372 N/A SER 353.A OG ASP 356.A OD2 no hydrogen 3.123 N/A LYS 354.A NZ ASP 365.A OD2 no hydrogen 3.042 N/A THR 355.A OG1 SER 353.A OG no hydrogen 3.372 N/A THR 355.A OG1 ASP 356.A OD2 no hydrogen 3.521 N/A ASP 356.A N SER 353.A O no hydrogen 3.112 N/A SER 357.A N LYS 354.A O no hydrogen 3.396 N/A SER 357.A OG LYS 354.A O no hydrogen 3.070 N/A ILE 358.A N PHE 362.A O no hydrogen 3.034 N/A PHE 362.A N ILE 358.A O no hydrogen 3.356 N/A TYR 364.A N SER 357.A OG no hydrogen 3.250 N/A TYR 364.A OH LEU 349.A O no hydrogen 3.055 N/A TYR 364.A OH SER 352.A O no hydrogen 2.954 N/A THR 367.A N ASP 363.A O no hydrogen 2.840 N/A THR 367.A OG1 ASP 363.A O no hydrogen 2.643 N/A VAL 368.A N TYR 364.A O no hydrogen 2.886 N/A SER 369.A N ASP 365.A O no hydrogen 2.910 N/A SER 369.A OG ASP 365.A O no hydrogen 3.259 N/A THR 370.A N ASN 366.A O no hydrogen 2.897 N/A THR 370.A OG1 ASN 366.A O no hydrogen 2.678 N/A PHE 371.A N THR 367.A O no hydrogen 2.881 N/A ALA 372.A N VAL 368.A O no hydrogen 2.905 N/A THR 373.A N SER 369.A O no hydrogen 2.914 N/A THR 373.A OG1 SER 369.A O no hydrogen 2.975 N/A SER 374.A N THR 370.A O no hydrogen 2.869 N/A SER 374.A OG THR 370.A O no hydrogen 3.463 N/A SER 374.A OG PHE 371.A O no hydrogen 2.772 N/A LEU 375.A N PHE 371.A O no hydrogen 2.940 N/A ASN 376.A N ALA 372.A O no hydrogen 2.928 N/A SER 377.A N THR 373.A O no hydrogen 2.890 N/A PHE 378.A N SER 374.A O no hydrogen 2.905 N/A TYR 379.A N LEU 375.A O no hydrogen 2.938 N/A LYS 380.A N ASN 376.A O no hydrogen 2.936 N/A GLU 381.A N SER 377.A O no hydrogen 2.900 N/A TYR 382.A N PHE 378.A O no hydrogen 3.467 N/A ASN 383.A N LYS 380.A O no hydrogen 3.333 N/A LEU 384.A N TYR 379.A O no hydrogen 3.008 N/A GLN 388.A NE2 SER 431.A O no hydrogen 3.462 N/A SER 391.A N GLN 388.A O no hydrogen 3.341 N/A SER 391.A OG GLN 388.A O no hydrogen 2.300 N/A SER 391.A OG ASN 432.A O no hydrogen 3.554 N/A SER 391.A OG THR 435.A OG1 no hydrogen 2.841 N/A LEU 392.A N SER 389.A O no hydrogen 3.169 N/A ASP 393.A N GLU 390.A O no hydrogen 3.417 N/A LEU 395.A N ASP 393.A OD1 no hydrogen 3.088 N/A GLU 396.A N ASP 393.A OD1 no hydrogen 3.431 N/A ASN 397.A ND2 GLU 390.A O no hydrogen 2.566 N/A GLY 405.A N GLU 169.A OE1 no hydrogen 2.862 N/A SER 408.A N PRO 404.A O no hydrogen 2.804 N/A SER 408.A OG TYR 403.A O no hydrogen 3.069 N/A SER 408.A OG PRO 404.A O no hydrogen 3.356 N/A LYS 409.A N GLY 405.A O no hydrogen 2.894 N/A VAL 410.A N ASN 406.A O no hydrogen 2.923 N/A LEU 411.A N ILE 407.A O no hydrogen 2.905 N/A THR 412.A N SER 408.A O no hydrogen 2.909 N/A THR 412.A OG1 SER 408.A O no hydrogen 3.039 N/A THR 412.A OG1 LYS 409.A O no hydrogen 2.852 N/A ASN 413.A N LYS 409.A O no hydrogen 2.951 N/A ALA 414.A N VAL 410.A O no hydrogen 2.901 N/A TRP 415.A N LEU 411.A O no hydrogen 2.934 N/A TRP 415.A NE1 TYR 379.A OH no hydrogen 3.161 N/A SER 416.A N THR 412.A O no hydrogen 2.923 N/A SER 416.A OG THR 412.A O no hydrogen 2.789 N/A THR 417.A N ASN 413.A O no hydrogen 2.942 N/A THR 417.A OG1 ASN 413.A O no hydrogen 3.147 N/A THR 417.A OG1 ALA 414.A O no hydrogen 2.840 N/A LEU 418.A N ALA 414.A O no hydrogen 2.938 N/A TYR 419.A N TRP 415.A O no hydrogen 2.932 N/A GLU 420.A N SER 416.A O no hydrogen 2.913 N/A ILE 421.A N THR 417.A O no hydrogen 2.919 N/A ARG 422.A N LEU 418.A O no hydrogen 2.975 N/A ARG 422.A NH1 TYR 437.A OH no hydrogen 3.055 N/A LYS 423.A NZ GLU 420.A OE1 no hydrogen 3.478 N/A VAL 430.A N LEU 426.A O no hydrogen 2.922 N/A SER 431.A N ASP 427.A O no hydrogen 3.142 N/A SER 431.A OG ASP 427.A O no hydrogen 2.721 N/A ASN 432.A N LEU 429.A O no hydrogen 3.144 N/A ASN 433.A N PHE 428.A O no hydrogen 2.899 N/A LEU 434.A N PHE 428.A O no hydrogen 3.340 N/A THR 435.A OG1 SER 391.A OG no hydrogen 2.841 N/A THR 435.A OG1 ASN 432.A O no hydrogen 3.076 N/A SER 436.A OG ASN 432.A O no hydrogen 3.553 N/A SER 436.A OG ASN 433.A O no hydrogen 2.365 N/A TYR 437.A N ASN 433.A O no hydrogen 2.869 N/A LEU 438.A N LEU 434.A O no hydrogen 2.965 N/A CYS 439.A N THR 435.A O no hydrogen 2.915 N/A ASN 440.A N SER 436.A O no hydrogen 2.853 N/A ALA 441.A N TYR 437.A O no hydrogen 2.964 N/A ALA 449.A N GLU 445.A O no hydrogen 3.035 N/A LEU 450.A N GLU 446.A O no hydrogen 2.896 N/A ARG 451.A N GLU 447.A O no hydrogen 2.947 N/A GLU 452.A N LYS 448.A O no hydrogen 2.929 N/A LEU 453.A N ALA 449.A O no hydrogen 2.945 N/A GLN 454.A N LEU 450.A O no hydrogen 2.882 N/A PHE 455.A N ARG 451.A O no hydrogen 2.932 N/A LYS 456.A N GLU 452.A O no hydrogen 2.925 N/A LYS 456.A NZ GLU 420.A OE2 no hydrogen 3.390 N/A TYR 457.A N LEU 453.A O no hydrogen 2.905 N/A TYR 457.A OH SER 391.A O no hydrogen 2.768 N/A SER 458.A N GLN 454.A O no hydrogen 2.939 N/A SER 458.A OG GLN 454.A O no hydrogen 3.166 N/A SER 458.A OG THR 473.A OG1 no hydrogen 3.070 N/A TYR 459.A N PHE 455.A O no hydrogen 2.872 N/A THR 460.A N LYS 456.A O no hydrogen 2.926 N/A THR 460.A OG1 LYS 456.A O no hydrogen 2.476 N/A LEU 461.A N TYR 457.A O no hydrogen 2.909 N/A ALA 462.A N SER 458.A O no hydrogen 2.866 N/A GLN 463.A N TYR 459.A O no hydrogen 2.931 N/A GLN 464.A N THR 460.A O no hydrogen 3.356 N/A GLN 464.A NE2 ASN 432.A OD1 no hydrogen 2.327 N/A ARG 465.A N ALA 462.A O no hydrogen 2.929 N/A ARG 465.A NE ALA 462.A O no hydrogen 3.294 N/A HIS 466.A N LEU 461.A O no hydrogen 3.008 N/A ALA 470.A N HIS 466.A O no hydrogen 3.075 N/A ILE 471.A N ILE 467.A O no hydrogen 2.876 N/A LYS 472.A N GLU 468.A O no hydrogen 2.990 N/A THR 473.A N THR 469.A O no hydrogen 2.938 N/A THR 473.A OG1 SER 458.A OG no hydrogen 3.070 N/A THR 473.A OG1 THR 469.A O no hydrogen 3.487 N/A THR 473.A OG1 ALA 470.A O no hydrogen 3.088 N/A LEU 474.A N ALA 470.A O no hydrogen 2.956 N/A GLU 475.A N ILE 471.A O no hydrogen 2.845 N/A SER 476.A N LYS 472.A O no hydrogen 2.995 N/A SER 476.A OG LYS 472.A O no hydrogen 3.250 N/A LEU 477.A N THR 473.A O no hydrogen 2.936 N/A LEU 479.A N LEU 474.A O no hydrogen 2.981 N/A SER 480.A N GLU 475.A O no hydrogen 3.228 N/A SER 480.A OG GLU 475.A O no hydrogen 3.041 N/A ASN 482.A ND2 ILE 478.A O no hydrogen 3.074 N/A TYR 485.A OH GLU 452.A OE2 no hydrogen 3.317 N/A TYR 486.A OH SER 517.A OG no hydrogen 2.324 N/A LYS 487.A NZ GLU 452.A OE1 no hydrogen 3.092 N/A HIS 490.A N TYR 486.A O no hydrogen 2.943 N/A LEU 491.A N LYS 487.A O no hydrogen 2.990 N/A LEU 492.A N ALA 488.A O no hydrogen 2.900 N/A ALA 493.A N TRP 489.A O no hydrogen 2.896 N/A LEU 494.A N HIS 490.A O no hydrogen 2.973 N/A CYS 495.A N LEU 491.A O no hydrogen 2.924 N/A CYS 495.A SG LEU 491.A O no hydrogen 3.471 N/A ARG 496.A N LEU 492.A O no hydrogen 2.896 N/A ARG 496.A NH2 GLU 475.A OE2 no hydrogen 2.556 N/A SER 497.A N LEU 494.A O no hydrogen 3.198 N/A SER 497.A OG LEU 494.A O no hydrogen 2.404 N/A VAL 498.A N CYS 495.A O no hydrogen 3.286 N/A GLN 499.A NE2 ASP 501.A O no hydrogen 2.926 N/A LYS 502.A NZ SER 497.A O no hydrogen 2.435 N/A LYS 502.A NZ GLN 499.A O no hydrogen 3.139 N/A TYR 505.A N LYS 502.A O no hydrogen 2.980 N/A LYS 506.A N GLU 503.A O no hydrogen 2.921 N/A LYS 506.A NZ GLU 503.A OE1 no hydrogen 2.901 N/A VAL 508.A N SER 504.A O no hydrogen 2.921 N/A CYS 509.A N TYR 505.A O no hydrogen 2.909 N/A CYS 509.A SG TYR 505.A O no hydrogen 3.244 N/A SER 510.A N LYS 506.A O no hydrogen 2.930 N/A SER 510.A OG LYS 506.A O no hydrogen 3.485 N/A SER 510.A OG ILE 507.A O no hydrogen 3.161 N/A VAL 511.A N ILE 507.A O no hydrogen 2.900 N/A LEU 512.A N VAL 508.A O no hydrogen 2.880 N/A GLU 513.A N CYS 509.A O no hydrogen 2.941 N/A ALA 514.A N SER 510.A O no hydrogen 2.904 N/A ASN 515.A ND2 LEU 512.A O no hydrogen 3.053 N/A GLU 516.A N GLU 513.A O no hydrogen 2.923 N/A SER 517.A N ALA 514.A O no hydrogen 2.899 N/A SER 517.A OG TYR 486.A OH no hydrogen 2.324 N/A SER 517.A OG ALA 514.A O no hydrogen 2.813 N/A GLN 519.A N ASN 515.A O no hydrogen 2.913 N/A ASN 521.A N GLU 516.A O no hydrogen 3.087 N/A THR 522.A OG1 THR 522.A O no hydrogen 2.538 N/A LEU 523.A N SER 517.A O no hydrogen 3.267 N/A ARG 528.A NE LEU 565.A O no hydrogen 3.263 N/A TRP 529.A N ASN 526.A O no hydrogen 3.201 N/A GLN 530.A NE2 CYS 726.A O no hydrogen 2.843 N/A PHE 531.A N ASP 527.A O no hydrogen 2.792 N/A ILE 532.A N ARG 528.A O no hydrogen 3.009 N/A HIS 533.A N TRP 529.A O no hydrogen 2.922 N/A LEU 534.A N GLN 530.A O no hydrogen 2.874 N/A LYS 535.A N PHE 531.A O no hydrogen 2.927 N/A LYS 535.A NZ GLN 538.A OE1 no hydrogen 3.124 N/A LEU 536.A N ILE 532.A O no hydrogen 2.940 N/A THR 537.A N HIS 533.A O no hydrogen 2.913 N/A THR 537.A OG1 HIS 533.A O no hydrogen 3.092 N/A GLN 538.A N LEU 534.A O no hydrogen 2.897 N/A LEU 539.A N LYS 535.A O no hydrogen 2.933 N/A ALA 540.A N LEU 536.A O no hydrogen 2.921 N/A LEU 541.A N THR 537.A O no hydrogen 2.921 N/A ILE 542.A N GLN 538.A O no hydrogen 2.886 N/A GLU 543.A N LEU 539.A O no hydrogen 2.843 N/A GLU 544.A N ALA 540.A O no hydrogen 2.956 N/A ILE 545.A N LEU 541.A O no hydrogen 2.892 N/A PHE 546.A N ILE 542.A O no hydrogen 2.552 N/A ALA 551.A N GLY 547.A O no hydrogen 3.218 N/A LEU 552.A N THR 548.A O no hydrogen 2.888 N/A GLU 553.A N LEU 549.A O no hydrogen 2.999 N/A THR 554.A N ALA 551.A O no hydrogen 3.245 N/A THR 554.A OG1 ALA 551.A O no hydrogen 3.114 N/A LEU 555.A N LEU 552.A O no hydrogen 3.380 N/A VAL 558.A N LEU 555.A O no hydrogen 2.920 N/A GLU 560.A N PRO 556.A O no hydrogen 3.080 N/A LEU 561.A N GLU 557.A O no hydrogen 2.772 N/A TYR 562.A N VAL 558.A O no hydrogen 2.708 N/A TYR 562.A OH LYS 578.A O no hydrogen 2.876 N/A ALA 563.A N PHE 559.A O no hydrogen 2.856 N/A THR 564.A N GLU 560.A O no hydrogen 3.003 N/A THR 564.A OG1 GLU 560.A O no hydrogen 2.904 N/A LEU 565.A N LEU 561.A O no hydrogen 2.873 N/A PHE 566.A N TYR 562.A O no hydrogen 2.877 N/A SER 570.A OG SER 570.A O no hydrogen 2.588 N/A GLN 576.A N LYS 573.A O no hydrogen 3.394 N/A THR 577.A N TYR 574.A O no hydrogen 3.201 N/A TYR 580.A N THR 577.A O no hydrogen 3.155 N/A GLN 583.A N GLU 579.A O no hydrogen 3.065 N/A GLN 583.A NE2 ALA 607.A O no hydrogen 3.639 N/A TRP 585.A N LEU 582.A O no hydrogen 2.951 N/A ILE 586.A N GLN 583.A O no hydrogen 2.949 N/A ALA 588.A N VAL 584.A O no hydrogen 2.938 N/A ALA 589.A N TRP 585.A O no hydrogen 2.895 N/A ASN 590.A N ILE 586.A O no hydrogen 2.914 N/A THR 593.A OG1 TYR 591.A O no hydrogen 3.097 N/A LYS 601.A N ASP 597.A O no hydrogen 2.974 N/A ALA 602.A N GLU 598.A O no hydrogen 2.887 N/A ALA 603.A N ASP 599.A O no hydrogen 2.915 N/A ILE 604.A N ALA 600.A O no hydrogen 2.935 N/A LYS 605.A N LYS 601.A O no hydrogen 2.922 N/A GLU 606.A N ALA 602.A O no hydrogen 2.903 N/A ALA 607.A N ALA 603.A O no hydrogen 2.918 N/A SER 608.A N ILE 604.A O no hydrogen 2.908 N/A ASN 609.A N LYS 605.A O no hydrogen 2.968 N/A VAL 610.A N ALA 607.A O no hydrogen 3.448 N/A ILE 616.A N LEU 612.A O no hydrogen 2.942 N/A ALA 617.A N ASN 613.A O no hydrogen 2.914 N/A ASN 618.A N CYS 614.A O no hydrogen 2.918 N/A GLY 619.A N ASN 615.A O no hydrogen 2.910 N/A TYR 620.A N ILE 616.A O no hydrogen 2.946 N/A TYR 620.A OH ASP 644.A O no hydrogen 3.303 N/A LEU 621.A N ALA 617.A O no hydrogen 2.891 N/A SER 622.A N GLY 619.A O no hydrogen 3.232 N/A SER 622.A OG ASN 618.A O no hydrogen 2.724 N/A ILE 624.A N LEU 621.A O no hydrogen 3.118 N/A LYS 630.A N GLY 626.A O no hydrogen 3.053 N/A GLU 631.A N VAL 627.A O no hydrogen 2.928 N/A PHE 632.A N ALA 628.A O no hydrogen 2.905 N/A GLU 633.A N LEU 629.A O no hydrogen 2.899 N/A THR 634.A N LYS 630.A O no hydrogen 2.896 N/A THR 634.A OG1 LYS 630.A O no hydrogen 2.484 N/A VAL 635.A N GLU 631.A O no hydrogen 2.922 N/A LEU 636.A N PHE 632.A O no hydrogen 2.897 N/A TYR 637.A N GLU 633.A O no hydrogen 2.908 N/A ASN 642.A N ASP 639.A O no hydrogen 3.247 N/A ASN 642.A ND2 ASP 639.A OD2 no hydrogen 3.351 N/A ALA 645.A N ASN 642.A OD1 no hydrogen 2.943 N/A LEU 646.A N ASN 642.A O no hydrogen 3.303 N/A VAL 647.A N LEU 643.A O no hydrogen 2.902 N/A GLY 648.A N ASP 644.A O no hydrogen 2.889 N/A PHE 649.A N ALA 645.A O no hydrogen 2.921 N/A ALA 650.A N LEU 646.A O no hydrogen 2.926 N/A GLU 651.A N VAL 647.A O no hydrogen 2.882 N/A LEU 652.A N GLY 648.A O no hydrogen 2.933 N/A ILE 653.A N PHE 649.A O no hydrogen 2.972 N/A PHE 654.A N ALA 650.A O no hydrogen 2.714 N/A PHE 654.A N GLU 651.A O no hydrogen 3.303 N/A ASN 657.A N ASP 660.A OD2 no hydrogen 3.271 N/A ASP 660.A N ASN 657.A O no hydrogen 3.265 N/A ARG 661.A N ASN 657.A O no hydrogen 3.421 N/A SER 662.A N ASP 658.A O no hydrogen 2.939 N/A SER 662.A OG ASP 658.A O no hydrogen 3.205 N/A ALA 663.A N THR 659.A O no hydrogen 2.971 N/A ALA 664.A N ASP 660.A O no hydrogen 2.926 N/A TYR 665.A N ARG 661.A O no hydrogen 2.840 N/A ALA 666.A N SER 662.A O no hydrogen 2.961 N/A ARG 667.A N ALA 663.A O no hydrogen 2.935 N/A LEU 668.A N ALA 664.A O no hydrogen 2.902 N/A LYS 669.A N TYR 665.A O no hydrogen 2.915 N/A PHE 670.A N ALA 666.A O no hydrogen 2.946 N/A LEU 671.A N ARG 667.A O no hydrogen 2.913 N/A LEU 672.A N LEU 668.A O no hydrogen 2.926 N/A GLU 673.A N LYS 669.A O no hydrogen 2.923 N/A CYS 674.A N PHE 670.A O no hydrogen 2.931 N/A CYS 674.A SG PHE 670.A O no hydrogen 3.449 N/A ALA 675.A N LEU 671.A O no hydrogen 2.914 N/A ILE 676.A N LEU 672.A O no hydrogen 2.948 N/A LEU 677.A N CYS 674.A O no hydrogen 3.038 N/A GLU 678.A N ALA 675.A O no hydrogen 3.267 N/A SER 679.A N ALA 675.A O no hydrogen 2.869 N/A TYR 683.A N SER 679.A O no hydrogen 3.125 N/A TYR 684.A N ILE 680.A O no hydrogen 3.093 N/A SER 685.A N ALA 682.A O no hydrogen 3.250 N/A TRP 689.A N SER 685.A O no hydrogen 3.320 N/A TRP 689.A NE1 TYR 683.A O no hydrogen 2.564 N/A TRP 690.A N PRO 686.A O no hydrogen 2.901 N/A TYR 691.A N GLU 687.A O no hydrogen 2.926 N/A LEU 692.A N VAL 688.A O no hydrogen 2.892 N/A SER 693.A N TRP 689.A O no hydrogen 2.900 N/A SER 693.A OG TRP 689.A O no hydrogen 3.238 N/A SER 693.A OG TRP 690.A O no hydrogen 2.263 N/A LEU 694.A N TRP 690.A O no hydrogen 2.882 N/A ILE 695.A N TYR 691.A O no hydrogen 2.916 N/A TYR 696.A N LEU 692.A O no hydrogen 2.967 N/A TYR 696.A OH GLU 673.A OE2 no hydrogen 2.899 N/A TYR 704.A N ASP 701.A O no hydrogen 3.281 N/A TYR 704.A N ASP 701.A OD1 no hydrogen 3.334 N/A ASN 706.A N ASP 702.A O no hydrogen 2.971 N/A SER 707.A N GLU 703.A O no hydrogen 2.920 N/A SER 707.A OG GLU 703.A O no hydrogen 2.956 N/A SER 707.A OG TYR 704.A O no hydrogen 2.450 N/A LEU 708.A N TYR 704.A O no hydrogen 2.916 N/A LEU 709.A N LYS 705.A O no hydrogen 2.925 N/A LYS 710.A N ASN 706.A O no hydrogen 2.922 N/A CYS 711.A N SER 707.A O no hydrogen 2.916 N/A CYS 711.A SG LEU 708.A O no hydrogen 3.041 N/A ILE 712.A N LEU 708.A O no hydrogen 2.940 N/A LYS 713.A N LEU 709.A O no hydrogen 2.933 N/A TYR 714.A N LYS 710.A O no hydrogen 2.890 N/A GLN 715.A N CYS 711.A O no hydrogen 2.937 N/A GLU 716.A N LYS 713.A O no hydrogen 3.332 N/A LEU 717.A N TYR 714.A O no hydrogen 3.088 N/A ILE 720.A N SER 497.A OG no hydrogen 3.164 N/A ARG 721.A NH1 THR 537.A OG1 no hydrogen 2.795 N/A ARG 721.A NH2 HIS 533.A ND1 no hydrogen 2.994 N/A ARG 724.A NH2 TYR 725.A OH no hydrogen 3.404 N/A TYR 725.A N SER 722.A O no hydrogen 3.448 N/A CYS 726.A N LEU 723.A O no hydrogen 2.947 N/A CYS 726.A SG LEU 723.A O no hydrogen 3.040 N/A ASN 727.A N ARG 724.A O no hydrogen 3.264 N/A TYR 728.A OH HIS 533.A NE2 no hydrogen 3.129 N/A