Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kxw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N TYR 220.A OH no hydrogen 2.487 N/A TYR 6.A N LYS 3.A O no hydrogen 3.109 N/A LEU 7.A N LYS 3.A O no hydrogen 3.223 N/A GLN 8.A N LYS 4.A O no hydrogen 3.101 N/A CYS 9.A N TYR 6.A O no hydrogen 3.150 N/A CYS 9.A SG GLU 5.A O no hydrogen 3.649 N/A VAL 15.A N SER 11.A O no hydrogen 3.300 N/A VAL 16.A N LEU 12.A O no hydrogen 2.967 N/A ARG 17.A N VAL 13.A O no hydrogen 2.974 N/A ARG 17.A NH1 ASP 14.A OD1 no hydrogen 2.967 N/A LEU 18.A N ASP 14.A O no hydrogen 2.964 N/A ARG 19.A N VAL 15.A O no hydrogen 2.945 N/A ARG 19.A NE TYR 220.A O no hydrogen 3.047 N/A ARG 19.A NH2 TYR 220.A O no hydrogen 2.971 N/A ALA 20.A N VAL 16.A O no hydrogen 2.959 N/A LEU 21.A N LEU 18.A O no hydrogen 3.015 N/A HIS 22.A N LEU 18.A O no hydrogen 2.954 N/A SER 23.A N ARG 19.A O no hydrogen 2.782 N/A SER 23.A OG ARG 19.A O no hydrogen 3.156 N/A LYS 26.A N SER 23.A O no hydrogen 3.141 N/A CYS 29.A SG SER 28.A OG no hydrogen 3.598 N/A THR 30.A N ALA 225.A O no hydrogen 2.856 N/A THR 30.A OG1 THR 39.A OG1 no hydrogen 2.704 N/A PHE 31.A N GLU 38.A O no hydrogen 2.845 N/A ASN 33.A N LEU 36.A O no hydrogen 3.181 N/A LEU 36.A N ASN 33.A O no hydrogen 2.944 N/A GLU 38.A N PHE 31.A O no hydrogen 3.084 N/A THR 39.A OG1 THR 30.A OG1 no hydrogen 2.704 N/A THR 40.A OG1 PRO 24.A O no hydrogen 3.280 N/A THR 40.A OG1 GLN 43.A OE1 no hydrogen 3.461 N/A TYR 41.A N LYS 26.A O no hydrogen 3.071 N/A TYR 41.A OH ILE 219.A O no hydrogen 2.521 N/A GLU 42.A N PRO 24.A O no hydrogen 2.950 N/A GLN 43.A N THR 40.A OG1 no hydrogen 3.204 N/A LEU 44.A N THR 40.A O no hydrogen 2.947 N/A ASP 45.A N TYR 41.A O no hydrogen 2.937 N/A GLN 46.A N GLU 42.A O no hydrogen 2.986 N/A HIS 47.A N GLN 43.A O no hydrogen 2.825 N/A ALA 48.A N LEU 44.A O no hydrogen 2.927 N/A LYS 49.A N ASP 45.A O no hydrogen 2.951 N/A LYS 49.A NZ ASP 45.A OD1 no hydrogen 3.508 N/A LYS 49.A NZ ASP 45.A OD2 no hydrogen 2.775 N/A ALA 50.A N GLN 46.A O no hydrogen 2.943 N/A ILE 51.A N HIS 47.A O no hydrogen 2.900 N/A ALA 52.A N ALA 48.A O no hydrogen 2.848 N/A ALA 53.A N LYS 49.A O no hydrogen 2.846 N/A THR 54.A N ALA 50.A O no hydrogen 3.116 N/A THR 54.A OG1 ALA 50.A O no hydrogen 2.959 N/A LEU 55.A N ILE 51.A O no hydrogen 2.928 N/A GLN 56.A N ALA 52.A O no hydrogen 2.906 N/A GLN 56.A NE2 GLN 152.A O no hydrogen 2.699 N/A ALA 57.A N ALA 53.A O no hydrogen 2.826 N/A GLU 58.A N THR 54.A O no hydrogen 2.909 N/A GLU 58.A N LEU 55.A O no hydrogen 3.166 N/A GLY 59.A N GLN 56.A O no hydrogen 3.072 N/A ALA 60.A N LEU 55.A O no hydrogen 3.008 N/A LYS 61.A N ASP 64.A OD2 no hydrogen 2.768 N/A GLY 63.A N GLY 87.A O no hydrogen 2.947 N/A ASP 64.A N LYS 61.A O no hydrogen 2.976 N/A ARG 65.A NE SER 112.A O no hydrogen 2.771 N/A ARG 65.A NH1 GLY 63.A O no hydrogen 2.895 N/A ARG 65.A NH2 SER 112.A O no hydrogen 3.314 N/A VAL 66.A N ILE 89.A O no hydrogen 2.972 N/A LEU 67.A N ILE 116.A O no hydrogen 2.957 N/A LEU 68.A N VAL 91.A O no hydrogen 2.781 N/A LEU 69.A N LEU 118.A O no hydrogen 2.901 N/A GLN 78.A N LEU 74.A O no hydrogen 2.935 N/A ALA 79.A N PRO 75.A O no hydrogen 2.920 N/A PHE 80.A N LEU 76.A O no hydrogen 2.921 N/A LEU 81.A N ILE 77.A O no hydrogen 3.097 N/A GLY 82.A N GLN 78.A O no hydrogen 2.855 N/A CYS 83.A N ALA 79.A O no hydrogen 2.865 N/A CYS 83.A SG ALA 79.A O no hydrogen 3.403 N/A LEU 84.A N PHE 80.A O no hydrogen 3.157 N/A TYR 85.A N LEU 81.A O no hydrogen 2.833 N/A TYR 85.A OH ASP 45.A OD1 no hydrogen 2.615 N/A ALA 86.A N GLY 82.A O no hydrogen 3.209 N/A ALA 86.A N CYS 83.A O no hydrogen 3.079 N/A GLY 87.A N LEU 84.A O no hydrogen 2.919 N/A CYS 88.A N CYS 83.A O no hydrogen 2.972 N/A CYS 88.A SG LYS 61.A O no hydrogen 3.685 N/A CYS 88.A SG ALA 86.A O no hydrogen 3.912 N/A ILE 89.A N ASP 64.A O no hydrogen 2.782 N/A ALA 90.A N ALA 162.A O no hydrogen 3.173 N/A VAL 91.A N VAL 66.A O no hydrogen 2.874 N/A ILE 93.A N LEU 68.A O no hydrogen 2.953 N/A ALA 97.A N PRO 95.A O no hydrogen 2.845 N/A GLU 99.A N GLU 99.A OE1 no hydrogen 2.756 N/A LYS 100.A NZ LYS 100.A O no hydrogen 3.155 N/A LYS 100.A NZ ASP 103.A OD2 no hydrogen 2.670 N/A LEU 102.A N GLN 98.A O no hydrogen 2.942 N/A LEU 102.A N GLU 99.A O no hydrogen 3.131 N/A ASP 103.A N GLU 99.A O no hydrogen 2.951 N/A LYS 104.A N LYS 100.A O no hydrogen 2.916 N/A LYS 104.A NZ GLN 513.A OE1 no hydrogen 3.207 N/A ALA 105.A N LEU 101.A O no hydrogen 3.096 N/A GLN 106.A N LEU 102.A O no hydrogen 2.913 N/A ARG 107.A N ASP 103.A O no hydrogen 2.994 N/A ARG 107.A NE ASP 103.A OD1 no hydrogen 3.033 N/A ARG 107.A NE ASP 103.A OD2 no hydrogen 2.770 N/A ARG 107.A NH2 ASP 103.A OD1 no hydrogen 3.089 N/A ILE 108.A N LYS 104.A O no hydrogen 2.948 N/A VAL 109.A N ALA 105.A O no hydrogen 2.871 N/A THR 110.A N GLN 106.A O no hydrogen 2.977 N/A THR 110.A OG1 GLN 106.A O no hydrogen 2.948 N/A THR 110.A OG1 GLN 106.A OE1 no hydrogen 3.086 N/A ASN 111.A N ARG 107.A O no hydrogen 3.096 N/A ASN 111.A ND2 TYR 166.A OH no hydrogen 2.813 N/A ASN 111.A ND2 TRP 399.A O no hydrogen 3.470 N/A SER 112.A N ILE 108.A O no hydrogen 2.865 N/A SER 112.A OG ILE 108.A O no hydrogen 2.800 N/A LYS 113.A N VAL 109.A O no hydrogen 2.906 N/A LYS 113.A NZ THR 110.A O no hydrogen 2.708 N/A VAL 115.A N ARG 65.A O no hydrogen 2.870 N/A VAL 117.A N PRO 136.A O no hydrogen 2.886 N/A LEU 118.A N LEU 67.A O no hydrogen 2.930 N/A ALA 120.A N GLU 141.A OE1 no hydrogen 2.719 N/A HIS 122.A N ILE 119.A O no hydrogen 2.747 N/A ILE 123.A N ILE 119.A O no hydrogen 3.203 N/A ILE 123.A N ALA 120.A O no hydrogen 3.133 N/A LYS 124.A N ALA 120.A O no hydrogen 3.410 N/A LYS 125.A N ASP 121.A O no hydrogen 3.161 N/A PHE 126.A N HIS 122.A O no hydrogen 2.712 N/A THR 127.A N ILE 123.A O no hydrogen 3.107 N/A THR 127.A OG1 ILE 123.A O no hydrogen 2.443 N/A PHE 132.A N ILE 135.A O no hydrogen 2.882 N/A ILE 135.A N PHE 132.A O no hydrogen 2.816 N/A ALA 137.A N PRO 130.A O no hydrogen 3.006 N/A ILE 138.A N VAL 117.A O no hydrogen 2.942 N/A GLU 141.A N GLU 141.A OE1 no hydrogen 2.846 N/A SER 142.A N ALA 139.A O no hydrogen 2.968 N/A SER 142.A OG ALA 139.A O no hydrogen 2.683 N/A ILE 143.A N LEU 140.A O no hydrogen 2.908 N/A ARG 147.A N GLU 144.A O no hydrogen 2.969 N/A SER 148.A N LEU 145.A O no hydrogen 3.051 N/A SER 148.A OG GLN 46.A O no hydrogen 2.815 N/A SER 148.A OG LEU 145.A O no hydrogen 3.022 N/A SER 150.A N ARG 147.A O no hydrogen 2.786 N/A TRP 151.A N SER 148.A O no hydrogen 3.090 N/A TRP 151.A NE1 TYR 85.A O no hydrogen 2.801 N/A GLN 152.A N GLN 56.A OE1 no hydrogen 3.057 N/A LYS 157.A N ASP 160.A OD2 no hydrogen 2.858 N/A ASP 160.A N LYS 157.A O no hydrogen 2.951 N/A ALA 162.A N VAL 177.A O no hydrogen 2.786 N/A PHE 163.A N VAL 177.A O no hydrogen 3.345 N/A LEU 164.A N ALA 90.A O no hydrogen 2.885 N/A GLN 165.A N VAL 176.A O no hydrogen 2.979 N/A GLN 165.A NE2 ALA 315.A O no hydrogen 3.061 N/A GLN 165.A NE2 THR 318.A O no hydrogen 2.985 N/A THR 167.A N LYS 174.A O no hydrogen 3.139 N/A THR 167.A OG1 SER 168.A O no hydrogen 3.176 N/A THR 171.A OG1 ASN 449.A O no hydrogen 3.021 N/A LYS 174.A NZ SER 170.A OG no hydrogen 2.806 N/A LYS 174.A NZ GLU 404.A OE1 no hydrogen 2.865 N/A VAL 176.A N GLN 165.A O no hydrogen 2.885 N/A HIS 179.A N ASP 160.A O no hydrogen 2.954 N/A HIS 180.A N SER 158.A O no hydrogen 2.885 N/A ASN 181.A N SER 178.A OG no hydrogen 2.908 N/A LEU 182.A N SER 178.A O no hydrogen 3.035 N/A LEU 183.A N HIS 179.A O no hydrogen 3.112 N/A ASP 184.A N HIS 180.A O no hydrogen 2.927 N/A ASN 185.A N ASN 181.A O no hydrogen 3.047 N/A ASN 185.A ND2 LEU 320.A O no hydrogen 3.203 N/A ASN 185.A ND2 SER 393.A OG no hydrogen 3.141 N/A LEU 186.A N LEU 182.A O no hydrogen 2.892 N/A ASN 187.A N LEU 183.A O no hydrogen 3.059 N/A LYS 188.A N ASP 184.A O no hydrogen 3.071 N/A LYS 188.A NZ ASP 184.A OD1 no hydrogen 3.293 N/A LYS 188.A NZ ASP 184.A OD2 no hydrogen 2.792 N/A ILE 189.A N ASN 185.A O no hydrogen 2.794 N/A PHE 190.A N LEU 186.A O no hydrogen 2.959 N/A THR 191.A N ASN 187.A O no hydrogen 2.954 N/A THR 191.A OG1 ASN 187.A O no hydrogen 2.929 N/A SER 192.A N LYS 188.A O no hydrogen 2.820 N/A SER 192.A OG LYS 188.A O no hydrogen 2.825 N/A PHE 193.A N ILE 189.A O no hydrogen 2.958 N/A HIS 194.A N THR 191.A O no hydrogen 3.034 N/A GLU 197.A N ASN 195.A OD1 no hydrogen 2.727 N/A THR 198.A N ASN 195.A O no hydrogen 3.091 N/A THR 198.A OG1 ASN 195.A O no hydrogen 3.015 N/A ILE 199.A N THR 248.A OG1 no hydrogen 3.072 N/A ILE 200.A N GLN 224.A O no hydrogen 3.006 N/A PHE 201.A N ILE 249.A O no hydrogen 3.018 N/A SER 202.A N ILE 226.A O no hydrogen 2.841 N/A LEU 204.A N SER 202.A OG no hydrogen 3.039 N/A HIS 208.A N PRO 205.A O no hydrogen 3.375 N/A LEU 211.A N HIS 208.A O no hydrogen 3.140 N/A ILE 212.A N ASP 209.A O no hydrogen 2.666 N/A CYS 214.A SG SER 202.A OG no hydrogen 3.592 N/A ILE 215.A N LEU 211.A O no hydrogen 3.231 N/A LEU 216.A N LEU 211.A O no hydrogen 2.959 N/A THR 217.A N ILE 212.A O no hydrogen 3.048 N/A THR 217.A OG1 ILE 212.A O no hydrogen 2.784 N/A ILE 219.A N ILE 215.A O no hydrogen 3.124 N/A TYR 220.A N LEU 216.A O no hydrogen 2.907 N/A GLY 221.A N THR 217.A O no hydrogen 2.818 N/A ILE 223.A N PRO 218.A O no hydrogen 2.953 N/A ALA 225.A N SER 28.A O no hydrogen 2.867 N/A ILE 226.A N ILE 200.A O no hydrogen 2.756 N/A SER 227.A OG SER 230.A OG no hydrogen 3.253 N/A SER 230.A N SER 227.A OG no hydrogen 3.185 N/A SER 230.A OG SER 227.A OG no hydrogen 3.253 N/A PHE 231.A N SER 227.A O no hydrogen 3.243 N/A LEU 232.A N PRO 228.A O no hydrogen 2.931 N/A GLN 233.A N PHE 229.A O no hydrogen 2.957 N/A ASN 234.A N SER 230.A O no hydrogen 3.164 N/A ASN 234.A N PHE 231.A O no hydrogen 3.105 N/A SER 237.A N ASN 234.A O no hydrogen 2.861 N/A SER 237.A OG ASN 234.A O no hydrogen 2.786 N/A TRP 238.A N PRO 235.A O no hydrogen 2.993 N/A TRP 238.A NE1 SER 250.A OG no hydrogen 2.783 N/A LYS 240.A N LEU 236.A O no hydrogen 2.888 N/A HIS 241.A N SER 237.A O no hydrogen 2.882 N/A ILE 242.A N TRP 238.A O no hydrogen 3.058 N/A THR 243.A N LEU 239.A O no hydrogen 2.990 N/A THR 243.A OG1 LEU 239.A O no hydrogen 2.806 N/A THR 243.A OG1 ASP 273.A O no hydrogen 3.261 N/A LYS 244.A N LYS 240.A O no hydrogen 2.825 N/A TYR 245.A N HIS 241.A O no hydrogen 2.881 N/A TYR 245.A OH GLU 37.A OE2 no hydrogen 2.755 N/A LYS 246.A N THR 243.A O no hydrogen 3.437 N/A ALA 247.A N ILE 242.A O no hydrogen 3.118 N/A THR 248.A N ILE 199.A O no hydrogen 2.867 N/A THR 248.A OG1 ILE 199.A O no hydrogen 3.455 N/A ILE 249.A N ILE 199.A O no hydrogen 3.169 N/A SER 250.A N THR 279.A O no hydrogen 3.143 N/A SER 250.A OG PHE 201.A O no hydrogen 2.772 N/A SER 252.A N PHE 281.A O no hydrogen 3.162 N/A SER 252.A OG PRO 253.A O no hydrogen 2.942 N/A ASN 254.A ND2 THR 291.A OG1 no hydrogen 2.958 N/A PHE 255.A N GLU 285.A OE2 no hydrogen 2.823 N/A ALA 256.A N PRO 253.A O no hydrogen 3.188 N/A TYR 257.A N ASN 254.A O no hydrogen 3.168 N/A TYR 257.A OH PHE 281.A O no hydrogen 2.716 N/A TYR 259.A N PHE 255.A O no hydrogen 2.900 N/A TYR 259.A OH LEU 232.A O no hydrogen 2.668 N/A CYS 260.A N ALA 256.A O no hydrogen 3.013 N/A CYS 260.A SG ALA 256.A O no hydrogen 3.454 N/A VAL 261.A N TYR 257.A O no hydrogen 3.097 N/A LYS 262.A N ASP 258.A O no hydrogen 2.870 N/A LYS 262.A NZ GLN 555.A O no hydrogen 2.905 N/A LYS 262.A NZ LYS 558.A O no hydrogen 2.704 N/A ARG 263.A N TYR 259.A O no hydrogen 2.955 N/A ILE 264.A N CYS 260.A O no hydrogen 3.074 N/A ARG 265.A NH1 LYS 262.A O no hydrogen 2.932 N/A GLU 267.A N GLU 267.A OE1 no hydrogen 2.752 N/A LYS 268.A N ARG 265.A O no hydrogen 2.860 N/A LYS 269.A N GLU 266.A O no hydrogen 3.214 N/A LYS 269.A NZ GLU 266.A OE1 no hydrogen 2.686 N/A LYS 269.A NZ ALA 297.A O no hydrogen 2.793 N/A LEU 272.A N LYS 269.A O no hydrogen 3.049 N/A ASP 273.A N THR 243.A OG1 no hydrogen 3.026 N/A LEU 274.A N PHE 301.A O no hydrogen 2.749 N/A SER 275.A N ASP 273.A OD1 no hydrogen 3.101 N/A SER 275.A OG ASP 273.A OD1 no hydrogen 2.715 N/A SER 276.A OG ALA 247.A O no hydrogen 2.615 N/A TRP 277.A N LEU 274.A O no hydrogen 3.089 N/A TRP 277.A NE1 SER 250.A O no hydrogen 3.129 N/A VAL 278.A N THR 248.A O no hydrogen 3.013 N/A THR 279.A N THR 248.A O no hydrogen 3.051 N/A ALA 280.A N ALA 307.A O no hydrogen 2.830 N/A PHE 281.A N SER 250.A O no hydrogen 3.128 N/A ASN 282.A N TYR 309.A O no hydrogen 2.981 N/A ASN 282.A ND2 ASN 254.A OD1 no hydrogen 3.001 N/A GLY 283.A N SER 252.A O no hydrogen 3.301 N/A ARG 288.A N ASN 254.A OD1 no hydrogen 2.945 N/A ARG 288.A NE GLU 480.A OE1 no hydrogen 3.405 N/A ARG 288.A NE GLU 480.A OE2 no hydrogen 2.928 N/A ARG 288.A NH1 THR 291.A OG1 no hydrogen 2.825 N/A ARG 288.A NH2 GLU 290.A OE1 no hydrogen 2.845 N/A ARG 288.A NH2 GLU 480.A OE1 no hydrogen 3.533 N/A THR 291.A OG1 ASP 258.A OD1 no hydrogen 3.326 N/A THR 291.A OG1 ASP 258.A OD2 no hydrogen 2.680 N/A HIS 293.A N GLU 290.A O no hydrogen 2.912 N/A PHE 294.A N THR 291.A O no hydrogen 3.033 N/A GLN 296.A N GLU 292.A O no hydrogen 2.949 N/A GLN 296.A NE2 GLU 292.A OE2 no hydrogen 2.876 N/A ALA 297.A N HIS 293.A O no hydrogen 3.030 N/A PHE 298.A N PHE 294.A O no hydrogen 3.061 N/A PHE 298.A N TYR 295.A O no hydrogen 3.265 N/A LYS 299.A N TYR 295.A O no hydrogen 2.883 N/A LYS 299.A NZ GLN 296.A OE1 no hydrogen 2.888 N/A PHE 301.A N PHE 298.A O no hydrogen 2.783 N/A GLY 302.A N LYS 299.A O no hydrogen 3.305 N/A PHE 303.A N PHE 298.A O no hydrogen 3.455 N/A LYS 305.A NZ GLU 289.A OE2 no hydrogen 2.707 N/A LYS 305.A NZ GLU 292.A OE1 no hydrogen 2.892 N/A GLU 306.A N GLU 306.A OE1 no hydrogen 2.770 N/A ALA 307.A N ARG 304.A O no hydrogen 2.977 N/A PHE 308.A N LYS 305.A O no hydrogen 3.067 N/A TYR 309.A N ALA 280.A O no hydrogen 2.914 N/A TYR 309.A OH GLY 324.A O no hydrogen 2.660 N/A CYS 311.A N ASN 282.A O no hydrogen 3.081 N/A CYS 311.A SG ASN 282.A O no hydrogen 4.039 N/A CYS 311.A SG TYR 309.A O no hydrogen 3.852 N/A TYR 312.A N THR 322.A O no hydrogen 3.010 N/A TYR 312.A OH ASP 424.A OD2 no hydrogen 2.654 N/A LEU 314.A N LEU 319.A O no hydrogen 3.167 N/A GLU 316.A N GLU 316.A OE1 no hydrogen 2.660 N/A ALA 317.A N LEU 314.A O no hydrogen 2.966 N/A THR 318.A N ALA 315.A O no hydrogen 2.860 N/A THR 318.A OG1 SER 393.A O no hydrogen 2.633 N/A LEU 319.A N ALA 317.A O no hydrogen 2.811 N/A LEU 320.A N ASN 185.A OD1 no hydrogen 2.941 N/A VAL 321.A N TYR 312.A O no hydrogen 2.894 N/A THR 322.A N TYR 312.A O no hydrogen 3.060 N/A THR 322.A OG1 SER 361.A O no hydrogen 2.816 N/A GLY 323.A N ASN 363.A O no hydrogen 3.086 N/A SER 328.A N THR 325.A O no hydrogen 3.096 N/A SER 328.A OG SER 329.A O no hydrogen 3.497 N/A TYR 330.A OH GLU 289.A OE1 no hydrogen 2.679 N/A LYS 331.A NZ GLU 432.A OE2 no hydrogen 2.678 N/A LEU 333.A N LEU 358.A O no hydrogen 2.874 N/A THR 334.A OG1 ASP 350.A OD2 no hydrogen 3.172 N/A LEU 335.A N TYR 356.A O no hydrogen 2.788 N/A ALA 336.A N HIS 346.A O no hydrogen 2.839 N/A GLN 339.A NE2 ALA 336.A O no hydrogen 2.769 N/A GLN 339.A NE2 HIS 346.A O no hydrogen 2.855 N/A PHE 340.A N GLU 338.A OE2 no hydrogen 3.027 N/A ARG 344.A N ASP 342.A OD1 no hydrogen 3.309 N/A ARG 344.A NH1 ASP 380.A OD2 no hydrogen 3.094 N/A ARG 344.A NH2 ASP 380.A OD2 no hydrogen 3.438 N/A VAL 345.A N ASP 382.A O no hydrogen 2.934 N/A HIS 346.A N GLN 339.A OE1 no hydrogen 2.896 N/A HIS 346.A NE2 ASP 342.A OD1 no hydrogen 2.650 N/A ALA 348.A N THR 334.A O no hydrogen 2.956 N/A SER 352.A N ASP 349.A O no hydrogen 2.768 N/A SER 355.A N SER 352.A O no hydrogen 3.160 N/A SER 355.A OG SER 352.A O no hydrogen 2.697 N/A TYR 356.A N LEU 335.A O no hydrogen 3.016 N/A LEU 358.A N LEU 333.A O no hydrogen 2.820 N/A SER 360.A N LYS 331.A O no hydrogen 2.863 N/A SER 360.A OG GLU 432.A OE1 no hydrogen 2.574 N/A SER 361.A N LEU 433.A O no hydrogen 2.777 N/A GLY 362.A N SER 360.A OG no hydrogen 2.900 N/A ASN 363.A N GLY 323.A O no hydrogen 3.013 N/A ILE 365.A N VAL 321.A O no hydrogen 2.772 N/A GLN 366.A N VAL 321.A O no hydrogen 3.066 N/A GLN 366.A NE2 ALA 317.A O no hydrogen 2.978 N/A GLN 366.A NE2 LEU 320.A O no hydrogen 2.816 N/A GLU 367.A N GLN 390.A O no hydrogen 3.143 N/A LYS 369.A N TRP 388.A O no hydrogen 2.830 N/A ILE 371.A N GLU 386.A O no hydrogen 2.913 N/A ASP 372.A N ILE 377.A O no hydrogen 3.032 N/A ASP 374.A N ASP 372.A OD1 no hydrogen 2.922 N/A THR 375.A N ASP 372.A OD1 no hydrogen 2.993 N/A LEU 376.A N ASP 372.A O no hydrogen 2.740 N/A ILE 377.A N THR 375.A OG1 no hydrogen 3.200 N/A CYS 379.A N ILE 370.A O no hydrogen 2.778 N/A CYS 379.A SG VAL 384.A O no hydrogen 3.803 N/A ASP 380.A N GLN 383.A OE1 no hydrogen 2.875 N/A ASP 382.A N LEU 428.A O no hydrogen 3.004 N/A GLN 383.A N ASP 380.A O no hydrogen 3.080 N/A VAL 384.A N HIS 343.A O no hydrogen 2.867 N/A GLY 385.A N GLY 426.A O no hydrogen 3.068 N/A GLU 386.A N ILE 371.A O no hydrogen 2.703 N/A ILE 387.A N ASP 424.A O no hydrogen 2.852 N/A TRP 388.A N LYS 369.A O no hydrogen 2.786 N/A TRP 388.A NE1 GLU 386.A OE1 no hydrogen 2.900 N/A VAL 389.A N LEU 420.A O no hydrogen 2.936 N/A GLN 390.A N GLU 367.A O no hydrogen 2.984 N/A SER 391.A OG GLN 366.A OE1 no hydrogen 2.659 N/A SER 393.A N SER 391.A OG no hydrogen 2.897 N/A SER 393.A OG ASP 184.A OD2 no hydrogen 2.523 N/A VAL 394.A N SER 391.A O no hydrogen 3.013 N/A ALA 395.A N GLU 316.A O no hydrogen 2.889 N/A TYR 398.A N THR 405.A OG1 no hydrogen 2.838 N/A TYR 398.A OH GLU 316.A OE2 no hydrogen 2.630 N/A TRP 399.A N GLY 175.A O no hydrogen 2.766 N/A GLN 401.A N TYR 398.A O no hydrogen 3.204 N/A GLN 401.A NE2 HIS 172.A O no hydrogen 3.399 N/A GLU 403.A N GLU 403.A OE1 no hydrogen 2.864 N/A THR 405.A N GLN 401.A O no hydrogen 2.917 N/A THR 405.A OG1 TYR 398.A O no hydrogen 3.369 N/A THR 405.A OG1 GLN 401.A O no hydrogen 2.834 N/A ARG 406.A N PRO 402.A O no hydrogen 3.019 N/A HIS 407.A N GLU 403.A O no hydrogen 3.012 N/A ALA 408.A N THR 405.A O no hydrogen 3.309 N/A PHE 409.A N THR 405.A O no hydrogen 2.862 N/A GLY 411.A N TYR 419.A O no hydrogen 2.918 N/A LYS 412.A NZ ALA 417.A O no hydrogen 3.042 N/A LYS 414.A N LEU 376.A O no hydrogen 3.143 N/A LYS 414.A NZ ASP 415.A OD2 no hydrogen 2.776 N/A ASP 416.A N ILE 413.A O no hydrogen 2.919 N/A TYR 419.A N GLY 411.A O no hydrogen 2.974 N/A TYR 419.A OH GLU 367.A OE2 no hydrogen 2.944 N/A LEU 420.A N VAL 389.A O no hydrogen 2.801 N/A ARG 421.A N ALA 408.A O no hydrogen 2.688 N/A ARG 421.A NE GLU 386.A OE1 no hydrogen 2.853 N/A ARG 421.A NH2 PRO 373.A O no hydrogen 2.812 N/A ARG 421.A NH2 GLU 386.A OE1 no hydrogen 3.064 N/A THR 422.A N ILE 387.A O no hydrogen 3.209 N/A THR 422.A OG1 TYR 312.A OH no hydrogen 3.400 N/A THR 422.A OG1 ILE 387.A O no hydrogen 2.773 N/A GLY 423.A N GLU 386.A OE2 no hydrogen 2.800 N/A ASP 424.A N THR 422.A OG1 no hydrogen 3.011 N/A LEU 425.A N GLY 437.A O no hydrogen 2.759 N/A GLY 426.A N GLY 385.A O no hydrogen 3.013 N/A PHE 427.A N TYR 434.A O no hydrogen 2.946 N/A HIS 429.A N GLU 432.A O no hydrogen 2.890 N/A HIS 429.A ND1 ASP 382.A OD1 no hydrogen 2.599 N/A GLU 432.A N HIS 429.A O no hydrogen 2.987 N/A LEU 433.A N GLY 362.A O no hydrogen 2.954 N/A TYR 434.A N PHE 427.A O no hydrogen 2.875 N/A THR 436.A N LEU 425.A O no hydrogen 2.782 N/A GLY 437.A N LEU 425.A O no hydrogen 3.357 N/A ARG 438.A NH1 THR 422.A O no hydrogen 3.025 N/A ARG 438.A NH1 ASP 424.A OD1 no hydrogen 2.842 N/A ILE 439.A N GLY 423.A O no hydrogen 2.953 N/A ILE 443.A N ASP 441.A OD2 no hydrogen 2.942 N/A ILE 444.A N ASP 441.A OD2 no hydrogen 3.368 N/A ILE 445.A N ASP 441.A O no hydrogen 3.037 N/A TYR 446.A N LEU 442.A O no hydrogen 2.903 N/A GLY 447.A N ILE 443.A O no hydrogen 3.057 N/A LYS 448.A N ILE 444.A O no hydrogen 2.962 N/A ASN 449.A N ILE 445.A O no hydrogen 3.061 N/A ASN 449.A ND2 THR 171.A OG1 no hydrogen 3.033 N/A HIS 450.A N GLY 447.A O no hydrogen 3.012 N/A TYR 451.A N TYR 446.A O no hydrogen 3.099 N/A ASP 454.A N HIS 450.A O no hydrogen 2.998 N/A ILE 455.A N TYR 451.A O no hydrogen 2.937 N/A GLU 456.A N PRO 452.A O no hydrogen 3.026 N/A PHE 457.A N GLN 453.A O no hydrogen 3.037 N/A SER 458.A N ASP 454.A O no hydrogen 3.061 N/A SER 458.A OG ASP 454.A O no hydrogen 3.400 N/A SER 458.A OG HIS 512.A NE2 no hydrogen 2.689 N/A LEU 459.A N ILE 455.A O no hydrogen 3.085 N/A SER 461.A N LEU 459.A O no hydrogen 3.400 N/A SER 461.A OG LEU 459.A O no hydrogen 3.064 N/A LEU 463.A N SER 461.A OG no hydrogen 3.237 N/A HIS 464.A N SER 461.A O no hydrogen 3.095 N/A HIS 464.A ND1 SER 461.A O no hydrogen 2.745 N/A HIS 465.A N PRO 462.A O no hydrogen 3.172 N/A VAL 466.A N LEU 463.A O no hydrogen 3.102 N/A LEU 467.A N HIS 464.A O no hydrogen 3.075 N/A GLY 468.A N GLU 487.A O no hydrogen 2.890 N/A LYS 469.A N GLU 487.A OE1 no hydrogen 2.846 N/A CYS 470.A SG GLU 456.A O no hydrogen 3.776 N/A ALA 472.A N GLU 456.A OE2 no hydrogen 2.889 N/A PHE 473.A N THR 484.A O no hydrogen 2.957 N/A ILE 475.A N LYS 482.A O no hydrogen 3.010 N/A GLU 477.A N GLU 480.A O no hydrogen 2.774 N/A GLU 480.A N GLU 477.A O no hydrogen 3.380 N/A LYS 482.A N ILE 475.A O no hydrogen 2.839 N/A THR 484.A N PHE 473.A O no hydrogen 2.703 N/A THR 484.A OG1 LYS 482.A O no hydrogen 3.093 N/A VAL 485.A N THR 518.A O no hydrogen 2.887 N/A GLU 487.A N LYS 469.A O no hydrogen 2.847 N/A VAL 488.A N ILE 522.A O no hydrogen 2.828 N/A LYS 489.A N VAL 466.A O no hydrogen 3.029 N/A LYS 489.A NZ HIS 465.A O no hydrogen 2.886 N/A PHE 492.A N ASN 490.A OD1 no hydrogen 2.874 N/A ALA 496.A N ASP 493.A OD1 no hydrogen 2.921 N/A GLN 497.A N ASP 493.A O no hydrogen 2.959 N/A ASP 498.A N ASP 494.A O no hydrogen 2.986 N/A ASN 499.A N VAL 495.A O no hydrogen 2.946 N/A LEU 500.A N ALA 496.A O no hydrogen 2.796 N/A PHE 501.A N GLN 497.A O no hydrogen 2.828 N/A ASN 502.A N ASP 498.A O no hydrogen 3.026 N/A GLU 503.A N ASN 499.A O no hydrogen 2.898 N/A ILE 504.A N LEU 500.A O no hydrogen 2.887 N/A PHE 505.A N PHE 501.A O no hydrogen 2.981 N/A GLU 506.A N ASN 502.A O no hydrogen 2.946 N/A LEU 507.A N GLU 503.A O no hydrogen 2.932 N/A VAL 508.A N ILE 504.A O no hydrogen 3.137 N/A TYR 509.A N PHE 505.A O no hydrogen 3.065 N/A GLU 510.A N GLU 506.A O no hydrogen 2.965 N/A ASN 511.A N LEU 507.A O no hydrogen 2.948 N/A ASN 511.A ND2 SER 458.A OG no hydrogen 2.907 N/A HIS 512.A N VAL 508.A O no hydrogen 2.893 N/A HIS 512.A NE2 SER 458.A OG no hydrogen 2.689 N/A GLN 513.A N TYR 509.A O no hydrogen 2.952 N/A GLN 513.A NE2 GLU 510.A O no hydrogen 2.981 N/A HIS 517.A N LEU 483.A O no hydrogen 2.883 N/A THR 518.A N LEU 483.A O no hydrogen 3.212 N/A THR 518.A OG1 GLN 555.A OE1 no hydrogen 2.467 N/A ILE 519.A N TRP 554.A O no hydrogen 2.948 N/A VAL 520.A N VAL 485.A O no hydrogen 2.844 N/A LEU 521.A N ALA 552.A O no hydrogen 2.865 N/A ILE 522.A N CYS 486.A O no hydrogen 2.989 N/A ALA 526.A N PRO 523.A O no hydrogen 3.215 N/A SER 531.A N THR 529.A OG1 no hydrogen 2.875 N/A ILE 534.A N SER 531.A OG no hydrogen 3.387 N/A ARG 535.A N SER 531.A O no hydrogen 3.052 N/A ARG 536.A N GLY 532.A O no hydrogen 2.779 N/A ARG 536.A NE GLU 456.A OE2 no hydrogen 2.898 N/A ARG 536.A NH2 GLU 456.A OE1 no hydrogen 2.938 N/A ARG 536.A NH2 GLU 456.A OE2 no hydrogen 3.549 N/A ASN 537.A N LYS 533.A O no hydrogen 2.835 N/A PHE 538.A N ILE 534.A O no hydrogen 3.003 N/A CYS 539.A N ARG 535.A O no hydrogen 3.145 N/A CYS 539.A SG ARG 535.A O no hydrogen 3.410 N/A ARG 540.A N ARG 536.A O no hydrogen 2.961 N/A ARG 540.A NH1 VAL 474.A O no hydrogen 3.183 N/A ARG 540.A NH2 VAL 474.A O no hydrogen 2.683 N/A LYS 541.A N ASN 537.A O no hydrogen 2.982 N/A HIS 542.A N PHE 538.A O no hydrogen 2.924 N/A HIS 542.A ND1 PHE 538.A O no hydrogen 2.946 N/A LEU 543.A N CYS 539.A O no hydrogen 2.971 N/A LEU 544.A N ARG 540.A O no hydrogen 3.256 N/A ASP 545.A N LYS 541.A O no hydrogen 2.903 N/A LYS 546.A N HIS 542.A O no hydrogen 3.213 N/A VAL 551.A N LEU 521.A O no hydrogen 2.758 N/A ALA 552.A N LEU 521.A O no hydrogen 3.411 N/A TRP 554.A N ILE 519.A O no hydrogen 2.822 N/A LEU 556.A N HIS 517.A O no hydrogen 2.915 N/A LYS 558.A N GLN 555.A O no hydrogen 3.161 N/A