Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7om6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 7.A N SER 4.A OG no hydrogen 2.993 N/A MET 8.A N SER 4.A O no hydrogen 2.984 N/A LEU 9.A N LEU 5.A O no hydrogen 3.000 N/A ALA 10.A N GLU 6.A O no hydrogen 3.090 N/A GLU 11.A N ALA 7.A O no hydrogen 2.951 N/A ARG 12.A N MET 8.A O no hydrogen 2.996 N/A ALA 13.A N LEU 9.A O no hydrogen 3.055 N/A MET 14.A N ALA 10.A O no hydrogen 3.247 N/A VAL 15.A N GLU 11.A O no hydrogen 3.147 N/A ALA 16.A N ARG 12.A O no hydrogen 2.939 N/A ARG 17.A N ALA 13.A O no hydrogen 3.114 N/A ARG 17.A NE CYS 578.A O no hydrogen 2.876 N/A ARG 17.A NH2 CYS 578.A O no hydrogen 3.149 N/A ARG 17.A NH2 ASP 586.A OD2 no hydrogen 3.005 N/A GLN 18.A N VAL 15.A O no hydrogen 2.986 N/A ASP 19.A N ALA 16.A O no hydrogen 2.989 N/A LEU 23.A N ASP 19.A O no hydrogen 2.935 N/A LYS 24.A N LEU 20.A O no hydrogen 2.835 N/A ARG 25.A N ALA 21.A O no hydrogen 3.112 N/A LYS 26.A N GLY 22.A O no hydrogen 2.927 N/A LYS 26.A NZ ILE 617.A O no hydrogen 3.193 N/A LEU 27.A N LEU 23.A O no hydrogen 3.041 N/A ALA 28.A N ARG 25.A O no hydrogen 3.337 N/A ALA 30.A N LEU 27.A O no hydrogen 3.292 N/A ARG 32.A NH1 THR 572.A O no hydrogen 2.845 N/A ARG 32.A NH2 THR 572.A O no hydrogen 2.801 N/A VAL 33.A N VAL 609.A O no hydrogen 2.763 N/A ALA 35.A N ASN 570.A OD1 no hydrogen 2.908 N/A GLN 37.A NE2 SER 38.A O no hydrogen 3.034 N/A SER 38.A N GLY 563.A O no hydrogen 3.181 N/A GLN 41.A N ARG 125.A O no hydrogen 2.715 N/A GLN 41.A NE2 PRO 39.A O no hydrogen 3.024 N/A CYS 42.A N ARG 125.A O no hydrogen 3.269 N/A CYS 42.A SG GLY 43.A O no hydrogen 3.300 N/A CYS 42.A SG PHE 124.A O no hydrogen 3.466 N/A ALA 47.A N GLY 43.A O no hydrogen 3.047 N/A GLN 48.A N ARG 44.A O no hydrogen 2.848 N/A ALA 49.A N GLU 45.A O no hydrogen 2.936 N/A GLN 50.A N SER 46.A O no hydrogen 2.942 N/A GLN 50.A NE2 SER 46.A O no hydrogen 3.596 N/A ALA 51.A N ALA 47.A O no hydrogen 3.035 N/A ARG 52.A N GLN 48.A O no hydrogen 2.959 N/A SER 53.A N ALA 49.A O no hydrogen 2.989 N/A VAL 54.A N GLN 50.A O no hydrogen 3.098 N/A THR 55.A N ALA 51.A O no hydrogen 2.900 N/A THR 55.A OG1 ALA 51.A O no hydrogen 2.951 N/A SER 56.A N ARG 52.A O no hydrogen 2.938 N/A GLU 57.A N SER 53.A O no hydrogen 3.179 N/A LEU 58.A N VAL 54.A O no hydrogen 2.905 N/A LYS 59.A N THR 55.A O no hydrogen 2.887 N/A SER 60.A N SER 56.A O no hydrogen 3.181 N/A SER 60.A OG SER 56.A O no hydrogen 3.161 N/A ALA 61.A N GLU 57.A O no hydrogen 3.176 N/A VAL 62.A N LEU 58.A O no hydrogen 3.018 N/A LYS 63.A N LYS 59.A O no hydrogen 2.915 N/A GLU 64.A N SER 60.A O no hydrogen 2.976 N/A ALA 65.A N ALA 61.A O no hydrogen 3.039 N/A GLN 66.A N VAL 62.A O no hydrogen 2.833 N/A GLN 66.A NE2 ALA 113.A O no hydrogen 3.304 N/A GLN 66.A NE2 GLY 144.A O no hydrogen 3.061 N/A GLY 67.A N LYS 63.A O no hydrogen 2.935 N/A GLY 67.A N GLU 64.A O no hydrogen 3.197 N/A LEU 68.A N ALA 65.A O no hydrogen 3.248 N/A HIS 70.A ND1 GLN 71.A O no hydrogen 3.089 N/A GLN 71.A NE2 GLN 151.A OE1 no hydrogen 3.033 N/A LEU 76.A N LEU 73.A O no hydrogen 3.341 N/A GLU 77.A N ARG 417.A O no hydrogen 2.912 N/A LEU 79.A N VAL 415.A O no hydrogen 2.896 N/A VAL 84.A N GLY 104.A O no hydrogen 2.916 N/A CYS 85.A N GLU 245.A OE1 no hydrogen 2.868 N/A HIS 89.A N HIS 92.A O no hydrogen 2.849 N/A HIS 89.A ND1 ASP 218.A OD1 no hydrogen 2.876 N/A HIS 89.A NE2 ASP 221.A OD2 no hydrogen 3.036 N/A HIS 92.A N HIS 89.A O no hydrogen 3.249 N/A HIS 92.A NE2 ASP 218.A OD1 no hydrogen 2.937 N/A VAL 94.A N ILE 87.A O no hydrogen 3.200 N/A HIS 95.A ND1 GLU 245.A OE1 no hydrogen 2.969 N/A HIS 95.A ND1 GLU 245.A OE2 no hydrogen 3.164 N/A HIS 95.A NE2 THR 99.A O no hydrogen 2.815 N/A HIS 100.A ND1 SER 107.A O no hydrogen 3.040 N/A ASN 102.A N LYS 105.A O no hydrogen 2.767 N/A GLY 104.A N ASN 101.A OD1 no hydrogen 2.861 N/A LYS 105.A N ASN 102.A O no hydrogen 2.923 N/A VAL 106.A N TYR 82.A O no hydrogen 2.984 N/A SER 107.A N HIS 100.A O no hydrogen 3.129 N/A VAL 108.A N GLY 412.A O no hydrogen 3.297 N/A ARG 110.A N ASP 411.A OD1 no hydrogen 2.653 N/A ARG 110.A NE ASN 253.A OD1 no hydrogen 3.026 N/A ARG 110.A NH1 GLU 250.A OE2 no hydrogen 2.974 N/A ARG 110.A NH1 ILE 410.A O no hydrogen 2.868 N/A ARG 110.A NH2 GLU 250.A OE2 no hydrogen 2.936 N/A ALA 113.A N ASP 143.A OD2 no hydrogen 3.075 N/A THR 121.A N SER 117.A O no hydrogen 3.194 N/A THR 121.A OG1 SER 117.A O no hydrogen 3.073 N/A CYS 122.A N ASP 118.A O no hydrogen 3.091 N/A CYS 122.A SG ASP 118.A O no hydrogen 3.341 N/A ALA 123.A N ALA 119.A O no hydrogen 3.024 N/A PHE 124.A N LEU 120.A O no hydrogen 3.024 N/A ARG 125.A N THR 121.A O no hydrogen 2.951 N/A ARG 125.A NE CYS 42.A O no hydrogen 3.116 N/A ARG 125.A NH2 GLU 40.A OE1 no hydrogen 3.023 N/A PHE 126.A N CYS 122.A O no hydrogen 3.103 N/A PHE 126.A N ALA 123.A O no hydrogen 3.174 N/A SER 129.A OG GLN 50.A OE1 no hydrogen 2.791 N/A LEU 131.A N ASP 128.A OD2 no hydrogen 3.044 N/A VAL 132.A N ASP 128.A O no hydrogen 3.120 N/A ARG 133.A N SER 129.A O no hydrogen 2.870 N/A ARG 133.A NH1 GLU 57.A OE1 no hydrogen 3.067 N/A GLU 134.A N ASP 130.A O no hydrogen 2.938 N/A THR 135.A N LEU 131.A O no hydrogen 2.869 N/A THR 135.A OG1 LEU 131.A O no hydrogen 2.920 N/A ALA 136.A N VAL 132.A O no hydrogen 2.795 N/A LEU 137.A N ARG 133.A O no hydrogen 2.957 N/A LYS 138.A N GLU 134.A O no hydrogen 3.209 N/A LYS 138.A N THR 135.A O no hydrogen 3.108 N/A THR 139.A OG1 GLU 259.A OE2 no hydrogen 3.010 N/A THR 140.A N TYR 258.A O no hydrogen 3.017 N/A THR 142.A N ASP 256.A O no hydrogen 3.026 N/A GLY 144.A N THR 142.A OG1 no hydrogen 3.219 N/A THR 145.A N THR 267.A OG1 no hydrogen 2.917 N/A THR 145.A OG1 LEU 263.A O no hydrogen 2.791 N/A GLY 148.A N THR 145.A OG1 no hydrogen 2.905 N/A PHE 149.A N THR 145.A O no hydrogen 2.999 N/A VAL 150.A N TRP 146.A O no hydrogen 3.113 N/A GLN 151.A N ALA 147.A O no hydrogen 3.103 N/A ARG 152.A N GLY 148.A O no hydrogen 3.019 N/A ARG 152.A NE GLU 265.A O no hydrogen 3.637 N/A ARG 152.A NH1 GLN 360.A OE1 no hydrogen 3.516 N/A LEU 153.A N PHE 149.A O no hydrogen 2.896 N/A LYS 154.A N VAL 150.A O no hydrogen 2.921 N/A LYS 154.A NZ GLN 71.A OE1 no hydrogen 2.980 N/A LYS 154.A NZ GLN 151.A OE1 no hydrogen 3.507 N/A MET 155.A N GLN 151.A O no hydrogen 3.105 N/A GLN 156.A N ARG 152.A O no hydrogen 2.912 N/A GLN 156.A NE2 PRO 269.A O no hydrogen 3.492 N/A GLN 156.A NE2 ASP 362.A OD2 no hydrogen 2.765 N/A THR 157.A N LEU 153.A O no hydrogen 2.878 N/A THR 157.A N LYS 154.A O no hydrogen 3.161 N/A THR 157.A OG1 LEU 153.A O no hydrogen 2.865 N/A THR 157.A OG1 LYS 154.A O no hydrogen 3.165 N/A THR 158.A N LYS 154.A O no hydrogen 2.844 N/A THR 158.A OG1 LYS 154.A O no hydrogen 2.701 N/A ARG 159.A NH1 LYS 359.A O no hydrogen 2.867 N/A ARG 159.A NH1 SER 364.A OG no hydrogen 2.728 N/A ARG 159.A NH2 LYS 359.A O no hydrogen 3.217 N/A CYS 161.A SG ARG 159.A O no hydrogen 3.535 N/A CYS 161.A SG GLY 363.A O no hydrogen 2.964 N/A GLN 163.A NE2 ASP 422.A OD1 no hydrogen 3.113 N/A GLU 164.A N ASP 366.A OD2 no hydrogen 3.058 N/A ARG 168.A NE ASP 375.A OD1 no hydrogen 3.347 N/A ARG 168.A NE ASP 375.A OD2 no hydrogen 3.060 N/A ARG 168.A NH2 ASP 375.A OD1 no hydrogen 2.796 N/A LEU 170.A N SER 167.A OG no hydrogen 2.998 N/A LEU 171.A N SER 167.A O no hydrogen 3.130 N/A LYS 172.A N ARG 168.A O no hydrogen 2.801 N/A GLN 173.A N LYS 169.A O no hydrogen 3.134 N/A LEU 174.A N LEU 170.A O no hydrogen 2.836 N/A PHE 175.A N LEU 171.A O no hydrogen 2.789 N/A ASP 178.A N ALA 291.A O no hydrogen 3.001 N/A GLN 180.A N ASP 178.A OD1 no hydrogen 3.103 N/A LYS 181.A N ASP 178.A O no hydrogen 3.213 N/A LYS 181.A NZ ASP 178.A OD2 no hydrogen 3.518 N/A LEU 182.A N PRO 179.A O no hydrogen 3.241 N/A VAL 183.A N SER 287.A OG no hydrogen 2.716 N/A SER 186.A N ASP 184.A OD1 no hydrogen 3.099 N/A SER 186.A OG ASP 184.A OD1 no hydrogen 2.777 N/A SER 186.A OG ASP 184.A OD2 no hydrogen 3.484 N/A GLY 187.A N ASP 184.A O no hydrogen 3.242 N/A SER 190.A N GLU 188.A OE2 no hydrogen 3.194 N/A SER 190.A OG GLU 188.A OE2 no hydrogen 2.681 N/A GLU 191.A N GLU 188.A OE1 no hydrogen 3.302 N/A LEU 192.A N GLU 188.A O no hydrogen 3.263 N/A VAL 193.A N LEU 189.A O no hydrogen 2.893 N/A LEU 194.A N SER 190.A O no hydrogen 2.930 N/A GLY 195.A N GLU 191.A O no hydrogen 3.102 N/A GLY 195.A N LEU 192.A O no hydrogen 3.071 N/A ILE 196.A N VAL 193.A O no hydrogen 3.176 N/A LYS 197.A N GLN 286.A OE1 no hydrogen 2.937 N/A ALA 202.A N ASN 199.A O no hydrogen 3.233 N/A ALA 204.A N ARG 210.A O no hydrogen 2.926 N/A GLY 205.A N SER 203.A OG no hydrogen 3.078 N/A TYR 208.A OH HIS 276.A ND1 no hydrogen 3.002 N/A TRP 209.A N GLY 205.A O no hydrogen 3.098 N/A TRP 209.A NE1 GLU 245.A OE2 no hydrogen 2.798 N/A ARG 210.A NE TYR 208.A O no hydrogen 2.861 N/A ARG 210.A NH2 VAL 94.A O no hydrogen 2.731 N/A ARG 210.A NH2 ASP 218.A OD2 no hydrogen 2.829 N/A LYS 212.A N ALA 202.A O no hydrogen 2.944 N/A LYS 212.A NZ SER 203.A O no hydrogen 2.714 N/A ARG 213.A N ALA 200.A O no hydrogen 3.089 N/A ASP 214.A N THR 211.A OG1 no hydrogen 3.041 N/A ALA 215.A N THR 211.A O no hydrogen 2.973 N/A MET 219.A N ALA 215.A O no hydrogen 2.977 N/A LEU 220.A N LEU 216.A O no hydrogen 2.941 N/A ASP 221.A N PRO 217.A O no hydrogen 2.788 N/A CYS 222.A N ASP 218.A O no hydrogen 3.027 N/A CYS 222.A SG LEU 88.A O no hydrogen 3.853 N/A VAL 223.A N ASP 218.A O no hydrogen 3.085 N/A LEU 224.A N MET 219.A O no hydrogen 2.802 N/A LEU 227.A N VAL 223.A O no hydrogen 2.907 N/A TYR 228.A N LEU 224.A O no hydrogen 2.910 N/A ASP 229.A N PRO 225.A O no hydrogen 3.051 N/A HIS 230.A N LEU 226.A O no hydrogen 3.187 N/A HIS 230.A ND1 ASP 235.A O no hydrogen 2.862 N/A ILE 231.A N LEU 227.A O no hydrogen 2.979 N/A VAL 232.A N TYR 228.A O no hydrogen 3.099 N/A ARG 233.A N ASP 229.A O no hydrogen 3.149 N/A LYS 234.A N ILE 231.A O no hydrogen 3.149 N/A LYS 234.A NZ GLU 394.A OE2 no hydrogen 3.340 N/A ASP 235.A N HIS 230.A O no hydrogen 2.801 N/A THR 238.A OG1 ASP 235.A OD1 no hydrogen 2.921 N/A LEU 239.A N ASP 235.A O no hydrogen 3.236 N/A ARG 240.A N LEU 236.A O no hydrogen 2.929 N/A ASN 241.A N THR 237.A O no hydrogen 3.087 N/A LYS 242.A N THR 238.A O no hydrogen 2.999 N/A LYS 242.A NZ HIS 243.A NE2 no hydrogen 3.439 N/A HIS 243.A N LEU 239.A O no hydrogen 2.702 N/A LEU 246.A N HIS 243.A O no hydrogen 3.374 N/A PHE 247.A N PRO 244.A O no hydrogen 3.063 N/A LEU 248.A N GLU 245.A O no hydrogen 3.316 N/A ALA 249.A N PRO 407.A O no hydrogen 2.860 N/A GLU 250.A N SER 272.A O no hydrogen 3.131 N/A CYS 251.A N LEU 409.A O no hydrogen 2.785 N/A CYS 251.A SG TYR 270.A O no hydrogen 3.888 N/A LYS 252.A N TYR 270.A O no hydrogen 2.861 N/A ASN 253.A ND2 GLN 111.A O no hydrogen 2.917 N/A ASN 253.A ND2 ASP 143.A O no hydrogen 2.895 N/A LYS 254.A N ARG 268.A O no hydrogen 2.925 N/A LYS 254.A NZ ASP 256.A OD2 no hydrogen 3.236 N/A THR 255.A OG1 ASP 143.A OD1 no hydrogen 2.718 N/A ASP 256.A N THR 142.A O no hydrogen 3.151 N/A ARG 257.A N ASP 256.A OD1 no hydrogen 2.814 N/A ARG 257.A NE THR 531.A O no hydrogen 2.816 N/A ARG 257.A NH2 THR 531.A O no hydrogen 2.878 N/A TYR 258.A N THR 140.A O no hydrogen 2.781 N/A TYR 258.A OH LYS 254.A O no hydrogen 2.741 N/A VAL 260.A N LYS 138.A O no hydrogen 3.032 N/A SER 262.A N GLU 259.A O no hydrogen 3.203 N/A SER 262.A OG GLU 259.A O no hydrogen 3.335 N/A LEU 263.A N VAL 260.A O no hydrogen 3.455 N/A GLU 265.A N SER 262.A O no hydrogen 3.088 N/A LYS 266.A N SER 262.A O no hydrogen 2.870 N/A THR 267.A OG1 THR 145.A O no hydrogen 3.491 N/A ARG 268.A N TYR 258.A OH no hydrogen 2.868 N/A TYR 270.A N LYS 252.A O no hydrogen 3.074 N/A PHE 271.A N THR 426.A O no hydrogen 2.688 N/A SER 272.A N GLU 250.A O no hydrogen 2.895 N/A HIS 273.A NE2 MET 402.A O no hydrogen 3.175 N/A PHE 275.A N ALA 204.A O no hydrogen 2.797 N/A HIS 276.A ND1 TYR 208.A OH no hydrogen 3.002 N/A HIS 276.A NE2 LEU 246.A O no hydrogen 2.840 N/A SER 278.A N PRO 274.A O no hydrogen 2.987 N/A SER 278.A OG PHE 275.A O no hydrogen 2.923 N/A ALA 279.A N PHE 275.A O no hydrogen 2.780 N/A LEU 280.A N HIS 276.A O no hydrogen 3.249 N/A VAL 281.A N LEU 277.A O no hydrogen 3.243 N/A SER 282.A N SER 278.A O no hydrogen 2.864 N/A SER 282.A OG SER 278.A O no hydrogen 2.849 N/A VAL 283.A N ALA 279.A O no hydrogen 3.336 N/A VAL 283.A N LEU 280.A O no hydrogen 3.249 N/A SER 285.A N VAL 281.A O no hydrogen 2.971 N/A GLN 286.A N SER 282.A O no hydrogen 2.866 N/A GLN 286.A NE2 LYS 197.A O no hydrogen 2.961 N/A SER 287.A N VAL 283.A O no hydrogen 3.234 N/A SER 287.A OG HIS 381.A NE2 no hydrogen 2.981 N/A PHE 288.A N LEU 284.A O no hydrogen 2.968 N/A SER 289.A N SER 285.A O no hydrogen 2.921 N/A SER 289.A OG SER 285.A O no hydrogen 3.093 N/A GLY 290.A N GLN 286.A O no hydrogen 3.097 N/A ALA 291.A N SER 287.A O no hydrogen 3.267 N/A LEU 292.A N PHE 288.A O no hydrogen 2.883 N/A LYS 293.A N PRO 176.A O no hydrogen 3.066 N/A ILE 294.A N GLU 297.A OE1 no hydrogen 3.282 N/A MET 295.A N ASN 303.A O no hydrogen 3.067 N/A GLU 297.A N ILE 294.A O no hydrogen 2.979 N/A ASP 298.A N ILE 294.A O no hydrogen 3.091 N/A THR 300.A N ASP 298.A OD1 no hydrogen 3.159 N/A THR 300.A OG1 GLN 173.A O no hydrogen 2.947 N/A THR 300.A OG1 ASP 298.A OD1 no hydrogen 2.826 N/A SER 301.A N ASP 298.A O no hydrogen 3.055 N/A SER 301.A OG LEU 174.A O no hydrogen 3.367 N/A PHE 302.A N LEU 174.A O no hydrogen 2.883 N/A ASN 303.A ND2 LYS 293.A O no hydrogen 3.055 N/A ASN 303.A ND2 TYR 305.A O no hydrogen 2.832 N/A ALA 304.A N CYS 336.A O no hydrogen 2.943 N/A PHE 307.A N ALA 304.A O no hydrogen 3.197 N/A SER 308.A OG THR 310.A OG1 no hydrogen 2.947 N/A THR 310.A N SER 308.A OG no hydrogen 3.172 N/A THR 310.A OG1 SER 308.A OG no hydrogen 2.947 N/A ASN 311.A N LEU 597.A O no hydrogen 2.882 N/A GLY 312.A N TYR 598.A O no hydrogen 2.883 N/A GLY 313.A N THR 310.A O no hydrogen 3.084 N/A ALA 314.A N TRP 309.A O no hydrogen 3.024 N/A ASP 316.A N GLY 312.A O no hydrogen 2.797 N/A LEU 317.A N GLY 313.A O no hydrogen 3.046 N/A ALA 318.A N ALA 314.A O no hydrogen 3.450 N/A ILE 319.A N GLU 315.A O no hydrogen 2.897 N/A TRP 320.A N ASP 316.A O no hydrogen 2.943 N/A ALA 321.A N LEU 317.A O no hydrogen 2.848 N/A ARG 322.A N ALA 318.A O no hydrogen 3.058 N/A ARG 322.A NH1 GLU 487.A O no hydrogen 2.702 N/A ARG 322.A NH1 TYR 516.A OH no hydrogen 3.211 N/A GLN 323.A N TRP 320.A O no hydrogen 3.220 N/A ALA 324.A N ALA 321.A O no hydrogen 3.077 N/A GLY 325.A N PRO 331.A O no hydrogen 3.180 N/A ALA 327.A N ARG 346.A O no hydrogen 2.844 N/A LYS 329.A N GLU 326.A O no hydrogen 3.150 N/A LYS 330.A N GLU 326.A O no hydrogen 2.886 N/A ARG 333.A N TYR 344.A O no hydrogen 2.914 N/A ARG 333.A NE GLN 323.A OE1 no hydrogen 3.289 N/A ARG 333.A NH2 GLN 323.A OE1 no hydrogen 3.115 N/A ALA 335.A N ASP 342.A O no hydrogen 3.027 N/A CYS 336.A N PHE 302.A O no hydrogen 2.862 N/A CYS 336.A SG PHE 302.A O no hydrogen 3.844 N/A TYR 337.A N ASP 340.A O no hydrogen 2.764 N/A GLY 338.A N THR 436.A OG1 no hydrogen 2.825 N/A ASP 340.A N TYR 337.A O no hydrogen 2.921 N/A THR 341.A N PRO 356.A O no hydrogen 3.284 N/A ASP 342.A N ALA 335.A O no hydrogen 2.850 N/A ILE 343.A N ILE 354.A O no hydrogen 2.601 N/A TYR 344.A N ARG 333.A O no hydrogen 2.827 N/A TYR 344.A OH ASP 342.A OD2 no hydrogen 2.809 N/A TYR 345.A N TYR 352.A O no hydrogen 3.034 N/A ARG 346.A N GLY 325.A O no hydrogen 3.025 N/A ARG 346.A NE ALA 324.A O no hydrogen 3.312 N/A ARG 346.A NH1 GLY 349.A O no hydrogen 3.289 N/A ARG 346.A NH1 GLU 487.A OE1 no hydrogen 3.179 N/A ARG 346.A NH1 GLU 487.A OE2 no hydrogen 3.255 N/A ARG 346.A NH2 ARG 322.A O no hydrogen 2.894 N/A ARG 346.A NH2 GLU 487.A OE1 no hydrogen 2.981 N/A LYS 347.A N LYS 350.A O no hydrogen 3.076 N/A ASP 348.A N GLU 326.A OE2 no hydrogen 2.913 N/A GLY 349.A N GLU 326.A OE1 no hydrogen 2.797 N/A LYS 350.A N LYS 347.A O no hydrogen 3.226 N/A LEU 351.A N GLU 487.A OE2 no hydrogen 3.438 N/A TYR 352.A N TYR 345.A O no hydrogen 2.716 N/A ARG 353.A N ALA 483.A O no hydrogen 2.855 N/A ARG 353.A NH1 THR 496.A OG1 no hydrogen 2.579 N/A ARG 353.A NH1 GLN 498.A O no hydrogen 3.366 N/A ARG 353.A NH2 ASP 342.A OD2 no hydrogen 3.009 N/A ILE 354.A N ILE 343.A O no hydrogen 2.658 N/A CYS 355.A SG ASP 342.A OD1 no hydrogen 2.985 N/A ASP 357.A N THR 479.A OG1 no hydrogen 3.336 N/A LYS 359.A N VAL 474.A O no hydrogen 2.838 N/A GLN 360.A NE2 ASP 362.A OD1 no hydrogen 2.958 N/A GLY 363.A N GLN 360.A O no hydrogen 3.274 N/A GLY 363.A N ASP 362.A OD1 no hydrogen 2.827 N/A SER 364.A N MET 361.A O no hydrogen 2.918 N/A SER 364.A OG GLY 472.A O no hydrogen 2.866 N/A VAL 365.A N ASP 362.A O no hydrogen 3.140 N/A ALA 367.A N ASP 422.A OD1 no hydrogen 2.856 N/A THR 368.A N GLN 163.A OE1 no hydrogen 3.269 N/A THR 368.A OG1 GLN 163.A OE1 no hydrogen 2.984 N/A THR 369.A N ASP 366.A OD2 no hydrogen 2.973 N/A THR 369.A OG1 ASP 366.A OD1 no hydrogen 2.932 N/A THR 369.A OG1 ASP 366.A OD2 no hydrogen 3.278 N/A ILE 370.A N ASP 366.A O no hydrogen 3.253 N/A GLU 371.A N ALA 367.A O no hydrogen 2.839 N/A ALA 372.A N THR 368.A O no hydrogen 2.816 N/A VAL 373.A N THR 369.A O no hydrogen 2.835 N/A VAL 374.A N ILE 370.A O no hydrogen 3.052 N/A ASP 375.A N GLU 371.A O no hydrogen 2.946 N/A TYR 376.A N ALA 372.A O no hydrogen 2.753 N/A TYR 376.A OH PHE 175.A O no hydrogen 2.719 N/A VAL 377.A N VAL 373.A O no hydrogen 2.914 N/A VAL 378.A N VAL 374.A O no hydrogen 2.822 N/A ASP 379.A N ASP 375.A O no hydrogen 2.789 N/A ALA 380.A N TYR 376.A O no hydrogen 2.993 N/A HIS 381.A N VAL 377.A O no hydrogen 3.313 N/A HIS 381.A ND1 VAL 377.A O no hydrogen 3.000 N/A HIS 381.A NE2 SER 287.A OG no hydrogen 2.981 N/A VAL 382.A N VAL 378.A O no hydrogen 2.990 N/A LYS 383.A N ASP 379.A O no hydrogen 2.827 N/A LYS 383.A NZ ASP 379.A OD1 no hydrogen 3.163 N/A LYS 383.A NZ ASP 379.A OD2 no hydrogen 3.455 N/A GLN 384.A N ALA 380.A O no hydrogen 3.357 N/A TYR 385.A N HIS 381.A O no hydrogen 2.722 N/A TYR 385.A OH LEU 182.A O no hydrogen 2.726 N/A ALA 388.A N TYR 385.A O no hydrogen 3.530 N/A TRP 392.A N ALA 388.A O no hydrogen 3.480 N/A TRP 392.A NE1 VAL 185.A O no hydrogen 3.115 N/A GLU 393.A N ARG 389.A O no hydrogen 3.074 N/A GLU 394.A N GLN 390.A O no hydrogen 3.130 N/A VAL 395.A N PHE 391.A O no hydrogen 3.014 N/A GLY 396.A N TRP 392.A O no hydrogen 2.825 N/A LYS 397.A N GLU 393.A O no hydrogen 3.166 N/A LYS 397.A NZ GLU 394.A OE2 no hydrogen 2.964 N/A LEU 398.A N GLU 394.A O no hydrogen 3.268 N/A TRP 399.A N VAL 395.A O no hydrogen 2.909 N/A TRP 399.A NE1 VAL 429.A O no hydrogen 2.870 N/A VAL 400.A N GLY 396.A O no hydrogen 3.037 N/A GLU 401.A N LYS 397.A O no hydrogen 3.122 N/A MET 402.A N LEU 398.A O no hydrogen 2.954 N/A ALA 403.A N TRP 399.A O no hydrogen 2.965 N/A THR 404.A N GLU 401.A O no hydrogen 3.240 N/A THR 404.A OG1 VAL 400.A O no hydrogen 2.796 N/A GLN 405.A N GLU 401.A O no hydrogen 2.731 N/A GLN 405.A NE2 THR 404.A O no hydrogen 3.240 N/A GLN 405.A NE2 LYS 418.A O no hydrogen 2.857 N/A SER 406.A OG PRO 407.A O no hydrogen 3.180 N/A PHE 408.A N TYR 416.A O no hydrogen 2.742 N/A LEU 409.A N ALA 249.A O no hydrogen 3.009 N/A GLY 412.A N VAL 108.A O no hydrogen 2.681 N/A THR 413.A OG1 GLU 81.A OE2 no hydrogen 2.784 N/A VAL 415.A N GLY 80.A O no hydrogen 2.805 N/A TYR 416.A N PHE 408.A O no hydrogen 2.700 N/A ARG 417.A N GLU 77.A O no hydrogen 3.050 N/A ARG 417.A NE GLU 77.A OE1 no hydrogen 3.114 N/A ARG 417.A NH2 GLU 77.A OE1 no hydrogen 3.315 N/A ARG 417.A NH2 GLU 77.A OE2 no hydrogen 3.036 N/A LYS 418.A NZ THR 404.A O no hydrogen 2.841 N/A LYS 418.A NZ GLN 420.A O no hydrogen 2.907 N/A LYS 418.A NZ ASP 422.A O no hydrogen 2.850 N/A LYS 418.A NZ GLY 423.A O no hydrogen 3.063 N/A GLN 420.A NE2 THR 157.A O no hydrogen 3.041 N/A GLN 420.A NE2 ARG 159.A O no hydrogen 2.885 N/A LYS 421.A NZ GLU 371.A OE2 no hydrogen 3.068 N/A GLY 423.A N VAL 365.A O no hydrogen 2.873 N/A LEU 424.A N ASP 362.A O no hydrogen 2.789 N/A MET 425.A N ALA 403.A O no hydrogen 2.869 N/A THR 426.A OG1 ASP 362.A OD2 no hydrogen 2.856 N/A GLY 427.A N THR 431.A OG1 no hydrogen 2.958 N/A VAL 428.A N MET 425.A O no hydrogen 3.191 N/A THR 431.A N VAL 428.A O no hydrogen 3.209 N/A THR 431.A OG1 VAL 428.A O no hydrogen 2.731 N/A PHE 434.A N GLY 430.A O no hydrogen 2.956 N/A ASP 435.A N THR 431.A O no hydrogen 3.085 N/A THR 436.A N THR 432.A O no hydrogen 2.841 N/A THR 436.A OG1 THR 432.A O no hydrogen 2.758 N/A VAL 437.A N LEU 433.A O no hydrogen 2.902 N/A LYS 438.A N PHE 434.A O no hydrogen 3.118 N/A LYS 438.A NZ GLU 164.A OE2 no hydrogen 3.032 N/A LYS 438.A NZ SER 364.A O no hydrogen 3.390 N/A LYS 438.A NZ ASP 366.A OD1 no hydrogen 2.826 N/A LYS 438.A NZ HIS 471.A O no hydrogen 3.082 N/A SER 439.A N ASP 435.A O no hydrogen 3.061 N/A SER 439.A OG GLY 338.A O no hydrogen 3.028 N/A ALA 440.A N THR 436.A O no hydrogen 2.892 N/A LEU 441.A N VAL 437.A O no hydrogen 2.870 N/A ALA 442.A N LYS 438.A O no hydrogen 3.185 N/A TYR 443.A N SER 439.A O no hydrogen 3.026 N/A ASN 444.A N ALA 440.A O no hydrogen 2.814 N/A ASP 445.A N LEU 441.A O no hydrogen 3.104 N/A TRP 446.A N ALA 442.A O no hydrogen 2.936 N/A TRP 446.A NE1 LEU 457.A O no hydrogen 3.182 N/A ALA 447.A N TYR 443.A O no hydrogen 2.997 N/A ASP 448.A N ASN 444.A O no hydrogen 2.982 N/A GLN 449.A N ASP 445.A O no hydrogen 2.974 N/A GLN 449.A NE2 ASP 445.A O no hydrogen 3.521 N/A GLN 449.A NE2 ASP 445.A OD1 no hydrogen 3.372 N/A LEU 450.A N TRP 446.A O no hydrogen 2.954 N/A MET 451.A N ALA 447.A O no hydrogen 3.078 N/A PHE 452.A N ASP 448.A O no hydrogen 3.121 N/A PHE 452.A N GLN 449.A O no hydrogen 3.183 N/A GLY 453.A N LEU 450.A O no hydrogen 2.779 N/A SER 454.A N GLN 449.A O no hydrogen 3.221 N/A LEU 457.A N SER 454.A O no hydrogen 3.278 N/A LEU 458.A N LEU 455.A O no hydrogen 3.374 N/A GLU 459.A N ASN 456.A O no hydrogen 2.972 N/A ALA 463.A N GLU 459.A O no hydrogen 2.894 N/A ILE 464.A N GLU 460.A O no hydrogen 2.881 N/A GLU 465.A N LYS 461.A O no hydrogen 3.209 N/A PHE 466.A N TYR 462.A O no hydrogen 2.936 N/A PHE 467.A N ALA 463.A O no hydrogen 2.976 N/A LYS 468.A N ILE 464.A O no hydrogen 3.031 N/A ASN 469.A N GLU 465.A O no hydrogen 2.828 N/A LYS 470.A N PHE 466.A O no hydrogen 2.770 N/A LYS 470.A NZ ASP 445.A OD1 no hydrogen 3.508 N/A LYS 470.A NZ ASP 445.A OD2 no hydrogen 2.938 N/A HIS 471.A N PHE 467.A O no hydrogen 2.968 N/A HIS 471.A ND1 GLU 164.A OE2 no hydrogen 3.037 N/A HIS 471.A NE2 ASP 445.A OD2 no hydrogen 3.024 N/A GLY 472.A N LYS 468.A O no hydrogen 2.967 N/A LEU 473.A N PHE 467.A O no hydrogen 3.000 N/A LYS 476.A N ASP 357.A O no hydrogen 2.745 N/A THR 479.A N LYS 476.A O no hydrogen 3.242 N/A THR 479.A OG1 ASP 357.A O no hydrogen 3.541 N/A THR 479.A OG1 LYS 476.A O no hydrogen 2.663 N/A TRP 480.A NE1 LEU 458.A O no hydrogen 2.946 N/A ALA 483.A N ARG 353.A O no hydrogen 3.027 N/A VAL 485.A N LEU 351.A O no hydrogen 3.258 N/A ASN 486.A N TRP 495.A O no hydrogen 3.077 N/A ASN 486.A ND2 GLU 493.A OE1 no hydrogen 3.259 N/A GLY 490.A N GLU 493.A OE1 no hydrogen 2.909 N/A GLY 492.A N VAL 507.A O no hydrogen 2.926 N/A GLU 493.A N GLY 490.A O no hydrogen 3.024 N/A TRP 495.A N LEU 505.A O no hydrogen 2.908 N/A TRP 495.A NE1 TYR 344.A OH no hydrogen 3.025 N/A THR 496.A OG1 GLN 498.A OE1 no hydrogen 3.418 N/A GLN 498.A N THR 496.A OG1 no hydrogen 3.306 N/A GLN 498.A NE2 ARG 353.A O no hydrogen 2.997 N/A LYS 499.A NZ ASP 524.A OD2 no hydrogen 2.949 N/A PHE 500.A N LEU 503.A O no hydrogen 3.169 N/A LEU 501.A N ASP 340.A OD2 no hydrogen 3.087 N/A LEU 503.A N PHE 500.A O no hydrogen 3.158 N/A GLN 504.A N ASN 519.A O no hydrogen 2.849 N/A GLN 504.A NE2 GLU 497.A O no hydrogen 3.033 N/A LYS 506.A N VAL 517.A O no hydrogen 2.850 N/A LYS 506.A NZ ASN 519.A OD1 no hydrogen 3.140 N/A LYS 506.A NZ PHE 557.A O no hydrogen 3.040 N/A VAL 507.A N GLU 493.A O no hydrogen 3.152 N/A VAL 508.A N VAL 515.A O no hydrogen 2.780 N/A ARG 509.A NE GLU 511.A O no hydrogen 2.890 N/A ARG 510.A N GLU 513.A O no hydrogen 3.055 N/A ARG 510.A NH1 ASP 601.A OD2 no hydrogen 2.820 N/A ARG 510.A NH2 ASP 601.A OD1 no hydrogen 3.215 N/A ARG 510.A NH2 ASP 601.A OD2 no hydrogen 3.381 N/A GLU 513.A N ARG 510.A O no hydrogen 2.810 N/A LYS 514.A NZ ASP 488.A OD2 no hydrogen 3.521 N/A LYS 514.A NZ PRO 489.A O no hydrogen 2.954 N/A VAL 515.A N VAL 508.A O no hydrogen 2.941 N/A VAL 517.A N LYS 506.A O no hydrogen 2.650 N/A ASN 519.A N GLN 504.A O no hydrogen 2.843 N/A ASN 519.A ND2 GLN 504.A OE1 no hydrogen 3.150 N/A GLU 523.A N GLU 523.A OE1 no hydrogen 2.935 N/A ASP 524.A N PRO 521.A O no hydrogen 3.126 N/A TRP 525.A N PRO 521.A O no hydrogen 3.473 N/A TRP 525.A NE1 LEU 520.A O no hydrogen 3.025 N/A LEU 526.A N PHE 522.A O no hydrogen 2.869 N/A THR 527.A N GLU 523.A O no hydrogen 3.039 N/A THR 527.A OG1 GLU 523.A O no hydrogen 2.951 N/A MET 528.A N ASP 524.A O no hydrogen 3.145 N/A TRP 529.A N TRP 525.A O no hydrogen 2.929 N/A TRP 529.A NE1 ALA 119.A O no hydrogen 2.936 N/A VAL 530.A N LEU 526.A O no hydrogen 2.951 N/A THR 531.A N THR 527.A O no hydrogen 3.131 N/A THR 531.A N MET 528.A O no hydrogen 3.331 N/A THR 531.A OG1 THR 527.A O no hydrogen 2.680 N/A ARG 539.A N THR 535.A O no hydrogen 2.997 N/A ARG 539.A NH2 GLU 536.A OE1 no hydrogen 2.945 N/A GLU 540.A N GLU 536.A O no hydrogen 2.893 N/A ARG 541.A N THR 537.A O no hydrogen 3.002 N/A ARG 541.A NE ASP 545.A OD2 no hydrogen 3.076 N/A ARG 541.A NH1 VAL 576.A O no hydrogen 3.004 N/A ARG 541.A NH1 VAL 577.A O no hydrogen 2.889 N/A ARG 541.A NH1 SER 585.A O no hydrogen 3.378 N/A ARG 541.A NH2 ASP 545.A OD1 no hydrogen 3.084 N/A ARG 541.A NH2 SER 585.A O no hydrogen 2.951 N/A THR 542.A N MET 538.A O no hydrogen 2.921 N/A THR 542.A OG1 MET 538.A O no hydrogen 2.976 N/A LEU 543.A N ARG 539.A O no hydrogen 3.148 N/A PHE 544.A N GLU 540.A O no hydrogen 3.197 N/A ASP 545.A N ARG 541.A O no hydrogen 2.889 N/A ARG 546.A N THR 542.A O no hydrogen 2.832 N/A ARG 546.A NH1 TRP 529.A O no hydrogen 2.892 N/A ARG 546.A NH2 MET 528.A O no hydrogen 2.880 N/A ARG 546.A NH2 TRP 529.A O no hydrogen 3.554 N/A ALA 547.A N LEU 543.A O no hydrogen 3.001 N/A ARG 548.A N PHE 544.A O no hydrogen 3.006 N/A ARG 548.A NH1 SER 585.A OG no hydrogen 3.203 N/A ARG 548.A NH1 GLY 587.A O no hydrogen 2.918 N/A ARG 548.A NH2 ASP 545.A OD1 no hydrogen 2.889 N/A ARG 548.A NH2 SER 585.A OG no hydrogen 3.013 N/A GLY 549.A N ASP 545.A O no hydrogen 2.947 N/A LEU 550.A N ARG 546.A O no hydrogen 3.023 N/A LEU 551.A N ALA 547.A O no hydrogen 3.073 N/A VAL 552.A N ARG 548.A O no hydrogen 3.084 N/A THR 553.A N GLY 549.A O no hydrogen 2.984 N/A THR 553.A OG1 GLY 549.A O no hydrogen 2.809 N/A GLY 554.A N LEU 551.A O no hydrogen 3.071 N/A ALA 555.A N LEU 550.A O no hydrogen 3.015 N/A PHE 557.A N GLY 554.A O no hydrogen 2.964 N/A ASP 558.A N ALA 555.A O no hydrogen 3.201 N/A ALA 561.A N ASP 558.A OD2 no hydrogen 2.896 N/A ARG 562.A N ASP 558.A O no hydrogen 2.942 N/A ARG 562.A NH1 VAL 556.A O no hydrogen 2.731 N/A ARG 562.A NH2 GLU 559.A OE2 no hydrogen 3.090 N/A GLY 563.A N GLU 559.A O no hydrogen 3.190 N/A LEU 564.A N ARG 560.A O no hydrogen 3.030 N/A MET 565.A N ALA 561.A O no hydrogen 2.972 N/A GLY 566.A N ARG 562.A O no hydrogen 2.912 N/A ALA 567.A N GLY 563.A O no hydrogen 3.036 N/A VAL 568.A N LEU 564.A O no hydrogen 3.118 N/A ILE 569.A N MET 565.A O no hydrogen 3.023 N/A ASN 570.A N GLY 566.A O no hydrogen 2.928 N/A ASN 570.A ND2 ALA 35.A O no hydrogen 2.797 N/A ASN 570.A ND2 GLN 37.A OE1 no hydrogen 3.042 N/A SER 571.A N ALA 567.A O no hydrogen 2.994 N/A SER 571.A OG ALA 567.A O no hydrogen 3.158 N/A THR 572.A N ILE 569.A O no hydrogen 3.115 N/A THR 572.A OG1 VAL 568.A O no hydrogen 2.899 N/A THR 572.A OG1 ILE 569.A O no hydrogen 3.277 N/A GLU 575.A N GLU 575.A OE1 no hydrogen 2.883 N/A VAL 576.A N ALA 573.A O no hydrogen 3.103 N/A VAL 577.A N ALA 573.A O no hydrogen 3.160 N/A CYS 578.A N PRO 574.A O no hydrogen 2.991 N/A CYS 578.A SG PRO 574.A O no hydrogen 3.607 N/A ARG 580.A N ARG 17.A O no hydrogen 2.958 N/A TYR 588.A N PRO 607.A O no hydrogen 3.000 N/A TRP 593.A N SER 590.A OG no hydrogen 2.912 N/A TRP 593.A NE1 CYS 604.A O no hydrogen 2.892 N/A VAL 594.A N SER 590.A O no hydrogen 3.052 N/A VAL 595.A N TYR 591.A O no hydrogen 2.965 N/A SER 596.A N ASP 592.A O no hydrogen 3.012 N/A SER 596.A OG ASP 601.A OD2 no hydrogen 3.098 N/A LEU 597.A N TRP 593.A O no hydrogen 2.923 N/A TYR 598.A N VAL 594.A O no hydrogen 3.142 N/A TYR 598.A OH VAL 552.A O no hydrogen 2.717 N/A SER 599.A N VAL 595.A O no hydrogen 2.936 N/A SER 599.A OG SER 596.A O no hydrogen 2.742 N/A ARG 600.A NH1 ASP 316.A OD1 no hydrogen 3.008 N/A ARG 600.A NH1 ASP 316.A OD2 no hydrogen 3.499 N/A ARG 600.A NH2 ASP 316.A OD1 no hydrogen 2.889 N/A ASP 601.A N SER 599.A OG no hydrogen 3.049 N/A CYS 604.A SG SER 596.A OG no hydrogen 3.699 N/A ARG 608.A NE MET 606.A O no hydrogen 3.231 N/A ARG 608.A NH1 ASP 586.A OD1 no hydrogen 2.946 N/A ARG 608.A NH2 MET 606.A O no hydrogen 2.939 N/A VAL 609.A N ASP 586.A O no hydrogen 3.159 N/A ALA 613.A N PHE 610.A O no hydrogen 3.151 N/A THR 615.A OG1 GLU 612.A O no hydrogen 2.912 N/A LEU 616.A N GLU 612.A O no hydrogen 2.969 N/A ILE 617.A N ALA 613.A O no hydrogen 2.814 N/A ALA 618.A N ALA 614.A O no hydrogen 2.979 N/A SER 619.A N LEU 616.A O no hydrogen 3.071 N/A SER 619.A OG LEU 616.A O no hydrogen 3.402 N/A TYR 620.A N THR 615.A O no hydrogen 3.148 N/A ARG 628.A N ASP 626.A OD1 no hydrogen 3.092 N/A