Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xhb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N LYS 21.A O no hydrogen 2.330 N/A LEU 3.A N PHE 19.A O no hydrogen 2.933 N/A THR 5.A OG1 ALA 117.A O no hydrogen 3.131 N/A ASP 6.A N ARG 17.A O no hydrogen 3.302 N/A ILE 8.A N VAL 15.A O no hydrogen 2.895 N/A THR 9.A OG1 HIS 89.A NE2 no hydrogen 2.916 N/A GLU 10.A N LYS 13.A O no hydrogen 2.960 N/A LYS 13.A N GLU 10.A O no hydrogen 3.120 N/A VAL 15.A N ILE 8.A O no hydrogen 2.666 N/A ILE 16.A N ASP 31.A O no hydrogen 2.957 N/A ARG 17.A N ASP 6.A O no hydrogen 2.982 N/A ARG 17.A NE ASP 6.A OD1 no hydrogen 3.145 N/A ARG 17.A NH2 ASP 6.A OD2 no hydrogen 2.723 N/A ILE 18.A N ASP 29.A O no hydrogen 2.800 N/A PHE 19.A N ASP 4.A O no hydrogen 3.062 N/A LYS 20.A N LYS 27.A O no hydrogen 2.863 N/A LYS 20.A NZ ASP 29.A OD2 no hydrogen 3.351 N/A LYS 21.A N MET 1.A O no hydrogen 2.758 N/A LYS 21.A NZ GLY 24.A O no hydrogen 2.969 N/A GLU 22.A N GLU 25.A O no hydrogen 3.043 N/A GLY 24.A N GLU 133.A OE1 no hydrogen 3.384 N/A GLU 25.A N GLU 22.A O no hydrogen 3.081 N/A LYS 27.A N LYS 20.A O no hydrogen 3.049 N/A LYS 27.A NZ GLU 22.A OE1 no hydrogen 3.189 N/A ASP 29.A N ILE 18.A O no hydrogen 3.038 N/A ASP 31.A N ILE 16.A O no hydrogen 2.982 N/A ARG 32.A NH2 GLU 10.A OE1 no hydrogen 2.883 N/A ASN 33.A N ASP 31.A OD1 no hydrogen 3.054 N/A TYR 37.A OH ASP 123.A OD2 no hydrogen 2.597 N/A ILE 38.A N LEU 85.A O no hydrogen 2.967 N/A TYR 39.A N TYR 110.A O no hydrogen 2.966 N/A ALA 40.A N TRP 83.A O no hydrogen 2.947 N/A LEU 41.A N ASP 108.A O no hydrogen 3.173 N/A LYS 43.A N ALA 105.A O no hydrogen 2.749 N/A LYS 43.A NZ PRO 104.A O no hydrogen 3.243 N/A SER 46.A N ASP 44.A OD2 no hydrogen 2.906 N/A ALA 47.A N ASP 44.A O no hydrogen 3.065 N/A ILE 48.A N ASP 45.A O no hydrogen 3.312 N/A VAL 51.A N ALA 47.A O no hydrogen 3.018 N/A LYS 52.A N ILE 48.A O no hydrogen 2.788 N/A LYS 53.A N ASP 50.A O no hydrogen 3.067 N/A ILE 54.A N VAL 51.A O no hydrogen 3.184 N/A THR 55.A OG1 VAL 63.A O no hydrogen 2.902 N/A ALA 56.A N VAL 63.A O no hydrogen 3.018 N/A ARG 58.A N THR 61.A O no hydrogen 2.792 N/A ARG 58.A NE ASP 92.A OD1 no hydrogen 2.586 N/A THR 61.A N ARG 58.A O no hydrogen 2.805 N/A THR 61.A OG1 ARG 58.A O no hydrogen 3.110 N/A THR 61.A OG1 HIS 59.A O no hydrogen 3.489 N/A VAL 63.A N ALA 56.A O no hydrogen 2.778 N/A VAL 66.A N TYR 86.A O no hydrogen 3.156 N/A ARG 67.A NH1 GLU 35.A OE1 no hydrogen 3.148 N/A ARG 67.A NH2 GLU 35.A OE1 no hydrogen 3.058 N/A ARG 67.A NH2 GLU 35.A OE2 no hydrogen 3.192 N/A GLU 69.A N LYS 84.A O no hydrogen 3.169 N/A VAL 71.A N VAL 82.A O no hydrogen 2.899 N/A LYS 73.A N ILE 80.A O no hydrogen 2.869 N/A LYS 73.A NZ TYR 39.A OH no hydrogen 3.182 N/A LYS 73.A NZ ASN 360.A OD1 no hydrogen 2.941 N/A LYS 74.A N ASN 360.A O no hydrogen 3.275 N/A PHE 75.A N ARG 78.A O no hydrogen 2.755 N/A GLY 77.A N GLU 361.A OE2 no hydrogen 3.025 N/A ARG 78.A N PHE 75.A O no hydrogen 3.224 N/A ARG 78.A NE GLU 410.A OE2 no hydrogen 3.226 N/A ARG 78.A NH2 GLU 410.A OE2 no hydrogen 3.049 N/A ILE 80.A N LYS 73.A O no hydrogen 2.758 N/A VAL 82.A N VAL 71.A O no hydrogen 3.092 N/A TRP 83.A N ALA 40.A O no hydrogen 2.709 N/A LYS 84.A N GLU 69.A O no hydrogen 2.846 N/A LYS 84.A NZ TYR 86.A OH no hydrogen 3.248 N/A LEU 85.A N ILE 38.A O no hydrogen 2.812 N/A TYR 86.A N ARG 67.A O no hydrogen 2.897 N/A TYR 86.A OH GLU 69.A OE1 no hydrogen 3.189 N/A PHE 87.A N PRO 36.A O no hydrogen 3.006 N/A HIS 89.A N ASP 92.A OD2 no hydrogen 2.856 N/A HIS 89.A NE2 THR 9.A OG1 no hydrogen 2.916 N/A GLN 91.A N HIS 89.A ND1 no hydrogen 3.302 N/A ASP 92.A N HIS 89.A O no hydrogen 3.069 N/A VAL 93.A N PRO 90.A O no hydrogen 3.214 N/A ILE 96.A N ASP 92.A O no hydrogen 3.058 N/A ARG 97.A N VAL 93.A O no hydrogen 2.732 N/A ARG 97.A NH2 TYR 112.A O no hydrogen 2.906 N/A LYS 99.A N ILE 96.A O no hydrogen 3.245 N/A ILE 100.A N ILE 96.A O no hydrogen 3.389 N/A ILE 100.A N ARG 97.A O no hydrogen 3.217 N/A LYS 101.A N ARG 97.A O no hydrogen 3.325 N/A GLU 102.A N ASP 98.A O no hydrogen 2.769 N/A HIS 103.A N ILE 100.A O no hydrogen 3.310 N/A HIS 103.A NE2 ASP 50.A OD1 no hydrogen 3.060 N/A ALA 105.A N HIS 103.A ND1 no hydrogen 3.275 N/A VAL 106.A N HIS 103.A O no hydrogen 3.088 N/A VAL 107.A N LEU 41.A O no hydrogen 2.841 N/A ILE 109.A N ASP 108.A OD1 no hydrogen 2.690 N/A TYR 110.A N TYR 39.A O no hydrogen 2.950 N/A ARG 119.A N PRO 115.A O no hydrogen 2.828 N/A ARG 119.A NE ASP 123.A OD1 no hydrogen 2.875 N/A ARG 119.A NH1 GLU 111.A OE1 no hydrogen 2.547 N/A ARG 119.A NH2 ASP 123.A OD1 no hydrogen 3.181 N/A TYR 120.A N PHE 116.A O no hydrogen 2.929 N/A TYR 120.A OH ASP 31.A OD2 no hydrogen 2.979 N/A LEU 121.A N ALA 117.A O no hydrogen 3.269 N/A ILE 122.A N LYS 118.A O no hydrogen 3.075 N/A ASP 123.A N ARG 119.A O no hydrogen 2.912 N/A LYS 124.A N TYR 120.A O no hydrogen 3.001 N/A GLY 125.A N ILE 122.A O no hydrogen 3.298 N/A LEU 126.A N LEU 121.A O no hydrogen 3.007 N/A MET 129.A N ILE 2.A O no hydrogen 2.942 N/A LYS 136.A N ASP 199.A OD2 no hydrogen 2.786 N/A LYS 136.A NZ LYS 196.A O no hydrogen 2.751 N/A LEU 138.A N VAL 200.A O no hydrogen 2.945 N/A ALA 139.A N ALA 158.A O no hydrogen 2.821 N/A PHE 140.A N ILE 202.A O no hydrogen 3.144 N/A ASP 141.A N SER 156.A O no hydrogen 2.912 N/A ILE 142.A N ASP 141.A OD1 no hydrogen 2.633 N/A GLU 143.A N MET 154.A O no hydrogen 2.886 N/A LEU 145.A N PRO 151.A O no hydrogen 3.070 N/A ILE 152.A N GLU 182.A OE2 no hydrogen 2.738 N/A LEU 153.A N GLU 143.A O no hydrogen 2.716 N/A MET 154.A N GLU 143.A O no hydrogen 3.227 N/A ILE 155.A N ILE 166.A O no hydrogen 2.945 N/A SER 156.A N ASP 141.A O no hydrogen 2.913 N/A SER 156.A OG ASP 141.A O no hydrogen 3.475 N/A SER 156.A OG SER 307.A O no hydrogen 2.875 N/A TYR 157.A N ARG 164.A O no hydrogen 2.989 N/A ALA 158.A N ALA 139.A O no hydrogen 2.979 N/A ASP 159.A N GLY 162.A O no hydrogen 2.756 N/A GLY 162.A N ASP 159.A O no hydrogen 3.201 N/A ARG 164.A N TYR 157.A O no hydrogen 2.829 N/A ARG 164.A NE ASP 177.A OD1 no hydrogen 3.370 N/A ARG 164.A NE ASP 177.A OD2 no hydrogen 3.316 N/A ARG 164.A NH2 PRO 174.A O no hydrogen 3.072 N/A ARG 164.A NH2 ASP 177.A OD2 no hydrogen 2.729 N/A VAL 165.A N TYR 175.A O no hydrogen 2.984 N/A ILE 166.A N ILE 155.A O no hydrogen 2.820 N/A THR 167.A N ASP 177.A O no hydrogen 3.090 N/A THR 167.A OG1 LEU 153.A O no hydrogen 3.252 N/A TRP 168.A NE1 ILE 152.A O no hydrogen 3.010 N/A LEU 173.A N ILE 171.A O no hydrogen 2.949 N/A VAL 176.A N LEU 173.A O no hydrogen 3.328 N/A ASP 177.A N VAL 165.A O no hydrogen 2.734 N/A VAL 179.A N THR 167.A O no hydrogen 2.850 N/A GLU 184.A N THR 181.A OG1 no hydrogen 3.405 N/A MET 185.A N THR 181.A O no hydrogen 2.849 N/A ILE 186.A N GLU 182.A O no hydrogen 3.059 N/A LYS 187.A N LYS 183.A O no hydrogen 2.978 N/A LYS 187.A NZ GLU 184.A OE1 no hydrogen 2.740 N/A ARG 188.A N GLU 184.A O no hydrogen 2.900 N/A PHE 189.A N MET 185.A O no hydrogen 3.088 N/A LEU 190.A N ILE 186.A O no hydrogen 2.976 N/A LYS 191.A N LYS 187.A O no hydrogen 3.107 N/A VAL 192.A N ARG 188.A O no hydrogen 3.230 N/A VAL 193.A N PHE 189.A O no hydrogen 3.249 N/A LYS 194.A N LEU 190.A O no hydrogen 3.164 N/A GLU 195.A N LYS 191.A O no hydrogen 2.763 N/A LYS 196.A N VAL 192.A O no hydrogen 2.934 N/A LYS 196.A NZ ASP 159.A OD1 no hydrogen 3.325 N/A LYS 196.A NZ ASP 159.A OD2 no hydrogen 2.702 N/A ASP 197.A N VAL 193.A O no hydrogen 2.870 N/A ASP 199.A N LYS 136.A O no hydrogen 2.758 N/A VAL 200.A N LYS 136.A O no hydrogen 3.165 N/A LEU 201.A N ILE 251.A O no hydrogen 3.040 N/A ILE 202.A N LEU 138.A O no hydrogen 2.800 N/A THR 203.A N PHE 253.A O no hydrogen 3.273 N/A THR 203.A OG1 HIS 252.A NE2 no hydrogen 2.686 N/A TYR 204.A OH TYR 268.A O no hydrogen 2.739 N/A ASN 205.A N ASP 254.A OD1 no hydrogen 2.828 N/A ASP 207.A N ASP 254.A OD2 no hydrogen 3.184 N/A ASN 208.A ND2 ASN 205.A OD1 no hydrogen 3.464 N/A TYR 213.A N PHE 209.A O no hydrogen 2.845 N/A TYR 213.A OH GLY 150.A O no hydrogen 2.914 N/A LEU 214.A N ALA 210.A O no hydrogen 2.939 N/A LYS 215.A N PHE 211.A O no hydrogen 2.822 N/A LYS 215.A NZ GLU 233.A OE1 no hydrogen 3.475 N/A LYS 215.A NZ PRO 234.A O no hydrogen 2.590 N/A LYS 216.A N ALA 212.A O no hydrogen 3.217 N/A ARG 217.A N TYR 213.A O no hydrogen 3.046 N/A ARG 217.A NE GLU 182.A OE2 no hydrogen 2.783 N/A ARG 217.A NH1 ALA 148.A O no hydrogen 3.055 N/A ARG 217.A NH1 GLU 149.A O no hydrogen 3.191 N/A ARG 217.A NH2 GLU 182.A OE1 no hydrogen 2.861 N/A ARG 217.A NH2 GLU 182.A OE2 no hydrogen 3.299 N/A SER 218.A N LEU 214.A O no hydrogen 3.106 N/A SER 218.A OG LEU 214.A O no hydrogen 2.893 N/A GLU 219.A N LYS 215.A O no hydrogen 2.701 N/A LYS 220.A N LYS 216.A O no hydrogen 3.017 N/A LEU 221.A N ARG 217.A O no hydrogen 2.613 N/A VAL 223.A N SER 218.A O no hydrogen 2.870 N/A GLY 228.A N SER 232.A O no hydrogen 3.040 N/A ARG 229.A N LYS 248.A O no hydrogen 3.025 N/A ARG 229.A NH1 ASP 199.A OD1 no hydrogen 3.192 N/A ARG 229.A NH1 GLY 249.A O no hydrogen 2.781 N/A ARG 229.A NH2 ASP 197.A O no hydrogen 2.947 N/A ARG 229.A NH2 ASP 197.A OD2 no hydrogen 3.137 N/A ARG 229.A NH2 ASP 199.A OD1 no hydrogen 2.810 N/A GLU 230.A N GLU 230.A OE1 no hydrogen 2.689 N/A SER 232.A OG GLU 230.A OE2 no hydrogen 2.701 N/A LYS 235.A N GLU 246.A O no hydrogen 3.049 N/A GLN 237.A N ALA 244.A O no hydrogen 2.669 N/A GLN 237.A NE2 GLU 246.A OE2 no hydrogen 2.695 N/A MET 239.A N ARG 242.A O no hydrogen 2.688 N/A ARG 242.A N MET 239.A O no hydrogen 3.155 N/A ALA 244.A N GLN 237.A O no hydrogen 3.293 N/A GLU 246.A N LYS 235.A O no hydrogen 3.068 N/A LYS 248.A NZ ASP 6.A OD2 no hydrogen 2.617 N/A ARG 250.A N VAL 247.A O no hydrogen 3.039 N/A ARG 250.A NE LEU 227.A O no hydrogen 2.689 N/A ARG 250.A NH1 PRO 198.A O no hydrogen 2.680 N/A ARG 250.A NH2 LEU 227.A O no hydrogen 3.485 N/A ILE 251.A N ASP 199.A O no hydrogen 2.719 N/A HIS 252.A ND1 VAL 245.A O no hydrogen 2.751 N/A HIS 252.A NE2 THR 203.A OG1 no hydrogen 2.686 N/A PHE 253.A N LEU 201.A O no hydrogen 2.978 N/A LEU 255.A N THR 203.A O no hydrogen 2.767 N/A TYR 256.A N ASP 254.A OD1 no hydrogen 3.004 N/A ILE 259.A N LEU 255.A O no hydrogen 3.006 N/A ARG 260.A N TYR 256.A O no hydrogen 3.221 N/A ARG 261.A N PRO 257.A O no hydrogen 3.297 N/A ARG 261.A NH1 VAL 339.A O no hydrogen 2.984 N/A ARG 261.A NH1 SER 342.A O no hydrogen 3.381 N/A ARG 261.A NH2 GLU 325.A OE2 no hydrogen 3.325 N/A THR 262.A N VAL 258.A O no hydrogen 2.984 N/A THR 262.A N ILE 259.A O no hydrogen 3.052 N/A THR 262.A OG1 VAL 258.A O no hydrogen 2.672 N/A ILE 263.A N ILE 259.A O no hydrogen 2.887 N/A TYR 268.A OH ILE 263.A O no hydrogen 2.979 N/A ALA 272.A N THR 269.A OG1 no hydrogen 3.202 N/A VAL 273.A N THR 269.A O no hydrogen 2.991 N/A TYR 274.A N LEU 270.A O no hydrogen 3.137 N/A TYR 274.A OH GLN 280.A OE1 no hydrogen 2.999 N/A TYR 274.A OH GLU 316.A OE2 no hydrogen 3.330 N/A GLU 275.A N GLU 271.A O no hydrogen 2.772 N/A ALA 276.A N ALA 272.A O no hydrogen 2.862 N/A ILE 277.A N VAL 273.A O no hydrogen 3.087 N/A PHE 278.A N TYR 274.A O no hydrogen 2.984 N/A GLY 279.A N GLU 275.A O no hydrogen 2.968 N/A LYS 282.A NZ GLU 271.A OE1 no hydrogen 2.745 N/A LYS 282.A NZ ASP 310.A OD1 no hydrogen 2.651 N/A GLU 289.A N TYR 286.A O no hydrogen 3.085 N/A ILE 290.A N TYR 286.A O no hydrogen 3.016 N/A ALA 291.A N ALA 287.A O no hydrogen 3.356 N/A ALA 293.A N GLU 289.A O no hydrogen 2.886 N/A TRP 294.A N ILE 290.A O no hydrogen 2.695 N/A GLU 295.A N ALA 291.A O no hydrogen 2.698 N/A THR 296.A N GLN 292.A O no hydrogen 3.118 N/A THR 296.A OG1 GLN 292.A O no hydrogen 2.875 N/A GLY 297.A N ALA 293.A O no hydrogen 2.803 N/A GLU 298.A N ALA 293.A O no hydrogen 3.374 N/A ARG 302.A NH1 GLU 289.A OE1 no hydrogen 2.732 N/A ARG 302.A NH2 GLU 289.A OE1 no hydrogen 3.342 N/A VAL 303.A N GLY 299.A O no hydrogen 3.119 N/A ALA 304.A N LEU 300.A O no hydrogen 2.832 N/A ARG 305.A N GLU 301.A O no hydrogen 2.939 N/A TYR 306.A N ARG 302.A O no hydrogen 3.214 N/A SER 307.A N VAL 303.A O no hydrogen 3.168 N/A MET 308.A N ALA 304.A O no hydrogen 3.057 N/A GLU 309.A N ARG 305.A O no hydrogen 2.843 N/A ASP 310.A N TYR 306.A O no hydrogen 2.929 N/A ALA 311.A N SER 307.A O no hydrogen 3.230 N/A LYS 312.A N MET 308.A O no hydrogen 3.027 N/A VAL 313.A N GLU 309.A O no hydrogen 2.732 N/A THR 314.A N ASP 310.A O no hydrogen 3.256 N/A THR 314.A OG1 ASP 310.A O no hydrogen 2.584 N/A TYR 315.A N ALA 311.A O no hydrogen 3.151 N/A TYR 315.A OH GLU 160.A OE2 no hydrogen 2.602 N/A GLU 316.A N LYS 312.A O no hydrogen 3.137 N/A LEU 317.A N VAL 313.A O no hydrogen 2.896 N/A GLY 318.A N THR 314.A O no hydrogen 2.682 N/A LYS 319.A N TYR 315.A O no hydrogen 2.756 N/A GLU 320.A N LEU 317.A O no hydrogen 3.209 N/A PHE 321.A N LEU 317.A O no hydrogen 3.329 N/A PHE 322.A N GLY 318.A O no hydrogen 3.105 N/A GLU 325.A N PHE 321.A O no hydrogen 3.076 N/A ALA 326.A N PHE 322.A O no hydrogen 2.668 N/A GLN 327.A N PRO 323.A O no hydrogen 3.083 N/A LEU 328.A N MET 324.A O no hydrogen 3.002 N/A SER 329.A N GLU 325.A O no hydrogen 3.020 N/A SER 329.A OG GLU 325.A O no hydrogen 3.180 N/A SER 329.A OG GLN 334.A O no hydrogen 3.489 N/A ARG 330.A N ALA 326.A O no hydrogen 3.311 N/A LEU 331.A N GLN 327.A O no hydrogen 3.116 N/A VAL 332.A N LEU 328.A O no hydrogen 2.936 N/A GLY 333.A N SER 329.A O no hydrogen 2.849 N/A SER 335.A OG ASP 338.A OD2 no hydrogen 2.752 N/A TRP 337.A NE1 VAL 245.A O no hydrogen 2.921 N/A ASP 338.A N SER 335.A OG no hydrogen 3.366 N/A VAL 339.A N SER 335.A O no hydrogen 2.957 N/A SER 340.A N LEU 336.A O no hydrogen 3.009 N/A SER 340.A OG LEU 336.A O no hydrogen 2.835 N/A SER 340.A OG TRP 337.A O no hydrogen 3.092 N/A ARG 341.A N ASP 338.A O no hydrogen 3.069 N/A ARG 341.A NE TRP 337.A O no hydrogen 3.041 N/A ARG 341.A NH1 ASP 207.A OD2 no hydrogen 2.899 N/A ARG 341.A NH2 HIS 252.A O no hydrogen 2.541 N/A SER 342.A OG ASP 338.A O no hydrogen 2.684 N/A ASN 346.A N SER 343.A OG no hydrogen 3.107 N/A LEU 347.A N SER 343.A O no hydrogen 2.936 N/A VAL 348.A N THR 344.A O no hydrogen 3.393 N/A VAL 348.A N GLY 345.A O no hydrogen 3.076 N/A GLU 349.A N GLY 345.A O no hydrogen 3.242 N/A TRP 350.A N ASN 346.A O no hydrogen 3.227 N/A PHE 351.A N LEU 347.A O no hydrogen 3.321 N/A LEU 352.A N VAL 348.A O no hydrogen 2.956 N/A LEU 353.A N GLU 349.A O no hydrogen 2.845 N/A ARG 354.A N TRP 350.A O no hydrogen 3.143 N/A ARG 354.A NE VAL 332.A O no hydrogen 3.334 N/A ARG 354.A NH1 LEU 121.A O no hydrogen 3.368 N/A ARG 354.A NH2 GLY 333.A O no hydrogen 2.713 N/A LYS 355.A N PHE 351.A O no hydrogen 3.059 N/A ALA 356.A N LEU 352.A O no hydrogen 2.701 N/A TYR 357.A N LEU 353.A O no hydrogen 2.939 N/A GLU 358.A N ARG 354.A O no hydrogen 3.253 N/A ARG 359.A N LYS 355.A O no hydrogen 3.127 N/A ARG 359.A NH2 SER 435.A OG no hydrogen 2.604 N/A ASN 360.A N TYR 357.A O no hydrogen 3.339 N/A ASN 360.A ND2 LYS 72.A O no hydrogen 3.081 N/A GLU 361.A N ALA 356.A O no hydrogen 2.669 N/A LEU 362.A N LYS 74.A O no hydrogen 2.814 N/A ALA 363.A N GLU 111.A OE2 no hydrogen 3.209 N/A ASN 365.A ND2 ILE 109.A O no hydrogen 2.962 N/A LYS 374.A N ALA 523.A O no hydrogen 3.421 N/A LYS 374.A NZ GLU 375.A O no hydrogen 3.555 N/A LYS 374.A NZ VAL 520.A O no hydrogen 3.310 N/A GLU 377.A N LEU 521.A O no hydrogen 2.881 N/A ARG 378.A N GLU 377.A OE1 no hydrogen 3.396 N/A GLY 379.A N ALA 731.A O no hydrogen 2.921 N/A TRP 381.A N GLY 570.A O no hydrogen 2.830 N/A ASN 383.A N LYS 568.A O no hydrogen 2.810 N/A ASN 383.A ND2 ALA 535.A O no hydrogen 2.925 N/A ILE 384.A N TYR 567.A O no hydrogen 2.784 N/A VAL 385.A N ALA 530.A O no hydrogen 2.916 N/A TYR 386.A N GLY 565.A O no hydrogen 3.084 N/A LEU 387.A N PHE 528.A O no hydrogen 3.029 N/A ASP 388.A N GLU 562.A O no hydrogen 2.849 N/A PHE 389.A N ASP 526.A O no hydrogen 2.666 N/A ARG 390.A N ASP 388.A OD2 no hydrogen 3.450 N/A SER 391.A OG GLU 560.A O no hydrogen 2.560 N/A LEU 392.A N PHE 389.A O no hydrogen 2.769 N/A TYR 393.A N ARG 390.A O no hydrogen 3.231 N/A TYR 393.A OH THR 525.A O no hydrogen 2.593 N/A ILE 396.A N LEU 392.A O no hydrogen 3.346 N/A ILE 397.A N TYR 393.A O no hydrogen 3.024 N/A ILE 398.A N PRO 394.A O no hydrogen 2.950 N/A THR 399.A N SER 395.A O no hydrogen 2.754 N/A THR 399.A OG1 SER 395.A O no hydrogen 2.690 N/A HIS 400.A N ILE 396.A O no hydrogen 3.104 N/A ASN 401.A N ILE 398.A O no hydrogen 3.371 N/A ASN 401.A ND2 CYS 426.A O no hydrogen 2.707 N/A ASN 401.A ND2 PHE 429.A O no hydrogen 2.671 N/A VAL 402.A N ILE 397.A O no hydrogen 3.101 N/A SER 403.A OG ASP 405.A OD1 no hydrogen 2.507 N/A ASP 405.A N ASP 405.A OD1 no hydrogen 2.649 N/A THR 406.A N SER 403.A O no hydrogen 3.045 N/A THR 406.A OG1 ASN 401.A O no hydrogen 2.711 N/A THR 406.A OG1 SER 403.A O no hydrogen 2.842 N/A LEU 407.A N PRO 404.A O no hydrogen 3.353 N/A ASN 408.A N LYS 424.A O no hydrogen 3.079 N/A ARG 409.A NH1 GLY 77.A O no hydrogen 3.338 N/A ARG 409.A NH1 ASP 405.A O no hydrogen 3.138 N/A ARG 409.A NH2 GLY 77.A O no hydrogen 2.999 N/A CYS 412.A N TYR 415.A OH no hydrogen 2.991 N/A CYS 412.A SG TYR 415.A OH no hydrogen 3.023 N/A GLU 413.A N ASP 428.A OD2 no hydrogen 3.254 N/A GLU 414.A N ASP 428.A OD1 no hydrogen 3.186 N/A TYR 415.A OH ARG 409.A O no hydrogen 2.508 N/A ASP 416.A N PHE 425.A O no hydrogen 3.151 N/A ALA 418.A N HIS 423.A O no hydrogen 2.833 N/A VAL 421.A N PRO 419.A O no hydrogen 2.678 N/A GLY 422.A N ALA 418.A O no hydrogen 3.246 N/A HIS 423.A NE2 GLU 495.A OE1 no hydrogen 3.110 N/A PHE 425.A N ASP 416.A O no hydrogen 3.111 N/A CYS 426.A N THR 406.A O no hydrogen 3.090 N/A LYS 427.A N GLU 414.A O no hydrogen 3.096 N/A LYS 427.A NZ THR 399.A O no hydrogen 2.964 N/A LYS 427.A NZ ASP 416.A OD2 no hydrogen 2.680 N/A GLY 431.A N ASN 401.A OD1 no hydrogen 2.757 N/A PHE 432.A N ASP 405.A OD2 no hydrogen 3.167 N/A SER 435.A N GLY 431.A O no hydrogen 3.055 N/A SER 435.A OG GLY 431.A O no hydrogen 2.797 N/A SER 435.A OG PHE 432.A O no hydrogen 2.831 N/A LEU 436.A N PHE 432.A O no hydrogen 3.269 N/A LEU 437.A N ILE 433.A O no hydrogen 2.692 N/A GLY 438.A N PRO 434.A O no hydrogen 2.733 N/A ASP 439.A N SER 435.A O no hydrogen 3.136 N/A LEU 440.A N LEU 436.A O no hydrogen 3.098 N/A LEU 441.A N LEU 437.A O no hydrogen 3.270 N/A GLU 442.A N GLY 438.A O no hydrogen 3.053 N/A GLU 443.A N ASP 439.A O no hydrogen 2.848 N/A ARG 444.A N LEU 440.A O no hydrogen 2.970 N/A GLN 445.A N LEU 441.A O no hydrogen 2.947 N/A LYS 446.A N GLU 442.A O no hydrogen 3.146 N/A VAL 447.A N GLU 443.A O no hydrogen 2.858 N/A LYS 448.A N ARG 444.A O no hydrogen 2.947 N/A LYS 449.A N GLN 445.A O no hydrogen 3.079 N/A LYS 450.A N LYS 446.A O no hydrogen 3.358 N/A MET 451.A N VAL 447.A O no hydrogen 2.789 N/A LYS 452.A N LYS 448.A O no hydrogen 3.237 N/A ALA 453.A N LYS 449.A O no hydrogen 3.200 N/A THR 454.A N LYS 450.A O no hydrogen 3.043 N/A THR 454.A OG1 LYS 450.A O no hydrogen 2.766 N/A LYS 460.A N ASP 456.A O no hydrogen 2.760 N/A LYS 461.A N PRO 457.A O no hydrogen 3.193 N/A LEU 462.A N ILE 458.A O no hydrogen 3.010 N/A LEU 463.A N GLU 459.A O no hydrogen 3.005 N/A ASP 464.A N LYS 460.A O no hydrogen 3.309 N/A TYR 465.A N LYS 461.A O no hydrogen 3.174 N/A TYR 465.A OH GLU 320.A O no hydrogen 3.251 N/A ARG 466.A N LEU 462.A O no hydrogen 3.143 N/A GLN 467.A N LEU 463.A O no hydrogen 3.264 N/A GLN 467.A NE2 ASP 464.A OD1 no hydrogen 3.042 N/A ARG 468.A N ASP 464.A O no hydrogen 3.103 N/A ALA 469.A N TYR 465.A O no hydrogen 2.786 N/A ILE 470.A N ARG 466.A O no hydrogen 3.110 N/A LYS 471.A N GLN 467.A O no hydrogen 3.234 N/A ILE 472.A N ARG 468.A O no hydrogen 3.155 N/A LEU 473.A N ALA 469.A O no hydrogen 3.116 N/A ALA 474.A N ILE 470.A O no hydrogen 2.790 N/A ASN 475.A N LYS 471.A O no hydrogen 2.857 N/A SER 476.A N LEU 473.A O no hydrogen 3.112 N/A SER 476.A OG ILE 472.A O no hydrogen 2.728 N/A PHE 477.A N ALA 474.A O no hydrogen 3.439 N/A TYR 478.A OH THR 498.A OG1 no hydrogen 2.857 N/A TYR 480.A N SER 476.A O no hydrogen 2.868 N/A TYR 480.A OH GLU 349.A OE2 no hydrogen 2.727 N/A TYR 481.A N PHE 477.A O no hydrogen 3.055 N/A TYR 481.A N TYR 478.A O no hydrogen 3.212 N/A TYR 481.A OH VAL 402.A O no hydrogen 2.869 N/A GLY 482.A N GLY 479.A O no hydrogen 3.283 N/A TYR 483.A N TYR 480.A O no hydrogen 3.098 N/A ALA 486.A N TYR 483.A O no hydrogen 3.256 N/A ARG 487.A N GLU 349.A OE1 no hydrogen 3.395 N/A ARG 487.A NH1 PRO 364.A O no hydrogen 2.795 N/A ARG 487.A NH2 ASP 113.A OD1 no hydrogen 2.642 N/A TRP 488.A N TYR 480.A OH no hydrogen 3.049 N/A CYS 490.A N TYR 481.A O no hydrogen 3.056 N/A GLU 492.A N GLU 492.A OE1 no hydrogen 2.673 N/A ALA 494.A N CYS 490.A O no hydrogen 3.323 N/A GLU 495.A N LYS 491.A O no hydrogen 3.003 N/A SER 496.A N GLU 492.A O no hydrogen 2.920 N/A SER 496.A OG GLU 492.A O no hydrogen 2.649 N/A VAL 497.A N CYS 493.A O no hydrogen 3.102 N/A THR 498.A N ALA 494.A O no hydrogen 2.836 N/A THR 498.A OG1 TYR 478.A OH no hydrogen 2.857 N/A THR 498.A OG1 ALA 494.A O no hydrogen 2.801 N/A ALA 499.A N GLU 495.A O no hydrogen 2.883 N/A TRP 500.A N SER 496.A O no hydrogen 3.028 N/A GLY 501.A N VAL 497.A O no hydrogen 3.004 N/A ARG 502.A N THR 498.A O no hydrogen 3.044 N/A ILE 505.A N GLY 501.A O no hydrogen 2.898 N/A GLU 506.A N ARG 502.A O no hydrogen 2.595 N/A THR 507.A N GLN 503.A O no hydrogen 2.762 N/A THR 507.A OG1 GLN 503.A O no hydrogen 2.647 N/A THR 508.A N TYR 504.A O no hydrogen 2.892 N/A THR 508.A OG1 TYR 504.A O no hydrogen 2.556 N/A ILE 509.A N ILE 505.A O no hydrogen 2.914 N/A ARG 510.A N GLU 506.A O no hydrogen 2.828 N/A GLU 511.A N THR 507.A O no hydrogen 2.917 N/A ILE 512.A N THR 508.A O no hydrogen 3.093 N/A GLU 513.A N ILE 509.A O no hydrogen 3.360 N/A GLU 514.A N ARG 510.A O no hydrogen 3.160 N/A LYS 515.A N GLU 511.A O no hydrogen 2.962 N/A LYS 515.A NZ GLU 511.A OE2 no hydrogen 2.572 N/A LYS 515.A NZ TYR 550.A OH no hydrogen 2.993 N/A GLY 517.A N GLU 513.A O no hydrogen 3.054 N/A PHE 518.A N ILE 512.A O no hydrogen 3.059 N/A LYS 519.A N THR 531.A O no hydrogen 2.680 N/A LEU 521.A N PHE 529.A O no hydrogen 2.854 N/A TYR 522.A N PHE 529.A O no hydrogen 3.471 N/A TYR 522.A OH ASP 524.A OD1 no hydrogen 2.843 N/A ASP 524.A N GLY 527.A O no hydrogen 2.769 N/A ASP 526.A N ASP 524.A OD2 no hydrogen 3.017 N/A GLY 527.A N ASP 524.A OD2 no hydrogen 2.901 N/A PHE 528.A N LEU 387.A O no hydrogen 2.905 N/A PHE 529.A N TYR 522.A O no hydrogen 2.700 N/A ALA 530.A N VAL 385.A O no hydrogen 2.961 N/A THR 531.A N LYS 519.A O no hydrogen 3.190 N/A THR 531.A OG1 GLU 382.A O no hydrogen 2.907 N/A THR 531.A OG1 ASN 383.A O no hydrogen 2.649 N/A ALA 535.A N ILE 532.A O no hydrogen 3.026 N/A VAL 540.A N ASP 536.A O no hydrogen 3.275 N/A LYS 541.A N ALA 537.A O no hydrogen 3.102 N/A LYS 541.A NZ GLU 538.A OE1 no hydrogen 2.768 N/A LYS 541.A NZ GLU 583.A OE1 no hydrogen 3.508 N/A LYS 541.A NZ GLU 583.A OE2 no hydrogen 3.171 N/A LYS 542.A N GLU 538.A O no hydrogen 2.925 N/A LYS 542.A NZ GLU 546.A OE2 no hydrogen 3.370 N/A LYS 543.A N THR 539.A O no hydrogen 2.625 N/A ALA 544.A N VAL 540.A O no hydrogen 2.760 N/A LYS 545.A N LYS 541.A O no hydrogen 2.904 N/A GLU 546.A N LYS 542.A O no hydrogen 2.972 N/A PHE 547.A N LYS 543.A O no hydrogen 2.929 N/A LEU 548.A N ALA 544.A O no hydrogen 2.976 N/A ASP 549.A N LYS 545.A O no hydrogen 3.327 N/A TYR 550.A N GLU 546.A O no hydrogen 3.188 N/A TYR 550.A OH GLU 511.A OE2 no hydrogen 2.615 N/A ILE 551.A N PHE 547.A O no hydrogen 2.814 N/A ASN 552.A N LEU 548.A O no hydrogen 3.110 N/A ASN 552.A ND2 LEU 561.A O no hydrogen 3.187 N/A LYS 554.A N TYR 550.A O no hydrogen 3.139 N/A LEU 555.A N ILE 551.A O no hydrogen 2.866 N/A LEU 559.A N PRO 556.A O no hydrogen 3.132 N/A GLU 564.A N TYR 386.A O no hydrogen 2.965 N/A TYR 567.A N ILE 384.A O no hydrogen 2.629 N/A TYR 567.A OH GLU 564.A OE2 no hydrogen 2.587 N/A LYS 568.A N ILE 581.A O no hydrogen 2.638 N/A ARG 569.A N ILE 581.A O no hydrogen 3.365 N/A ARG 569.A NE LEU 615.A O no hydrogen 2.662 N/A ARG 569.A NH1 GLU 382.A OE2 no hydrogen 2.558 N/A ARG 569.A NH2 LYS 616.A O no hydrogen 3.060 N/A GLY 570.A N TRP 381.A O no hydrogen 3.109 N/A PHE 571.A N ALA 579.A O no hydrogen 3.008 N/A VAL 573.A N LYS 577.A O no hydrogen 2.882 N/A THR 574.A N LYS 577.A O no hydrogen 3.279 N/A LYS 576.A N TYR 522.A OH no hydrogen 2.715 N/A LYS 577.A N THR 574.A O no hydrogen 2.930 N/A TYR 578.A N ARG 590.A O no hydrogen 3.215 N/A ALA 579.A N PHE 571.A O no hydrogen 3.186 N/A VAL 580.A N THR 588.A O no hydrogen 3.197 N/A ILE 581.A N ARG 569.A O no hydrogen 2.894 N/A ASP 582.A N LYS 586.A O no hydrogen 3.421 N/A ASP 585.A N ASP 582.A O no hydrogen 2.979 N/A LYS 586.A N ASP 582.A OD1 no hydrogen 2.746 N/A THR 588.A N VAL 580.A O no hydrogen 2.725 N/A THR 589.A OG1 GLU 593.A OE2 no hydrogen 3.261 N/A ARG 590.A N TYR 578.A O no hydrogen 3.020 N/A ILE 594.A N GLN 607.A OE1 no hydrogen 3.305 N/A ARG 596.A N ILE 594.A O no hydrogen 2.833 N/A ARG 597.A NH2 GLN 649.A OE1 no hydrogen 2.917 N/A TRP 599.A N ARG 596.A O no hydrogen 3.251 N/A SER 600.A N GLN 720.A OE1 no hydrogen 2.853 N/A SER 600.A OG GLN 720.A OE1 no hydrogen 2.768 N/A ILE 602.A N LYS 643.A O no hydrogen 2.939 N/A LYS 604.A N SER 600.A O no hydrogen 3.107 N/A LYS 604.A NZ ARG 596.A O no hydrogen 2.618 N/A LYS 604.A NZ TRP 599.A O no hydrogen 2.852 N/A GLU 605.A N GLU 601.A O no hydrogen 2.645 N/A THR 606.A N ILE 602.A O no hydrogen 3.075 N/A THR 606.A OG1 ILE 602.A O no hydrogen 2.689 N/A GLN 607.A N ALA 603.A O no hydrogen 3.193 N/A GLN 607.A NE2 LEU 592.A O no hydrogen 3.092 N/A GLN 607.A NE2 ALA 724.A O no hydrogen 3.116 N/A ALA 608.A N LYS 604.A O no hydrogen 3.066 N/A ARG 609.A N GLU 605.A O no hydrogen 3.037 N/A VAL 610.A N THR 606.A O no hydrogen 2.859 N/A LEU 611.A N GLN 607.A O no hydrogen 2.788 N/A GLU 612.A N ALA 608.A O no hydrogen 3.012 N/A ALA 613.A N ARG 609.A O no hydrogen 3.179 N/A ILE 614.A N VAL 610.A O no hydrogen 3.065 N/A LEU 615.A N LEU 611.A O no hydrogen 2.908 N/A LYS 616.A N GLU 612.A O no hydrogen 3.082 N/A HIS 617.A N GLU 612.A O no hydrogen 3.335 N/A ASP 619.A N ALA 613.A O no hydrogen 2.836 N/A GLU 622.A N ASP 619.A OD1 no hydrogen 2.945 N/A ALA 623.A N ASP 619.A O no hydrogen 3.310 N/A VAL 624.A N VAL 620.A O no hydrogen 2.893 N/A ARG 625.A N GLU 621.A O no hydrogen 3.005 N/A ILE 626.A N GLU 622.A O no hydrogen 2.866 N/A VAL 627.A N ALA 623.A O no hydrogen 3.277 N/A LYS 628.A N VAL 624.A O no hydrogen 3.076 N/A GLU 629.A N ARG 625.A O no hydrogen 3.004 N/A VAL 630.A N ILE 626.A O no hydrogen 3.139 N/A THR 631.A N VAL 627.A O no hydrogen 3.005 N/A THR 631.A OG1 VAL 627.A O no hydrogen 3.194 N/A THR 631.A OG1 LYS 628.A O no hydrogen 2.896 N/A THR 631.A OG1 LEU 739.A O no hydrogen 3.245 N/A GLU 632.A N LYS 628.A O no hydrogen 2.949 N/A LYS 633.A N GLU 629.A O no hydrogen 2.720 N/A LYS 633.A NZ GLU 632.A OE2 no hydrogen 3.138 N/A LEU 634.A N VAL 630.A O no hydrogen 2.884 N/A SER 635.A N THR 631.A O no hydrogen 3.342 N/A SER 635.A OG THR 631.A O no hydrogen 3.417 N/A SER 635.A OG GLU 632.A O no hydrogen 2.896 N/A LYS 636.A N GLU 632.A O no hydrogen 3.163 N/A TYR 637.A N LEU 634.A O no hydrogen 3.337 N/A GLU 638.A N LYS 633.A O no hydrogen 3.135 N/A GLU 642.A N GLU 642.A OE1 no hydrogen 2.812 N/A LYS 643.A N PRO 640.A O no hydrogen 2.924 N/A LYS 643.A NZ GLU 605.A OE1 no hydrogen 2.653 N/A LEU 644.A N PRO 641.A O no hydrogen 3.059 N/A ILE 646.A N TYR 685.A O no hydrogen 2.888 N/A TYR 647.A N ARG 597.A O no hydrogen 3.122 N/A GLU 648.A N ILE 683.A O no hydrogen 3.020 N/A ILE 650.A N THR 681.A O no hydrogen 3.104 N/A THR 651.A N TYR 657.A OH no hydrogen 2.851 N/A ARG 652.A NH1 THR 651.A OG1 no hydrogen 3.024 N/A ASP 656.A N ASP 653.A O no hydrogen 2.937 N/A TYR 657.A N LEU 654.A O no hydrogen 3.412 N/A VAL 664.A N GLY 661.A O no hydrogen 3.001 N/A ALA 665.A N GLY 661.A O no hydrogen 2.964 N/A VAL 666.A N PRO 662.A O no hydrogen 2.885 N/A ALA 667.A N HIS 663.A O no hydrogen 3.170 N/A LYS 668.A N VAL 664.A O no hydrogen 3.087 N/A ARG 669.A N ALA 665.A O no hydrogen 3.355 N/A ARG 669.A NH1 ALA 698.A O no hydrogen 3.533 N/A ARG 669.A NH2 ALA 698.A O no hydrogen 3.105 N/A LEU 670.A N VAL 666.A O no hydrogen 3.322 N/A ALA 671.A N ALA 667.A O no hydrogen 2.894 N/A ALA 672.A N LYS 668.A O no hydrogen 2.990 N/A ARG 673.A N LEU 670.A O no hydrogen 3.110 N/A ARG 673.A NH2 GLU 703.A OE2 no hydrogen 2.914 N/A GLY 674.A N ALA 671.A O no hydrogen 3.087 N/A ILE 675.A N LEU 670.A O no hydrogen 3.034 N/A ARG 678.A N THR 681.A OG1 no hydrogen 2.959 N/A ARG 678.A NE ILE 677.A O no hydrogen 3.131 N/A GLY 680.A N ILE 650.A O no hydrogen 2.962 N/A THR 681.A N ARG 678.A O no hydrogen 3.037 N/A THR 681.A OG1 ARG 678.A O no hydrogen 2.587 N/A ILE 683.A N GLU 648.A O no hydrogen 2.883 N/A TYR 685.A N ILE 646.A O no hydrogen 3.057 N/A TYR 685.A OH GLU 648.A OE1 no hydrogen 3.282 N/A ILE 686.A N ILE 699.A O no hydrogen 2.908 N/A VAL 687.A N TYR 716.A OH no hydrogen 2.985 N/A LEU 688.A N ARG 697.A O no hydrogen 3.321 N/A LYS 689.A N LYS 710.A O no hydrogen 2.954 N/A ARG 693.A N ASP 696.A OD1 no hydrogen 3.018 N/A ARG 693.A NE ASP 696.A OD1 no hydrogen 2.681 N/A ARG 693.A NH2 ASP 696.A OD1 no hydrogen 3.367 N/A ARG 693.A NH2 ASP 696.A OD2 no hydrogen 2.755 N/A ARG 697.A N ARG 693.A O no hydrogen 3.118 N/A ARG 697.A N ILE 694.A O no hydrogen 3.060 N/A ARG 697.A NE GLY 692.A O no hydrogen 3.078 N/A ARG 697.A NH2 GLY 692.A O no hydrogen 3.361 N/A ILE 699.A N ILE 686.A O no hydrogen 3.034 N/A PHE 701.A N SER 684.A O no hydrogen 2.890 N/A GLU 703.A N PRO 700.A O no hydrogen 3.086 N/A PHE 704.A N PHE 701.A O no hydrogen 3.233 N/A ASP 705.A N HIS 709.A ND1 no hydrogen 3.248 N/A ALA 707.A N ASP 705.A OD1 no hydrogen 3.080 N/A HIS 709.A N ASP 705.A O no hydrogen 2.941 N/A TYR 711.A OH LEU 634.A O no hydrogen 2.838 N/A ASP 712.A N VAL 687.A O no hydrogen 2.650 N/A TYR 715.A N ASP 712.A OD1 no hydrogen 2.886 N/A TYR 716.A N ASP 712.A O no hydrogen 3.109 N/A TYR 716.A OH LEU 644.A O no hydrogen 2.844 N/A ILE 717.A N ALA 713.A O no hydrogen 2.901 N/A GLU 718.A N GLU 714.A O no hydrogen 2.764 N/A ASN 719.A N TYR 715.A O no hydrogen 2.678 N/A VAL 721.A N TYR 716.A O no hydrogen 2.840 N/A LEU 722.A N ILE 717.A O no hydrogen 2.964 N/A ALA 724.A N VAL 721.A O no hydrogen 2.985 N/A VAL 725.A N LEU 722.A O no hydrogen 3.065 N/A GLU 726.A N LEU 722.A O no hydrogen 2.618 N/A LEU 729.A N VAL 725.A O no hydrogen 2.942 N/A ARG 730.A N GLU 726.A O no hydrogen 2.772 N/A ARG 730.A N ARG 727.A O no hydrogen 3.169 N/A ALA 731.A N ILE 728.A O no hydrogen 3.308 N/A PHE 732.A N LEU 729.A O no hydrogen 3.000 N/A GLY 733.A N ARG 730.A O no hydrogen 3.037 N/A TYR 734.A N LEU 729.A O no hydrogen 3.184 N/A ARG 735.A N ASP 738.A OD2 no hydrogen 2.435 N/A ASP 738.A N ARG 735.A O no hydrogen 2.761 N/A LEU 739.A N LYS 736.A O no hydrogen 2.737 N/A ARG 740.A N LYS 736.A O no hydrogen 3.300 N/A ARG 740.A NH2 GLU 718.A OE1 no hydrogen 2.904 N/A