Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2gk6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N LEU 147.A O no hydrogen 2.852 N/A GLN 9.A N ASP 6.A OD2 no hydrogen 3.097 N/A TYR 10.A N ASP 6.A O no hydrogen 3.279 N/A TYR 10.A OH GLU 340.A OE2 no hydrogen 2.490 N/A GLN 11.A N ALA 7.A O no hydrogen 2.826 N/A ASN 12.A N TYR 8.A O no hydrogen 2.835 N/A ILE 13.A N GLN 9.A O no hydrogen 3.043 N/A PHE 14.A N TYR 10.A O no hydrogen 3.116 N/A GLY 15.A N GLN 11.A O no hydrogen 2.918 N/A VAL 18.A N PHE 14.A O no hydrogen 2.992 N/A LYS 19.A N GLY 15.A O no hydrogen 3.101 N/A LEU 20.A N PRO 16.A O no hydrogen 2.974 N/A GLU 21.A N LEU 17.A O no hydrogen 3.338 N/A ALA 22.A N VAL 18.A O no hydrogen 2.900 N/A ASP 23.A N LYS 19.A O no hydrogen 3.143 N/A TYR 24.A N LEU 20.A O no hydrogen 3.060 N/A ASP 25.A N GLU 21.A O no hydrogen 2.970 N/A LYS 26.A N ALA 22.A O no hydrogen 2.978 N/A LYS 26.A NZ GLU 30.A OE2 no hydrogen 3.089 N/A LYS 27.A N ASP 23.A O no hydrogen 2.808 N/A LYS 27.A NZ ASP 23.A OD1 no hydrogen 3.163 N/A LYS 27.A NZ ASP 23.A OD2 no hydrogen 2.848 N/A LEU 28.A N TYR 24.A O no hydrogen 2.980 N/A LYS 29.A N ASP 25.A O no hydrogen 3.001 N/A GLU 30.A N LYS 26.A O no hydrogen 2.972 N/A SER 31.A N LYS 27.A O no hydrogen 2.955 N/A SER 31.A OG LYS 27.A O no hydrogen 2.816 N/A GLN 32.A N LYS 29.A O no hydrogen 3.274 N/A THR 33.A N GLU 30.A O no hydrogen 3.478 N/A THR 33.A OG1 GLU 30.A O no hydrogen 3.316 N/A THR 33.A OG1 ASP 113.A OD2 no hydrogen 2.998 N/A GLN 34.A N VAL 112.A O no hydrogen 3.282 N/A GLN 34.A NE2 THR 33.A O no hydrogen 3.610 N/A ILE 37.A N PHE 110.A O no hydrogen 2.966 N/A ARG 40.A N TYR 52.A O no hydrogen 2.770 N/A TRP 41.A NE1 VAL 106.A O no hydrogen 2.991 N/A ASP 42.A N ILE 50.A O no hydrogen 3.077 N/A GLY 44.A N LYS 48.A O no hydrogen 3.416 N/A ASN 46.A ND2 GLU 95.A OE2 no hydrogen 3.382 N/A LYS 47.A N GLY 44.A O no hydrogen 3.007 N/A LYS 48.A N ASN 46.A OD1 no hydrogen 3.061 N/A ARG 49.A N SER 99.A OG no hydrogen 3.063 N/A ILE 50.A N ASP 42.A O no hydrogen 3.476 N/A ALA 51.A N ILE 94.A O no hydrogen 2.896 N/A TYR 52.A N ARG 40.A O no hydrogen 2.905 N/A PHE 53.A N ILE 92.A O no hydrogen 3.129 N/A GLY 60.A N VAL 81.A O no hydrogen 3.239 N/A ASP 61.A N MET 58.A O no hydrogen 3.122 N/A ILE 63.A N GLY 79.A O no hydrogen 3.009 N/A CYS 64.A N ASP 113.A O no hydrogen 2.682 N/A LEU 65.A N GLY 77.A O no hydrogen 2.914 N/A ARG 66.A N GLN 111.A O no hydrogen 3.081 N/A ARG 66.A NE ASP 113.A OD1 no hydrogen 3.346 N/A TYR 67.A N TRP 75.A O no hydrogen 2.940 N/A LYS 68.A N ASN 109.A O no hydrogen 3.084 N/A GLY 77.A N LEU 65.A O no hydrogen 3.006 N/A GLY 79.A N ILE 63.A O no hydrogen 3.207 N/A HIS 80.A N GLU 95.A O no hydrogen 3.030 N/A HIS 80.A ND1 VAL 81.A O no hydrogen 3.341 N/A VAL 81.A N ASP 61.A O no hydrogen 2.867 N/A ILE 82.A N ALA 93.A O no hydrogen 2.741 N/A LYS 83.A NZ VAL 84.A O no hydrogen 3.226 N/A LYS 83.A NZ ASP 86.A OD2 no hydrogen 3.522 N/A LYS 83.A NZ GLU 91.A O no hydrogen 2.755 N/A ASP 86.A N GLY 89.A O no hydrogen 3.109 N/A ILE 92.A N PHE 53.A O no hydrogen 2.842 N/A ALA 93.A N LYS 83.A O no hydrogen 3.101 N/A ILE 94.A N ALA 51.A O no hydrogen 3.148 N/A GLU 95.A N HIS 80.A O no hydrogen 2.983 N/A LEU 96.A N ARG 49.A O no hydrogen 2.989 N/A ARG 97.A N ILE 78.A O no hydrogen 3.097 N/A VAL 104.A N ALA 102.A O no hydrogen 2.919 N/A THR 107.A OG1 THR 107.A O no hydrogen 2.524 N/A PHE 110.A N ILE 37.A O no hydrogen 3.241 N/A GLN 111.A N ARG 66.A O no hydrogen 2.874 N/A VAL 112.A N GLN 34.A O no hydrogen 3.031 N/A ASP 113.A N CYS 64.A O no hydrogen 3.049 N/A VAL 115.A N GLU 62.A O no hydrogen 3.130 N/A LYS 117.A NZ SER 118.A OG no hydrogen 3.081 N/A SER 118.A OG ASP 122.A OD2 no hydrogen 2.588 N/A ASP 122.A N SER 118.A O no hydrogen 2.835 N/A ARG 123.A N THR 119.A O no hydrogen 3.093 N/A ARG 123.A N SER 120.A O no hydrogen 3.229 N/A ARG 123.A NH1 VAL 315.A O no hydrogen 2.949 N/A MET 124.A N SER 120.A O no hydrogen 3.087 N/A GLN 125.A N PHE 121.A O no hydrogen 3.022 N/A GLN 125.A NE2 GLY 15.A O no hydrogen 3.011 N/A SER 126.A N ASP 122.A O no hydrogen 2.959 N/A ALA 127.A N ARG 123.A O no hydrogen 2.821 N/A LEU 128.A N MET 124.A O no hydrogen 3.062 N/A LYS 129.A N GLN 125.A O no hydrogen 3.189 N/A THR 130.A N SER 126.A O no hydrogen 2.972 N/A THR 130.A OG1 SER 126.A O no hydrogen 2.972 N/A PHE 131.A N ALA 127.A O no hydrogen 3.004 N/A ALA 132.A N LEU 128.A O no hydrogen 3.197 N/A ALA 132.A N LYS 129.A O no hydrogen 3.237 N/A VAL 133.A N LYS 129.A O no hydrogen 2.972 N/A ASP 134.A N THR 130.A O no hydrogen 2.852 N/A THR 136.A N ASP 134.A OD1 no hydrogen 2.936 N/A THR 136.A OG1 ASP 134.A OD1 no hydrogen 2.617 N/A SER 137.A N ASP 134.A O no hydrogen 3.355 N/A SER 137.A OG ASP 134.A O no hydrogen 3.013 N/A SER 139.A N ALA 351.A O no hydrogen 3.070 N/A ILE 142.A N SER 139.A OG no hydrogen 3.193 N/A HIS 144.A N GLY 140.A O no hydrogen 2.898 N/A HIS 144.A ND1 HIS 149.A ND1 no hydrogen 2.937 N/A LYS 145.A N TYR 141.A O no hydrogen 2.980 N/A LEU 146.A N ILE 142.A O no hydrogen 2.932 N/A LEU 147.A N TYR 143.A O no hydrogen 3.164 N/A GLY 148.A N LYS 145.A O no hydrogen 3.189 N/A HIS 149.A ND1 HIS 144.A ND1 no hydrogen 2.937 N/A HIS 149.A NE2 TYR 4.A O no hydrogen 2.722 N/A ILE 156.A N GLN 185.A O no hydrogen 2.967 N/A CYS 158.A SG LEU 184.A O no hydrogen 3.665 N/A LEU 169.A N ALA 166.A O no hydrogen 3.259 N/A LEU 172.A N THR 165.A OG1 no hydrogen 3.113 N/A ASN 173.A ND2 TYR 399.A OH no hydrogen 2.666 N/A SER 175.A OG ASN 173.A OD1 no hydrogen 2.738 N/A GLN 176.A N ASN 173.A OD1 no hydrogen 3.082 N/A VAL 177.A N ASN 173.A O no hydrogen 2.770 N/A TYR 178.A N HIS 174.A O no hydrogen 2.993 N/A ALA 179.A N SER 175.A O no hydrogen 3.057 N/A VAL 180.A N GLN 176.A O no hydrogen 2.942 N/A LYS 181.A N VAL 177.A O no hydrogen 3.051 N/A THR 182.A N TYR 178.A O no hydrogen 3.099 N/A THR 182.A OG1 TYR 178.A O no hydrogen 2.400 N/A VAL 183.A N ALA 179.A O no hydrogen 2.983 N/A LEU 184.A N VAL 180.A O no hydrogen 3.290 N/A GLN 185.A N THR 182.A O no hydrogen 3.219 N/A ARG 186.A N VAL 183.A O no hydrogen 3.422 N/A SER 189.A N LEU 354.A O no hydrogen 3.167 N/A ILE 191.A N LEU 356.A O no hydrogen 2.825 N/A GLN 192.A N ILE 393.A O no hydrogen 2.997 N/A GLN 192.A NE2 ASP 359.A OD1 no hydrogen 2.866 N/A GLY 193.A N GLY 358.A O no hydrogen 2.785 N/A THR 197.A N PRO 194.A O no hydrogen 3.149 N/A THR 197.A OG1 PRO 194.A O no hydrogen 2.507 N/A LYS 199.A NZ GLY 193.A O no hydrogen 2.910 N/A LYS 199.A NZ PRO 194.A O no hydrogen 3.423 N/A THR 200.A OG1 ASP 333.A OD2 no hydrogen 3.136 N/A THR 202.A N GLY 198.A O no hydrogen 3.000 N/A THR 202.A OG1 GLY 198.A O no hydrogen 2.379 N/A SER 203.A N LYS 199.A O no hydrogen 2.878 N/A SER 203.A OG LYS 199.A O no hydrogen 2.546 N/A ALA 204.A N THR 200.A O no hydrogen 2.904 N/A THR 205.A N VAL 201.A O no hydrogen 2.914 N/A THR 205.A OG1 VAL 201.A O no hydrogen 2.751 N/A ILE 206.A N THR 202.A O no hydrogen 2.852 N/A VAL 207.A N SER 203.A O no hydrogen 3.027 N/A TYR 208.A N ALA 204.A O no hydrogen 3.120 N/A HIS 209.A N THR 205.A O no hydrogen 3.227 N/A HIS 209.A NE2 PHE 164.A O no hydrogen 2.634 N/A LEU 210.A N ILE 206.A O no hydrogen 2.978 N/A ALA 211.A N VAL 207.A O no hydrogen 2.791 N/A ARG 212.A N TYR 208.A O no hydrogen 2.999 N/A ARG 212.A N HIS 209.A O no hydrogen 3.261 N/A GLN 213.A NE2 GLN 159.A O no hydrogen 3.550 N/A VAL 218.A N ASP 308.A O no hydrogen 3.055 N/A LEU 219.A N SER 329.A O no hydrogen 3.083 N/A VAL 220.A N ILE 310.A O no hydrogen 3.003 N/A CYS 221.A N LEU 331.A O no hydrogen 2.970 N/A CYS 221.A SG THR 313.A O no hydrogen 3.991 N/A ALA 222.A N CYS 312.A O no hydrogen 3.295 N/A ALA 227.A N SER 224.A OG no hydrogen 3.243 N/A VAL 228.A N SER 224.A O no hydrogen 3.045 N/A ASP 229.A N ASN 225.A O no hydrogen 3.067 N/A GLN 230.A N ILE 226.A O no hydrogen 3.130 N/A LEU 231.A N ALA 227.A O no hydrogen 3.321 N/A THR 232.A N VAL 228.A O no hydrogen 2.835 N/A THR 232.A OG1 VAL 228.A O no hydrogen 2.626 N/A GLU 233.A N ASP 229.A O no hydrogen 2.935 N/A LYS 234.A N GLN 230.A O no hydrogen 3.390 N/A ILE 235.A N LEU 231.A O no hydrogen 3.002 N/A HIS 236.A N THR 232.A O no hydrogen 3.093 N/A GLN 237.A N GLU 233.A O no hydrogen 3.072 N/A THR 238.A N ILE 235.A O no hydrogen 3.227 N/A THR 238.A OG1 ILE 235.A O no hydrogen 2.683 N/A GLY 239.A N HIS 236.A O no hydrogen 3.386 N/A LYS 241.A N ASP 308.A OD2 no hydrogen 3.107 N/A LYS 241.A NZ ASN 306.A O no hydrogen 3.535 N/A VAL 243.A N VAL 309.A O no hydrogen 3.002 N/A ARG 244.A N LEU 260.A O no hydrogen 3.171 N/A ARG 244.A NE ASP 229.A OD1 no hydrogen 3.171 N/A ARG 244.A NH1 LEU 245.A O no hydrogen 2.947 N/A ARG 244.A NH2 ASP 229.A OD1 no hydrogen 3.043 N/A LEU 245.A N CYS 311.A O no hydrogen 2.920 N/A LYS 248.A NZ ASP 319.A OD1 no hydrogen 3.448 N/A GLU 251.A N ALA 247.A O no hydrogen 3.046 N/A GLU 251.A N LYS 248.A O no hydrogen 3.387 N/A SER 258.A OG ASP 254.A OD1 no hydrogen 3.391 N/A SER 258.A OG SER 255.A O no hydrogen 3.171 N/A LEU 260.A N VAL 257.A O no hydrogen 3.391 N/A ALA 261.A N SER 258.A O no hydrogen 3.244 N/A LEU 262.A N ARG 244.A O no hydrogen 2.919 N/A ASN 264.A ND2 SER 258.A O no hydrogen 2.786 N/A GLN 265.A N ALA 261.A O no hydrogen 2.945 N/A GLN 265.A NE2 VAL 242.A O no hydrogen 3.074 N/A GLN 265.A NE2 LEU 260.A O no hydrogen 2.721 N/A ILE 266.A N LEU 262.A O no hydrogen 2.980 N/A ARG 267.A N HIS 263.A O no hydrogen 3.400 N/A ASN 268.A ND2 ASN 264.A O no hydrogen 3.313 N/A GLN 276.A N MET 272.A O no hydrogen 3.467 N/A GLN 276.A NE2 ARG 267.A O no hydrogen 2.952 N/A LYS 277.A N PRO 273.A O no hydrogen 3.330 N/A GLN 279.A N LEU 275.A O no hydrogen 3.141 N/A GLN 280.A N GLN 276.A O no hydrogen 2.887 N/A LEU 281.A N LEU 278.A O no hydrogen 3.235 N/A LYS 282.A NZ GLU 289.A OE2 no hydrogen 3.561 N/A SER 285.A OG ASP 288.A OD2 no hydrogen 3.003 N/A ARG 291.A NH1 GLU 274.A OE2 no hydrogen 3.079 N/A TYR 292.A N ASP 288.A O no hydrogen 3.030 N/A ARG 293.A N GLU 289.A O no hydrogen 3.171 N/A ALA 294.A N LYS 290.A O no hydrogen 3.236 N/A LEU 295.A N ARG 291.A O no hydrogen 3.156 N/A LYS 296.A N TYR 292.A O no hydrogen 2.950 N/A ARG 297.A N ARG 293.A O no hydrogen 2.965 N/A ARG 297.A NH1 ARG 321.A O no hydrogen 3.114 N/A THR 298.A N ALA 294.A O no hydrogen 3.125 N/A THR 298.A OG1 ALA 294.A O no hydrogen 3.085 N/A ALA 299.A N LEU 295.A O no hydrogen 2.830 N/A GLU 300.A N LYS 296.A O no hydrogen 2.934 N/A ARG 301.A N ARG 297.A O no hydrogen 3.133 N/A ARG 301.A NH1 ARG 321.A O no hydrogen 3.381 N/A GLU 302.A N THR 298.A O no hydrogen 3.287 N/A GLU 302.A N ALA 299.A O no hydrogen 3.019 N/A LEU 303.A N ALA 299.A O no hydrogen 3.072 N/A LEU 304.A N GLU 300.A O no hydrogen 2.878 N/A MET 305.A N ARG 301.A O no hydrogen 3.129 N/A ASN 306.A N GLU 302.A O no hydrogen 3.266 N/A ASN 306.A ND2 GLU 302.A O no hydrogen 2.780 N/A ASP 308.A N LYS 241.A O no hydrogen 2.986 N/A VAL 309.A N LYS 241.A O no hydrogen 3.270 N/A ILE 310.A N VAL 218.A O no hydrogen 3.029 N/A CYS 311.A N VAL 243.A O no hydrogen 2.869 N/A CYS 312.A N VAL 220.A O no hydrogen 2.998 N/A CYS 312.A SG THR 313.A O no hydrogen 3.083 N/A THR 313.A OG1 ALA 222.A O no hydrogen 2.925 N/A THR 313.A OG1 PRO 223.A O no hydrogen 2.908 N/A CYS 314.A N ALA 222.A O no hydrogen 3.123 N/A ALA 317.A N CYS 314.A O no hydrogen 3.133 N/A GLY 318.A N VAL 315.A O no hydrogen 3.178 N/A ASP 319.A N GLY 316.A O no hydrogen 3.228 N/A ARG 321.A N ASP 319.A OD1 no hydrogen 2.819 N/A ARG 321.A NE ASP 319.A OD1 no hydrogen 3.391 N/A ARG 321.A NE ASP 319.A OD2 no hydrogen 3.430 N/A ARG 321.A NH2 ASP 319.A OD2 no hydrogen 3.241 N/A LEU 322.A N ASP 319.A O no hydrogen 3.194 N/A GLN 326.A NE2 THR 136.A O no hydrogen 3.309 N/A PHE 327.A N LEU 349.A O no hydrogen 2.732 N/A ILE 330.A N GLN 353.A O no hydrogen 2.927 N/A LEU 331.A N LEU 219.A O no hydrogen 3.058 N/A ILE 332.A N ILE 355.A O no hydrogen 3.011 N/A ASP 333.A N CYS 221.A O no hydrogen 2.955 N/A GLU 334.A N ASP 333.A OD1 no hydrogen 2.866 N/A SER 335.A N VAL 357.A O no hydrogen 2.797 N/A SER 335.A OG VAL 357.A O no hydrogen 3.015 N/A GLN 337.A N GLU 334.A O no hydrogen 3.165 N/A ALA 338.A N SER 335.A O no hydrogen 3.107 N/A THR 339.A N GLU 342.A OE1 no hydrogen 3.223 N/A CYS 343.A N THR 339.A O no hydrogen 3.161 N/A CYS 343.A SG THR 339.A O no hydrogen 4.026 N/A MET 344.A N GLU 340.A O no hydrogen 3.006 N/A VAL 345.A N GLU 342.A O no hydrogen 3.266 N/A VAL 347.A N CYS 343.A O no hydrogen 3.498 N/A VAL 348.A N MET 344.A O no hydrogen 3.317 N/A LEU 349.A N PRO 346.A O no hydrogen 2.996 N/A GLY 350.A N SER 137.A O no hydrogen 2.948 N/A ALA 351.A N SER 137.A O no hydrogen 3.189 N/A ALA 351.A N VAL 347.A O no hydrogen 3.411 N/A LYS 352.A N ARG 328.A O no hydrogen 2.935 N/A GLN 353.A N ARG 328.A O no hydrogen 3.064 N/A GLN 353.A NE2 VAL 183.A O no hydrogen 3.046 N/A GLN 353.A NE2 LEU 184.A O no hydrogen 3.341 N/A GLN 353.A NE2 ARG 186.A O no hydrogen 3.190 N/A LEU 354.A N PRO 187.A O no hydrogen 2.905 N/A ILE 355.A N ILE 330.A O no hydrogen 3.004 N/A LEU 356.A N SER 189.A O no hydrogen 2.922 N/A VAL 357.A N ILE 332.A O no hydrogen 3.053 N/A GLY 358.A N ILE 191.A O no hydrogen 3.110 N/A ASP 359.A N THR 336.A OG1 no hydrogen 2.865 N/A CYS 361.A N ASP 359.A OD1 no hydrogen 3.202 N/A CYS 361.A SG PHE 413.A O no hydrogen 3.791 N/A GLN 362.A N ASP 359.A O no hydrogen 3.124 N/A LEU 363.A N GLN 527.A OE1 no hydrogen 3.042 N/A MET 368.A N GLU 21.A OE2 no hydrogen 2.911 N/A ALA 373.A N CYS 369.A O no hydrogen 3.135 N/A LYS 374.A N LYS 370.A O no hydrogen 3.067 N/A ALA 375.A N LYS 371.A O no hydrogen 3.213 N/A GLY 376.A N ALA 373.A O no hydrogen 3.097 N/A LEU 377.A N ALA 372.A O no hydrogen 2.976 N/A SER 378.A OG ALA 373.A O no hydrogen 3.275 N/A GLN 379.A N GLY 376.A O no hydrogen 3.296 N/A SER 380.A N GLU 383.A OE1 no hydrogen 3.159 N/A SER 380.A OG GLU 383.A OE1 no hydrogen 2.920 N/A GLU 383.A N SER 380.A OG no hydrogen 3.204 N/A ARG 384.A N SER 380.A O no hydrogen 3.104 N/A ARG 384.A NE GLU 340.A OE1 no hydrogen 2.867 N/A ARG 384.A NE GLU 340.A OE2 no hydrogen 3.405 N/A ARG 384.A NH1 SER 2.A O no hydrogen 3.273 N/A ARG 384.A NH1 LEU 146.A O no hydrogen 2.900 N/A ARG 384.A NH2 LEU 146.A O no hydrogen 2.951 N/A ARG 384.A NH2 GLU 340.A OE1 no hydrogen 3.491 N/A ARG 384.A NH2 GLU 340.A OE2 no hydrogen 2.653 N/A LEU 385.A N LEU 381.A O no hydrogen 3.015 N/A VAL 386.A N PHE 382.A O no hydrogen 3.080 N/A VAL 387.A N GLU 383.A O no hydrogen 2.981 N/A LEU 388.A N ARG 384.A O no hydrogen 3.011 N/A GLY 389.A N VAL 386.A O no hydrogen 3.165 N/A ILE 390.A N LEU 385.A O no hydrogen 3.120 N/A ILE 393.A N LEU 190.A O no hydrogen 3.081 N/A ARG 394.A NE GLN 192.A OE1 no hydrogen 2.759 N/A ARG 394.A NH1 TYR 414.A O no hydrogen 2.950 N/A ARG 394.A NH1 GLU 415.A OE1 no hydrogen 3.128 N/A ARG 394.A NH1 SER 417.A OG no hydrogen 2.995 N/A ARG 394.A NH2 GLN 192.A OE1 no hydrogen 3.209 N/A ARG 394.A NH2 GLU 415.A OE1 no hydrogen 3.038 N/A LEU 395.A N GLN 192.A O no hydrogen 3.078 N/A GLN 396.A N SER 175.A OG no hydrogen 3.229 N/A GLN 398.A N GLN 419.A O no hydrogen 2.934 N/A GLN 398.A NE2 MET 401.A O no hydrogen 3.191 N/A GLN 398.A NE2 ASN 420.A OD1 no hydrogen 2.585 N/A TYR 399.A N GLY 196.A O no hydrogen 2.906 N/A ARG 400.A N GLN 398.A OE1 no hydrogen 3.141 N/A ARG 400.A NE GLU 530.A OE1 no hydrogen 2.950 N/A ARG 400.A NH1 THR 555.A O no hydrogen 2.833 N/A MET 401.A N GLN 398.A OE1 no hydrogen 3.006 N/A HIS 402.A N ARG 558.A O no hydrogen 3.176 N/A LEU 405.A N HIS 402.A O no hydrogen 2.922 N/A SER 406.A N HIS 402.A O no hydrogen 3.467 N/A SER 406.A OG PRO 403.A O no hydrogen 2.906 N/A SER 406.A OG ASN 420.A OD1 no hydrogen 2.832 N/A ALA 407.A N ALA 404.A O no hydrogen 3.260 N/A SER 410.A N SER 406.A O no hydrogen 3.028 N/A ASN 411.A N ALA 407.A O no hydrogen 3.122 N/A ILE 412.A N PHE 408.A O no hydrogen 3.055 N/A PHE 413.A N PRO 409.A O no hydrogen 3.077 N/A TYR 414.A N SER 410.A O no hydrogen 3.079 N/A TYR 414.A OH ASP 359.A OD2 no hydrogen 2.511 N/A TYR 414.A OH ASN 551.A OD1 no hydrogen 2.883 N/A GLY 416.A N SER 410.A O no hydrogen 2.843 N/A SER 417.A N TYR 414.A O no hydrogen 2.945 N/A SER 417.A OG GLN 396.A OE1 no hydrogen 3.430 N/A SER 417.A OG TYR 414.A O no hydrogen 3.356 N/A LEU 418.A N SER 410.A OG no hydrogen 3.344 N/A GLN 419.A N GLN 396.A O no hydrogen 2.791 N/A GLY 421.A N GLN 398.A O no hydrogen 3.021 N/A ASP 426.A N THR 423.A O no hydrogen 3.215 N/A ARG 427.A N THR 423.A O no hydrogen 3.295 N/A ARG 427.A N ALA 424.A O no hydrogen 3.110 N/A ARG 427.A NH2 TYR 399.A O no hydrogen 3.074 N/A LYS 429.A NZ ASP 532.A OD2 no hydrogen 2.873 N/A LYS 441.A N GLN 438.A O no hydrogen 3.113 N/A MET 443.A N LYS 441.A O no hydrogen 2.667 N/A PHE 444.A N VAL 561.A O no hydrogen 3.329 N/A PHE 445.A N VAL 588.A O no hydrogen 2.905 N/A TYR 446.A N ILE 563.A O no hydrogen 2.790 N/A TYR 446.A OH GLY 592.A O no hydrogen 2.521 N/A VAL 447.A N VAL 590.A O no hydrogen 3.060 N/A THR 448.A N GLY 565.A O no hydrogen 3.058 N/A GLN 449.A NE2 GLU 591.A OE2 no hydrogen 3.366 N/A GLU 453.A N LEU 462.A O no hydrogen 3.221 N/A SER 457.A OG ALA 455.A O no hydrogen 2.767 N/A ASN 463.A ND2 GLY 450.A O no hydrogen 3.141 N/A ASN 463.A ND2 VAL 539.A O no hydrogen 3.052 N/A GLU 466.A N ASN 463.A OD1 no hydrogen 3.236 N/A ALA 467.A N ASN 463.A O no hydrogen 2.992 N/A ASN 469.A N THR 465.A O no hydrogen 3.218 N/A VAL 470.A N GLU 466.A O no hydrogen 2.978 N/A GLU 471.A N ALA 467.A O no hydrogen 3.100 N/A LYS 472.A N ALA 468.A O no hydrogen 3.113 N/A ILE 473.A N ASN 469.A O no hydrogen 3.047 N/A THR 474.A N VAL 470.A O no hydrogen 2.914 N/A THR 474.A OG1 VAL 470.A O no hydrogen 2.738 N/A THR 475.A N GLU 471.A O no hydrogen 2.912 N/A THR 475.A OG1 GLU 471.A O no hydrogen 2.787 N/A THR 475.A OG1 GLU 471.A OE2 no hydrogen 2.804 N/A THR 475.A OG1 TYR 515.A OH no hydrogen 2.996 N/A LYS 476.A N LYS 472.A O no hydrogen 3.050 N/A LEU 477.A N ILE 473.A O no hydrogen 3.081 N/A LEU 478.A N THR 474.A O no hydrogen 3.230 N/A LYS 479.A N THR 475.A O no hydrogen 3.209 N/A GLY 481.A N LEU 478.A O no hydrogen 3.322 N/A GLN 486.A N LYS 483.A O no hydrogen 3.191 N/A GLN 486.A NE2 ASP 485.A OD2 no hydrogen 3.441 N/A ILE 487.A N PRO 484.A O no hydrogen 3.144 N/A GLY 488.A N PHE 533.A O no hydrogen 2.871 N/A ILE 489.A N GLU 519.A O no hydrogen 2.945 N/A ILE 490.A N ILE 535.A O no hydrogen 2.849 N/A THR 491.A N ALA 521.A O no hydrogen 3.061 N/A THR 491.A OG1 SER 537.A O no hydrogen 3.167 N/A GLY 495.A N SER 460.A OG no hydrogen 3.145 N/A GLN 496.A NE2 ASN 463.A O no hydrogen 3.127 N/A GLN 496.A NE2 SER 537.A OG no hydrogen 3.024 N/A ARG 497.A N TYR 493.A O no hydrogen 3.297 N/A ARG 497.A NE GLU 494.A OE1 no hydrogen 3.288 N/A ARG 497.A NE GLU 494.A OE2 no hydrogen 3.005 N/A SER 498.A N GLU 494.A O no hydrogen 3.074 N/A SER 498.A OG GLU 494.A O no hydrogen 2.839 N/A SER 498.A OG GLU 494.A OE2 no hydrogen 3.205 N/A TYR 499.A N GLY 495.A O no hydrogen 3.155 N/A LEU 500.A N GLN 496.A O no hydrogen 2.842 N/A VAL 501.A N ARG 497.A O no hydrogen 3.056 N/A GLN 502.A N SER 498.A O no hydrogen 3.305 N/A TYR 503.A N TYR 499.A O no hydrogen 2.965 N/A MET 504.A N LEU 500.A O no hydrogen 3.012 N/A PHE 506.A N GLN 502.A O no hydrogen 3.162 N/A LEU 510.A N TYR 515.A OH no hydrogen 3.376 N/A TYR 515.A OH THR 475.A OG1 no hydrogen 2.996 N/A GLN 516.A N THR 512.A O no hydrogen 3.085 N/A GLN 516.A NE2 THR 512.A O no hydrogen 3.544 N/A VAL 518.A N TYR 515.A O no hydrogen 3.041 N/A ALA 521.A N ILE 489.A O no hydrogen 3.121 N/A SER 522.A OG ASP 524.A OD2 no hydrogen 3.451 N/A PHE 526.A N VAL 523.A O no hydrogen 2.993 N/A GLN 527.A N ASP 524.A O no hydrogen 3.484 N/A ARG 529.A NH1 GLU 519.A OE2 no hydrogen 2.739 N/A ARG 529.A NH1 ALA 525.A O no hydrogen 3.262 N/A ARG 529.A NH2 GLU 519.A OE1 no hydrogen 3.032 N/A ARG 529.A NH2 GLU 519.A OE2 no hydrogen 3.204 N/A LYS 531.A N ARG 556.A O no hydrogen 3.092 N/A LYS 531.A NZ GLU 519.A OE1 no hydrogen 2.698 N/A PHE 533.A N GLN 486.A O no hydrogen 3.040 N/A ILE 534.A N GLY 560.A O no hydrogen 2.924 N/A ILE 535.A N GLY 488.A O no hydrogen 2.836 N/A LEU 536.A N ILE 562.A O no hydrogen 2.886 N/A SER 537.A N ILE 490.A O no hydrogen 2.900 N/A SER 537.A OG GLU 466.A OE1 no hydrogen 2.623 N/A CYS 538.A N VAL 564.A O no hydrogen 3.158 N/A CYS 538.A SG VAL 564.A O no hydrogen 3.579 N/A ARG 540.A NE ARG 540.A O no hydrogen 2.527 N/A ARG 540.A NH2 TYR 493.A OH no hydrogen 2.905 N/A ASN 545.A N GLY 542.A O no hydrogen 3.296 N/A ARG 548.A N ASP 546.A OD2 no hydrogen 3.165 N/A ARG 549.A NH1 ASP 524.A OD2 no hydrogen 2.624 N/A ARG 549.A NH2 ASP 524.A OD1 no hydrogen 3.424 N/A LEU 550.A N ASP 546.A O no hydrogen 3.411 N/A ASN 551.A N PRO 547.A O no hydrogen 3.249 N/A VAL 552.A N ARG 548.A O no hydrogen 3.170 N/A ALA 553.A N ARG 549.A O no hydrogen 3.068 N/A LEU 554.A N LEU 550.A O no hydrogen 3.042 N/A THR 555.A N VAL 552.A O no hydrogen 3.170 N/A THR 555.A OG1 ASN 551.A O no hydrogen 2.668 N/A THR 555.A OG1 VAL 552.A O no hydrogen 3.200 N/A ARG 556.A NE VAL 552.A O no hydrogen 2.659 N/A ARG 556.A NH1 ARG 529.A O no hydrogen 2.949 N/A ARG 556.A NH2 THR 555.A OG1 no hydrogen 3.024 N/A ARG 558.A N LYS 531.A O no hydrogen 2.996 N/A TYR 559.A N ASP 532.A O no hydrogen 2.753 N/A GLY 560.A N ASP 532.A O no hydrogen 3.117 N/A VAL 561.A N PRO 442.A O no hydrogen 3.227 N/A ILE 562.A N ILE 534.A O no hydrogen 2.864 N/A ILE 563.A N PHE 444.A O no hydrogen 3.002 N/A VAL 564.A N LEU 536.A O no hydrogen 2.750 N/A ASN 566.A ND2 THR 448.A O no hydrogen 3.501 N/A ALA 569.A N ASN 566.A OD1 no hydrogen 3.445 N/A LEU 570.A N ASN 566.A O no hydrogen 3.110 N/A SER 571.A N PRO 567.A O no hydrogen 3.186 N/A SER 571.A OG PRO 567.A O no hydrogen 2.747 N/A LYS 572.A N ALA 569.A O no hydrogen 3.313 N/A GLN 573.A N LEU 570.A O no hydrogen 3.241 N/A ASN 577.A N GLN 573.A O no hydrogen 3.322 N/A HIS 578.A N PRO 574.A O no hydrogen 3.241 N/A LEU 579.A N LEU 575.A O no hydrogen 3.082 N/A LEU 580.A N TRP 576.A O no hydrogen 2.847 N/A ASN 581.A N ASN 577.A O no hydrogen 3.049 N/A ASN 581.A ND2 ASN 577.A O no hydrogen 3.086 N/A TYR 582.A N HIS 578.A O no hydrogen 3.042 N/A TYR 583.A N LEU 579.A O no hydrogen 3.106 N/A LYS 584.A N LEU 580.A O no hydrogen 3.092 N/A GLU 585.A N ASN 581.A O no hydrogen 3.281 N/A GLN 586.A N TYR 582.A O no hydrogen 3.329 N/A LYS 587.A N LYS 584.A O no hydrogen 3.100 N/A VAL 588.A N TYR 583.A O no hydrogen 2.902 N/A ASN 596.A N PRO 593.A O no hydrogen 3.244 N/A ARG 598.A N GLU 591.A O no hydrogen 3.324 N/A SER 600.A N LEU 589.A O no hydrogen 3.181 N/A SER 600.A OG GLU 591.A OE1 no hydrogen 3.541 N/A