Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8srr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N GLU 2.A OE1 no hydrogen 3.332 N/A GLU 2.A N GLU 2.A OE1 no hydrogen 2.701 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.422 N/A LEU 8.A N HIS 4.A O no hydrogen 3.328 N/A ILE 9.A N LEU 5.A O no hydrogen 3.093 N/A CYS 10.A N GLU 6.A O no hydrogen 3.213 N/A CYS 10.A SG GLU 6.A O no hydrogen 3.255 N/A GLU 14.A N LYS 11.A O no hydrogen 3.134 N/A SER 16.A OG CYS 18.A O no hydrogen 2.942 N/A CYS 18.A SG SER 19.A O no hydrogen 3.596 N/A ASN 23.A N SER 19.A O no hydrogen 2.987 N/A LEU 24.A N LEU 20.A O no hydrogen 2.992 N/A GLU 25.A N GLU 21.A O no hydrogen 3.454 N/A GLY 26.A N SER 22.A O no hydrogen 3.196 N/A LEU 27.A N ASN 23.A O no hydrogen 3.085 N/A ALA 28.A N LEU 24.A O no hydrogen 2.996 N/A ALA 28.A N GLU 25.A O no hydrogen 3.227 N/A LEU 31.A N LEU 27.A O no hydrogen 3.310 N/A GLU 32.A N GLY 29.A O no hydrogen 3.013 N/A LEU 35.A N GLU 32.A O no hydrogen 3.218 N/A TYR 38.A N LEU 35.A O no hydrogen 3.286 N/A LYS 39.A NZ GLU 77.A OE2 no hydrogen 3.091 N/A LYS 41.A NZ GLU 2.A O no hydrogen 2.492 N/A ILE 42.A N TYR 38.A O no hydrogen 2.939 N/A LEU 43.A N LYS 39.A O no hydrogen 3.087 N/A ARG 44.A N SER 40.A O no hydrogen 3.336 N/A LEU 45.A N LYS 41.A O no hydrogen 2.922 N/A LEU 46.A N ILE 42.A O no hydrogen 2.925 N/A CYS 47.A N LEU 43.A O no hydrogen 2.912 N/A CYS 47.A SG LEU 43.A O no hydrogen 3.158 N/A THR 48.A N ARG 44.A O no hydrogen 3.024 N/A THR 48.A OG1 ARG 44.A O no hydrogen 2.952 N/A THR 48.A OG1 LEU 45.A O no hydrogen 2.670 N/A VAL 49.A N LEU 45.A O no hydrogen 3.064 N/A ALA 50.A N LEU 46.A O no hydrogen 3.064 N/A ALA 50.A N CYS 47.A O no hydrogen 3.260 N/A ARG 51.A N THR 48.A O no hydrogen 3.246 N/A LEU 53.A N VAL 49.A O no hydrogen 3.184 N/A ILE 59.A N LYS 56.A O no hydrogen 3.173 N/A TYR 60.A N LYS 56.A O no hydrogen 3.378 N/A TYR 60.A OH ILE 9.A O no hydrogen 3.110 N/A THR 61.A N LEU 57.A O no hydrogen 2.901 N/A THR 61.A OG1 LEU 57.A O no hydrogen 3.173 N/A THR 61.A OG1 THR 58.A O no hydrogen 2.797 N/A THR 61.A OG1 ASP 107.A OD2 no hydrogen 2.757 N/A THR 62.A N THR 58.A O no hydrogen 3.435 N/A THR 62.A OG1 ILE 59.A O no hydrogen 2.587 N/A VAL 64.A N TYR 60.A O no hydrogen 3.013 N/A GLY 65.A N THR 61.A O no hydrogen 2.876 N/A LEU 66.A N THR 62.A O no hydrogen 2.776 N/A LEU 67.A N LEU 63.A O no hydrogen 3.175 N/A ASN 68.A N VAL 64.A O no hydrogen 2.790 N/A ASN 68.A ND2 LEU 238.A O no hydrogen 3.274 N/A ALA 69.A N GLY 65.A O no hydrogen 3.186 N/A ARG 70.A N LEU 66.A O no hydrogen 3.225 N/A ARG 70.A NH1 GLU 32.A OE1 no hydrogen 3.101 N/A ASN 71.A N LEU 67.A O no hydrogen 2.898 N/A ASN 73.A N ASN 71.A OD1 no hydrogen 3.122 N/A GLY 76.A N TYR 72.A O no hydrogen 3.253 N/A GLU 77.A N ASN 73.A O no hydrogen 3.162 N/A PHE 78.A N PHE 74.A O no hydrogen 2.977 N/A VAL 79.A N GLY 75.A O no hydrogen 3.077 N/A GLU 80.A N GLY 76.A O no hydrogen 3.053 N/A ALA 81.A N GLU 77.A O no hydrogen 2.998 N/A MET 82.A N PHE 78.A O no hydrogen 2.957 N/A ILE 83.A N VAL 79.A O no hydrogen 3.239 N/A ARG 84.A N GLU 80.A O no hydrogen 3.273 N/A GLN 85.A N ALA 81.A O no hydrogen 2.722 N/A LEU 86.A N MET 82.A O no hydrogen 2.551 N/A LYS 87.A N ILE 83.A O no hydrogen 2.563 N/A GLU 88.A N ARG 84.A O no hydrogen 3.163 N/A SER 89.A N GLN 85.A O no hydrogen 3.188 N/A SER 89.A OG ASN 94.A O no hydrogen 3.047 N/A SER 89.A OG GLU 97.A OE2 no hydrogen 2.320 N/A LEU 90.A N LEU 86.A O no hydrogen 3.151 N/A LYS 91.A N LYS 87.A O no hydrogen 3.138 N/A ALA 92.A N GLU 88.A O no hydrogen 2.943 N/A ALA 92.A N SER 89.A O no hydrogen 3.181 N/A ASN 93.A N LEU 90.A O no hydrogen 3.023 N/A ASN 94.A N SER 89.A O no hydrogen 3.086 N/A GLU 97.A N GLU 97.A OE1 no hydrogen 2.668 N/A VAL 99.A N TYR 95.A O no hydrogen 3.444 N/A LEU 101.A N GLU 97.A O no hydrogen 3.146 N/A LEU 101.A N ALA 98.A O no hydrogen 2.972 N/A VAL 102.A N ALA 98.A O no hydrogen 3.132 N/A ARG 103.A N VAL 99.A O no hydrogen 3.181 N/A ARG 103.A NH1 GLU 290.A OE2 no hydrogen 2.741 N/A ARG 103.A NH2 SER 149.A OG no hydrogen 2.560 N/A ARG 103.A NH2 GLU 290.A OE2 no hydrogen 2.750 N/A PHE 104.A N TYR 100.A O no hydrogen 3.142 N/A LEU 105.A N LEU 101.A O no hydrogen 2.877 N/A SER 106.A N VAL 102.A O no hydrogen 2.875 N/A SER 106.A OG VAL 102.A O no hydrogen 3.143 N/A SER 106.A OG ARG 103.A O no hydrogen 2.534 N/A ASP 107.A N ARG 103.A O no hydrogen 2.823 N/A LEU 108.A N PHE 104.A O no hydrogen 3.224 N/A LEU 108.A N LEU 105.A O no hydrogen 3.107 N/A VAL 109.A N SER 106.A O no hydrogen 3.087 N/A ASN 110.A N ASP 107.A O no hydrogen 2.981 N/A HIS 112.A N VAL 109.A O no hydrogen 3.156 N/A HIS 112.A ND1 ASN 110.A O no hydrogen 2.852 N/A VAL 113.A N LEU 108.A O no hydrogen 3.114 N/A ILE 114.A N LEU 108.A O no hydrogen 3.448 N/A ALA 115.A N HIS 240.A O no hydrogen 2.832 N/A SER 118.A OG ALA 115.A O no hydrogen 2.651 N/A MET 119.A N ALA 115.A O no hydrogen 3.404 N/A VAL 120.A N ALA 116.A O no hydrogen 3.061 N/A ALA 121.A N PRO 117.A O no hydrogen 2.836 N/A MET 122.A N SER 118.A O no hydrogen 2.969 N/A PHE 123.A N MET 119.A O no hydrogen 3.057 N/A GLU 124.A N VAL 120.A O no hydrogen 3.051 N/A ASN 125.A ND2 PHE 245.A O no hydrogen 2.497 N/A PHE 126.A N MET 122.A O no hydrogen 3.152 N/A VAL 127.A N PHE 123.A O no hydrogen 2.930 N/A SER 128.A N GLU 124.A O no hydrogen 2.827 N/A SER 128.A OG ASN 125.A O no hydrogen 2.608 N/A THR 130.A N VAL 127.A O no hydrogen 2.977 N/A GLN 131.A N SER 128.A O no hydrogen 3.000 N/A GLU 132.A N VAL 129.A O no hydrogen 3.038 N/A ARG 139.A N PRO 136.A O no hydrogen 3.190 N/A ARG 139.A NH1 PRO 248.A O no hydrogen 3.003 N/A ARG 139.A NH2 GLU 132.A OE2 no hydrogen 2.926 N/A ARG 139.A NH2 PRO 248.A O no hydrogen 3.385 N/A ASP 141.A N GLN 137.A O no hydrogen 3.103 N/A TRP 142.A N VAL 138.A O no hydrogen 3.213 N/A TYR 143.A N ARG 139.A O no hydrogen 3.363 N/A VAL 144.A N ARG 140.A O no hydrogen 3.320 N/A TYR 145.A N ASP 141.A O no hydrogen 2.705 N/A ALA 146.A N TRP 142.A O no hydrogen 2.718 N/A PHE 147.A N TYR 143.A O no hydrogen 3.212 N/A LEU 148.A N VAL 144.A O no hydrogen 2.997 N/A SER 149.A N TYR 145.A O no hydrogen 2.731 N/A SER 150.A N ALA 146.A O no hydrogen 3.404 N/A SER 150.A OG ALA 146.A O no hydrogen 3.247 N/A SER 150.A OG PHE 147.A O no hydrogen 3.207 N/A LEU 151.A N LEU 148.A O no hydrogen 3.274 N/A LEU 158.A N VAL 154.A O no hydrogen 3.359 N/A TYR 159.A N GLY 155.A O no hydrogen 3.034 N/A TYR 159.A OH ASP 167.A OD1 no hydrogen 3.135 N/A GLU 160.A N LYS 156.A O no hydrogen 3.101 N/A LYS 161.A N GLU 157.A O no hydrogen 3.436 N/A LYS 162.A N LEU 158.A O no hydrogen 3.302 N/A ASP 167.A N ASP 163.A O no hydrogen 3.104 N/A ARG 168.A N ALA 164.A O no hydrogen 3.340 N/A ARG 168.A NH2 GLU 124.A OE2 no hydrogen 3.549 N/A ILE 169.A N GLU 165.A O no hydrogen 2.674 N/A PHE 170.A N MET 166.A O no hydrogen 2.451 N/A ALA 171.A N ASP 167.A O no hydrogen 2.784 N/A ASN 172.A N ARG 168.A O no hydrogen 3.271 N/A THR 173.A N ILE 169.A O no hydrogen 3.218 N/A GLU 174.A N PHE 170.A O no hydrogen 2.937 N/A SER 175.A N ALA 171.A O no hydrogen 3.028 N/A TYR 176.A N ASN 172.A O no hydrogen 2.888 N/A TYR 176.A OH ASP 141.A OD1 no hydrogen 2.237 N/A LEU 177.A N THR 173.A O no hydrogen 3.032 N/A LYS 178.A N GLU 174.A O no hydrogen 3.352 N/A LYS 178.A N SER 175.A O no hydrogen 3.228 N/A ARG 179.A N TYR 176.A O no hydrogen 3.187 N/A ARG 180.A NE ASP 141.A OD1 no hydrogen 2.526 N/A ARG 180.A NE ASP 141.A OD2 no hydrogen 3.244 N/A ARG 180.A NH1 GLU 201.A OE1 no hydrogen 2.466 N/A ARG 180.A NH2 ASP 141.A OD2 no hydrogen 2.371 N/A ARG 180.A NH2 GLU 201.A OE2 no hydrogen 2.357 N/A LYS 182.A NZ GLU 201.A OE1 no hydrogen 2.755 N/A LYS 182.A NZ ASP 204.A OD1 no hydrogen 3.151 N/A LYS 182.A NZ ASP 204.A OD2 no hydrogen 2.509 N/A HIS 184.A NE2 GLU 201.A OE2 no hydrogen 2.724 N/A VAL 185.A N LYS 182.A O no hydrogen 2.982 N/A LEU 188.A N VAL 185.A O no hydrogen 2.975 N/A GLN 189.A N VAL 185.A O no hydrogen 3.103 N/A TYR 202.A N ARG 260.A O no hydrogen 3.072 N/A CYS 205.A N GLU 201.A O no hydrogen 2.952 N/A LEU 206.A N TYR 202.A O no hydrogen 2.747 N/A TRP 207.A N LEU 203.A O no hydrogen 2.780 N/A ALA 208.A N ASP 204.A O no hydrogen 3.041 N/A GLN 209.A N CYS 205.A O no hydrogen 3.038 N/A GLN 209.A NE2 SER 280.A O no hydrogen 3.634 N/A ILE 210.A N LEU 206.A O no hydrogen 2.953 N/A GLN 211.A N TRP 207.A O no hydrogen 2.953 N/A LYS 212.A N ALA 208.A O no hydrogen 3.208 N/A LEU 213.A N GLN 209.A O no hydrogen 3.030 N/A LYS 214.A N ILE 210.A O no hydrogen 2.751 N/A LYS 215.A N GLN 211.A O no hydrogen 2.944 N/A LYS 215.A N LYS 212.A O no hydrogen 2.995 N/A TRP 218.A N LEU 213.A O no hydrogen 2.918 N/A GLN 219.A N ASP 216.A O no hydrogen 3.298 N/A GLU 220.A N GLU 220.A OE1 no hydrogen 2.601 N/A HIS 222.A NE2 TYR 313.A OH no hydrogen 2.965 N/A ARG 225.A NE GLU 220.A OE2 no hydrogen 2.898 N/A ARG 225.A NH1 TRP 153.A O no hydrogen 2.916 N/A ARG 225.A NH1 TYR 227.A OH no hydrogen 2.380 N/A ARG 225.A NH2 PRO 152.A O no hydrogen 3.001 N/A ARG 225.A NH2 TRP 153.A O no hydrogen 3.547 N/A ARG 225.A NH2 GLU 220.A OE2 no hydrogen 2.567 N/A LEU 228.A N ARG 225.A O no hydrogen 3.175 N/A ALA 229.A N PRO 226.A O no hydrogen 3.135 N/A LEU 234.A N PHE 230.A O no hydrogen 3.411 N/A CYS 235.A SG ASP 231.A O no hydrogen 3.123 N/A CYS 235.A SG ASP 231.A OD1 no hydrogen 3.572 N/A ALA 237.A N LEU 234.A O no hydrogen 3.320 N/A GLN 239.A N GLN 239.A OE1 no hydrogen 2.620 N/A HIS 240.A N VAL 113.A O no hydrogen 2.695 N/A HIS 250.A ND1 TYR 256.A OH no hydrogen 2.512 N/A THR 251.A OG1 ASP 253.A OD1 no hydrogen 2.736 N/A GLU 252.A N GLU 252.A OE1 no hydrogen 2.585 N/A SER 254.A N THR 251.A O no hydrogen 3.154 N/A SER 254.A OG HIS 250.A ND1 no hydrogen 3.074 N/A SER 254.A OG THR 251.A O no hydrogen 2.345 N/A SER 254.A OG TYR 256.A OH no hydrogen 3.043 N/A TYR 256.A OH HIS 250.A ND1 no hydrogen 2.512 N/A TYR 256.A OH SER 254.A OG no hydrogen 3.043 N/A ILE 262.A N GLU 200.A O no hydrogen 3.250 N/A ARG 264.A NE GLU 327.A OE2 no hydrogen 2.746 N/A ARG 264.A NH1 SER 280.A O no hydrogen 3.235 N/A ARG 264.A NH2 GLU 289.A OE2 no hydrogen 3.163 N/A ASP 267.A N ASP 270.A OD2 no hydrogen 2.527 N/A TYR 268.A N ASP 267.A OD1 no hydrogen 2.540 N/A THR 269.A OG1 ASP 267.A OD2 no hydrogen 3.439 N/A ASP 270.A N ASP 267.A O no hydrogen 2.929 N/A ASP 271.A N TYR 268.A O no hydrogen 3.422 N/A GLU 273.A N GLU 273.A OE1 no hydrogen 2.617 N/A GLY 274.A N ASP 271.A OD1 no hydrogen 3.285 N/A SER 282.A OG GLY 279.A O no hydrogen 2.311 N/A ARG 285.A N SER 282.A O no hydrogen 2.960 N/A ARG 285.A NH2 PRO 278.A O no hydrogen 3.087 N/A PHE 286.A N SER 282.A O no hydrogen 3.433 N/A VAL 287.A N VAL 283.A O no hydrogen 3.176 N/A ILE 288.A N GLU 284.A O no hydrogen 3.224 N/A GLU 289.A N ARG 285.A O no hydrogen 3.190 N/A GLU 290.A N PHE 286.A O no hydrogen 2.848 N/A ASN 291.A N VAL 287.A O no hydrogen 2.861 N/A LEU 292.A N ILE 288.A O no hydrogen 3.029 N/A HIS 293.A N GLU 289.A O no hydrogen 2.816 N/A HIS 293.A ND1 GLU 332.A OE2 no hydrogen 2.795 N/A CYS 294.A N GLU 290.A O no hydrogen 3.180 N/A CYS 294.A SG TYR 100.A OH no hydrogen 3.117 N/A CYS 294.A SG GLU 290.A O no hydrogen 3.252 N/A ILE 295.A N ASN 291.A O no hydrogen 2.906 N/A ILE 296.A N LEU 292.A O no hydrogen 3.039 N/A LYS 297.A N HIS 293.A O no hydrogen 2.854 N/A SER 298.A N CYS 294.A O no hydrogen 2.730 N/A HIS 299.A N ILE 295.A O no hydrogen 3.227 N/A LYS 304.A NZ GLU 352.A OE1 no hydrogen 2.559 N/A CYS 306.A N GLU 302.A O no hydrogen 2.889 N/A ALA 307.A N ARG 303.A O no hydrogen 2.799 N/A ALA 308.A N LYS 304.A O no hydrogen 3.205 N/A GLN 309.A N THR 305.A O no hydrogen 3.037 N/A LEU 310.A N CYS 306.A O no hydrogen 3.372 N/A VAL 311.A N ALA 307.A O no hydrogen 3.394 N/A SER 312.A N ALA 308.A O no hydrogen 2.818 N/A SER 312.A OG ALA 308.A O no hydrogen 2.865 N/A SER 312.A OG GLN 309.A O no hydrogen 3.116 N/A TYR 313.A OH HIS 222.A NE2 no hydrogen 2.965 N/A TYR 313.A OH ASN 291.A OD1 no hydrogen 3.048 N/A LYS 316.A NZ TYR 313.A O no hydrogen 3.407 N/A ASN 322.A ND2 GLN 357.A OE1 no hydrogen 2.367 N/A TYR 323.A OH ASP 270.A O no hydrogen 2.820 N/A TYR 323.A OH GLN 367.A OE1 no hydrogen 3.070 N/A HIS 324.A N PRO 320.A O no hydrogen 3.493 N/A ILE 325.A N LEU 321.A O no hydrogen 2.845 N/A VAL 326.A N ASN 322.A O no hydrogen 3.171 N/A GLU 327.A N TYR 323.A O no hydrogen 3.133 N/A VAL 328.A N HIS 324.A O no hydrogen 2.998 N/A ILE 329.A N ILE 325.A O no hydrogen 3.197 N/A PHE 330.A N VAL 326.A O no hydrogen 3.163 N/A ALA 331.A N GLU 327.A O no hydrogen 2.865 N/A GLU 332.A N VAL 328.A O no hydrogen 3.131 N/A LEU 333.A N ILE 329.A O no hydrogen 2.960 N/A PHE 334.A N PHE 330.A O no hydrogen 2.984 N/A GLN 335.A N GLU 332.A O no hydrogen 3.318 N/A MET 345.A N ILE 342.A O no hydrogen 3.397 N/A TYR 346.A N ASP 343.A O no hydrogen 3.349 N/A TYR 346.A OH GLU 332.A OE1 no hydrogen 2.690 N/A THR 347.A OG1 VAL 344.A O no hydrogen 2.711 N/A THR 347.A OG1 HIS 393.A ND1 no hydrogen 3.385 N/A THR 348.A N VAL 344.A O no hydrogen 3.291 N/A THR 348.A OG1 VAL 344.A O no hydrogen 3.551 N/A THR 348.A OG1 MET 345.A O no hydrogen 2.817 N/A LEU 349.A N MET 345.A O no hydrogen 2.778 N/A LEU 350.A N TYR 346.A O no hydrogen 3.173 N/A GLU 352.A N THR 348.A O no hydrogen 3.146 N/A LEU 353.A N LEU 349.A O no hydrogen 2.993 N/A CYS 354.A N LEU 350.A O no hydrogen 2.761 N/A LYS 355.A N ILE 351.A O no hydrogen 3.084 N/A LEU 356.A N LEU 353.A O no hydrogen 3.145 N/A GLN 357.A N LEU 353.A O no hydrogen 2.993 N/A SER 360.A OG ASN 322.A OD1 no hydrogen 2.430 N/A LEU 361.A N GLN 357.A O no hydrogen 3.300 N/A VAL 364.A N SER 360.A O no hydrogen 3.133 N/A LEU 365.A N LEU 361.A O no hydrogen 2.941 N/A ALA 366.A N PRO 362.A O no hydrogen 3.160 N/A GLN 367.A N GLN 363.A O no hydrogen 3.069 N/A GLN 367.A NE2 ASP 270.A O no hydrogen 3.575 N/A ALA 368.A N VAL 364.A O no hydrogen 2.658 N/A THR 369.A N LEU 365.A O no hydrogen 2.914 N/A THR 369.A OG1 LEU 365.A O no hydrogen 3.165 N/A GLU 370.A N ALA 366.A O no hydrogen 3.085 N/A MET 371.A N GLN 367.A O no hydrogen 2.993 N/A LEU 372.A N ALA 368.A O no hydrogen 3.017 N/A TYR 373.A N THR 369.A O no hydrogen 3.116 N/A TYR 373.A OH ASP 409.A OD1 no hydrogen 2.752 N/A MET 374.A N GLU 370.A O no hydrogen 3.242 N/A ARG 375.A N LEU 372.A O no hydrogen 3.238 N/A LEU 376.A N TYR 373.A O no hydrogen 3.229 N/A ASN 380.A N VAL 190.A O no hydrogen 2.798 N/A THR 381.A N GLU 708.A OE1 no hydrogen 2.435 N/A THR 381.A OG1 GLU 708.A OE1 no hydrogen 2.588 N/A THR 382.A N ASN 380.A OD1 no hydrogen 3.391 N/A CYS 383.A SG PHE 334.A O no hydrogen 3.404 N/A VAL 384.A N ASN 380.A O no hydrogen 2.974 N/A ASP 385.A N THR 381.A O no hydrogen 2.911 N/A ARG 386.A NH1 LEU 333.A O no hydrogen 3.086 N/A ARG 386.A NH1 GLN 335.A O no hydrogen 2.963 N/A ARG 386.A NH2 LEU 336.A O no hydrogen 3.154 N/A PHE 387.A N CYS 383.A O no hydrogen 2.922 N/A ILE 388.A N VAL 384.A O no hydrogen 2.681 N/A ASN 389.A N ASP 385.A O no hydrogen 2.845 N/A TRP 390.A N ARG 386.A O no hydrogen 2.921 N/A PHE 391.A N PHE 387.A O no hydrogen 2.861 N/A SER 392.A N ILE 388.A O no hydrogen 3.112 N/A SER 392.A OG ILE 388.A O no hydrogen 2.567 N/A SER 392.A OG ASN 389.A O no hydrogen 3.204 N/A HIS 393.A N ASN 389.A O no hydrogen 3.194 N/A HIS 394.A N TRP 390.A O no hydrogen 2.512 N/A LEU 395.A N PHE 391.A O no hydrogen 2.926 N/A SER 396.A N SER 392.A O no hydrogen 3.047 N/A SER 396.A N HIS 393.A O no hydrogen 2.993 N/A PHE 398.A N LEU 395.A O no hydrogen 3.228 N/A PHE 400.A N LEU 395.A O no hydrogen 2.940 N/A ARG 401.A N PHE 398.A O no hydrogen 3.269 N/A ARG 401.A NH1 GLN 399.A OE1 no hydrogen 3.052 N/A ARG 401.A NH2 GLN 399.A OE1 no hydrogen 2.399 N/A ASP 406.A N SER 403.A O no hydrogen 3.411 N/A TRP 407.A N TRP 404.A O no hydrogen 2.980 N/A TRP 407.A NE1 GLU 370.A OE1 no hydrogen 3.102 N/A SER 408.A OG GLU 405.A O no hydrogen 2.319 N/A CYS 410.A SG TRP 407.A O no hydrogen 3.219 N/A SER 417.A N ASP 414.A O no hydrogen 2.843 N/A SER 417.A OG ASP 414.A O no hydrogen 3.311 N/A LYS 419.A NZ ASP 409.A OD2 no hydrogen 3.272 N/A LYS 421.A N SER 417.A O no hydrogen 2.899 N/A LYS 421.A NZ GLU 416.A OE1 no hydrogen 3.481 N/A PHE 422.A N PRO 418.A O no hydrogen 2.685 N/A VAL 423.A N LYS 419.A O no hydrogen 3.081 N/A ARG 424.A N PRO 420.A O no hydrogen 2.838 N/A ARG 424.A NH2 PRO 415.A O no hydrogen 2.418 N/A GLU 425.A N LYS 421.A O no hydrogen 2.850 N/A VAL 426.A N PHE 422.A O no hydrogen 2.928 N/A LEU 427.A N VAL 423.A O no hydrogen 3.226 N/A GLU 428.A N ARG 424.A O no hydrogen 3.280 N/A LYS 429.A N GLU 425.A O no hydrogen 3.042 N/A CYS 430.A N VAL 426.A O no hydrogen 2.952 N/A CYS 430.A SG VAL 426.A O no hydrogen 3.230 N/A MET 431.A N LEU 427.A O no hydrogen 3.060 N/A ARG 432.A N GLU 428.A O no hydrogen 3.370 N/A ARG 432.A N LYS 429.A O no hydrogen 3.149 N/A LEU 433.A N CYS 430.A O no hydrogen 2.831 N/A SER 434.A N MET 431.A O no hydrogen 3.458 N/A GLN 437.A NE2 ASP 441.A OD1 no hydrogen 2.862 N/A ASP 441.A N GLN 437.A O no hydrogen 3.159 N/A ASP 441.A N ARG 438.A O no hydrogen 3.257 N/A ILE 442.A N ARG 438.A O no hydrogen 3.403 N/A VAL 443.A N ILE 439.A O no hydrogen 3.110 N/A PHE 447.A N PRO 444.A O no hydrogen 3.160 N/A SER 448.A N PRO 445.A O no hydrogen 3.059 N/A SER 448.A OG PRO 445.A O no hydrogen 3.318 N/A LEU 450.A N PHE 447.A O no hydrogen 2.862 N/A CYS 451.A N SER 448.A O no hydrogen 3.317 N/A CYS 451.A SG SER 448.A O no hydrogen 3.107 N/A CYS 451.A SG PRO 452.A O no hydrogen 3.989 N/A THR 456.A N ASN 454.A O no hydrogen 2.876 N/A ILE 458.A N VAL 556.A O no hydrogen 2.994 N/A LYS 460.A NZ GLU 508.A OE2 no hydrogen 2.579 N/A GLU 464.A N GLU 464.A OE1 no hydrogen 2.694 N/A SER 465.A OG GLU 464.A OE2 no hydrogen 2.874 N/A SER 468.A N SER 466.A OG no hydrogen 3.306 N/A SER 468.A OG SER 466.A OG no hydrogen 2.626 N/A HIS 472.A N LEU 469.A O no hydrogen 3.277 N/A ALA 475.A N GLY 471.A O no hydrogen 2.764 N/A LEU 476.A N HIS 472.A O no hydrogen 3.280 N/A CYS 477.A SG SER 473.A O no hydrogen 3.292 N/A LEU 478.A N VAL 474.A O no hydrogen 3.115 N/A ALA 479.A N ALA 475.A O no hydrogen 2.990 N/A VAL 480.A N LEU 476.A O no hydrogen 3.202 N/A ALA 481.A N CYS 477.A O no hydrogen 3.170 N/A PHE 482.A N LEU 478.A O no hydrogen 2.833 N/A LYS 483.A N ALA 479.A O no hydrogen 3.229 N/A SER 484.A N VAL 480.A O no hydrogen 3.047 N/A SER 484.A N ALA 481.A O no hydrogen 3.214 N/A SER 484.A OG VAL 480.A O no hydrogen 2.847 N/A SER 484.A OG ALA 481.A O no hydrogen 2.802 N/A LYS 485.A N PHE 482.A O no hydrogen 3.154 N/A ALA 486.A N ALA 481.A O no hydrogen 3.248 N/A THR 487.A OG1 ASP 489.A OD1 no hydrogen 2.247 N/A ILE 491.A N THR 487.A O no hydrogen 3.361 N/A PHE 492.A N ASN 488.A O no hydrogen 3.299 N/A SER 493.A N ASP 489.A O no hydrogen 3.349 N/A SER 493.A OG GLU 490.A O no hydrogen 2.512 N/A ILE 494.A N GLU 490.A O no hydrogen 3.272 N/A LEU 495.A N ILE 491.A O no hydrogen 2.892 N/A LYS 496.A N SER 493.A O no hydrogen 3.199 N/A ASP 497.A N ILE 494.A O no hydrogen 3.480 N/A ASN 503.A ND2 ASN 500.A OD1 no hydrogen 2.402 N/A LYS 506.A N ASN 503.A O no hydrogen 3.256 N/A LYS 506.A N ASN 503.A OD1 no hydrogen 2.788 N/A GLU 508.A N PRO 504.A O no hydrogen 3.286 N/A VAL 509.A N LEU 505.A O no hydrogen 3.235 N/A PHE 510.A N LYS 506.A O no hydrogen 3.221 N/A VAL 511.A N ILE 507.A O no hydrogen 2.768 N/A GLN 512.A N GLU 508.A O no hydrogen 3.104 N/A THR 513.A N VAL 509.A O no hydrogen 3.457 N/A THR 513.A OG1 VAL 509.A O no hydrogen 2.856 N/A THR 513.A OG1 PHE 510.A O no hydrogen 2.926 N/A LEU 514.A N PHE 510.A O no hydrogen 3.061 N/A LEU 515.A N VAL 511.A O no hydrogen 2.935 N/A HIS 516.A N GLN 512.A O no hydrogen 3.180 N/A LEU 517.A N THR 513.A O no hydrogen 3.089 N/A ALA 518.A N LEU 514.A O no hydrogen 3.156 N/A ALA 518.A N LEU 515.A O no hydrogen 3.102 N/A SER 525.A N SER 521.A O no hydrogen 3.406 N/A SER 525.A OG ALA 518.A O no hydrogen 2.700 N/A SER 525.A OG SER 521.A O no hydrogen 3.401 N/A PHE 526.A N PHE 522.A O no hydrogen 3.017 N/A SER 527.A N SER 523.A O no hydrogen 3.197 N/A SER 527.A OG SER 523.A O no hydrogen 3.354 N/A SER 527.A OG HIS 524.A O no hydrogen 2.549 N/A ALA 528.A N HIS 524.A O no hydrogen 3.063 N/A LEU 529.A N SER 525.A O no hydrogen 3.082 N/A ALA 530.A N PHE 526.A O no hydrogen 3.005 N/A LYS 531.A N SER 527.A O no hydrogen 2.675 N/A PHE 532.A N ALA 528.A O no hydrogen 2.860 N/A PHE 536.A N PHE 532.A O no hydrogen 3.204 N/A LYS 537.A N HIS 533.A O no hydrogen 2.987 N/A THR 538.A N GLU 534.A O no hydrogen 2.922 N/A THR 538.A OG1 GLU 534.A O no hydrogen 3.071 N/A LEU 539.A N VAL 535.A O no hydrogen 2.950 N/A ALA 540.A N PHE 536.A O no hydrogen 2.986 N/A SER 542.A OG GLU 544.A OE2 no hydrogen 2.946 N/A GLY 545.A N SER 542.A OG no hydrogen 2.864 N/A LYS 546.A N SER 542.A O no hydrogen 3.108 N/A LYS 546.A NZ ASP 578.A OD2 no hydrogen 3.262 N/A HIS 548.A N GLU 544.A O no hydrogen 3.192 N/A VAL 549.A N GLY 545.A O no hydrogen 3.277 N/A VAL 549.A N LYS 546.A O no hydrogen 3.103 N/A LEU 550.A N LEU 547.A O no hydrogen 3.063 N/A ARG 551.A N LEU 547.A O no hydrogen 3.344 N/A VAL 552.A N HIS 548.A O no hydrogen 3.367 N/A MET 553.A N VAL 549.A O no hydrogen 3.172 N/A PHE 554.A N LEU 550.A O no hydrogen 2.801 N/A GLU 555.A N ARG 551.A O no hydrogen 3.120 N/A VAL 556.A N VAL 552.A O no hydrogen 3.146 N/A TRP 557.A N MET 553.A O no hydrogen 3.278 N/A ARG 558.A NH1 GLU 555.A OE1 no hydrogen 3.220 N/A ARG 558.A NH2 GLU 555.A OE1 no hydrogen 2.939 N/A HIS 560.A N TRP 557.A O no hydrogen 3.331 N/A MET 563.A N HIS 560.A O no hydrogen 2.996 N/A ALA 565.A N PRO 561.A O no hydrogen 3.299 N/A VAL 566.A N GLN 562.A O no hydrogen 3.430 N/A LEU 567.A N MET 563.A O no hydrogen 2.949 N/A VAL 568.A N ILE 564.A O no hydrogen 3.107 N/A LYS 570.A N VAL 566.A O no hydrogen 3.457 N/A MET 571.A N LEU 567.A O no hydrogen 3.402 N/A ILE 572.A N VAL 568.A O no hydrogen 3.167 N/A ARG 573.A N ASP 569.A O no hydrogen 3.388 N/A THR 574.A N LYS 570.A O no hydrogen 2.805 N/A THR 574.A OG1 LYS 570.A O no hydrogen 2.368 N/A THR 574.A OG1 MET 571.A O no hydrogen 3.244 N/A GLN 575.A N ILE 572.A O no hydrogen 3.082 N/A ILE 576.A N MET 571.A O no hydrogen 2.722 N/A CYS 579.A SG GLU 668.A OE1 no hydrogen 3.214 N/A CYS 579.A SG GLU 668.A OE2 no hydrogen 3.346 N/A ALA 581.A N ASP 578.A O no hydrogen 3.145 N/A ALA 581.A N ASP 578.A OD1 no hydrogen 2.521 N/A ALA 583.A N CYS 579.A O no hydrogen 3.390 N/A ASN 584.A N ALA 580.A O no hydrogen 3.292 N/A TRP 585.A N ALA 581.A O no hydrogen 2.975 N/A ILE 586.A N VAL 582.A O no hydrogen 3.150 N/A SER 588.A N TRP 585.A O no hydrogen 3.201 N/A SER 588.A OG TRP 585.A O no hydrogen 2.558 N/A SER 588.A OG GLU 590.A OE1 no hydrogen 3.158 N/A SER 589.A OG GLU 590.A OE1 no hydrogen 3.553 N/A GLU 590.A N GLU 590.A OE1 no hydrogen 2.611 N/A LEU 591.A N SER 588.A O no hydrogen 3.193 N/A SER 592.A N SER 589.A O no hydrogen 3.358 N/A SER 592.A OG SER 589.A O no hydrogen 2.877 N/A PHE 595.A N SER 592.A O no hydrogen 3.382 N/A ARG 597.A N ASP 594.A O no hydrogen 3.184 N/A ARG 597.A NH2 GLU 428.A OE1 no hydrogen 2.846 N/A TRP 601.A N LEU 598.A O no hydrogen 3.294 N/A ILE 603.A N VAL 600.A O no hydrogen 3.066 N/A LEU 604.A N VAL 600.A O no hydrogen 3.336 N/A HIS 605.A N TRP 601.A O no hydrogen 3.224 N/A HIS 605.A ND1 TRP 601.A O no hydrogen 2.400 N/A SER 606.A N GLU 602.A O no hydrogen 3.100 N/A THR 607.A N ILE 603.A O no hydrogen 2.928 N/A THR 607.A OG1 ILE 603.A O no hydrogen 2.779 N/A ILE 608.A N LEU 604.A O no hydrogen 2.856 N/A ARG 609.A N HIS 605.A O no hydrogen 2.938 N/A LYS 610.A N SER 606.A O no hydrogen 3.227 N/A LYS 610.A NZ ASP 569.A OD1 no hydrogen 3.246 N/A LYS 610.A NZ SER 606.A O no hydrogen 2.654 N/A MET 611.A N THR 607.A O no hydrogen 3.351 N/A ASN 612.A N ILE 608.A O no hydrogen 2.918 N/A LYS 613.A N ARG 609.A O no hydrogen 2.720 N/A HIS 614.A N LYS 610.A O no hydrogen 2.861 N/A VAL 615.A N MET 611.A O no hydrogen 3.050 N/A LEU 616.A N ASN 612.A O no hydrogen 3.206 N/A LYS 617.A N LYS 613.A O no hydrogen 3.005 N/A ILE 618.A N HIS 614.A O no hydrogen 3.239 N/A GLN 619.A N VAL 615.A O no hydrogen 3.035 N/A LYS 620.A N LEU 616.A O no hydrogen 3.003 N/A GLU 621.A N LYS 617.A O no hydrogen 3.111 N/A LEU 622.A N ILE 618.A O no hydrogen 2.836 N/A GLU 623.A N GLN 619.A O no hydrogen 2.742 N/A GLU 624.A N LYS 620.A O no hydrogen 3.049 N/A ALA 625.A N GLU 621.A O no hydrogen 3.291 N/A LYS 626.A N LEU 622.A O no hydrogen 2.955 N/A GLU 627.A N GLU 623.A O no hydrogen 2.807 N/A LYS 628.A N GLU 624.A O no hydrogen 3.178 N/A LYS 628.A N ALA 625.A O no hydrogen 3.093 N/A LEU 629.A N LYS 626.A O no hydrogen 3.139 N/A ARG 631.A N GLU 627.A O no hydrogen 2.954 N/A GLN 632.A N LYS 628.A O no hydrogen 2.959 N/A HIS 633.A N LEU 629.A O no hydrogen 3.254 N/A LYS 634.A N ALA 630.A O no hydrogen 2.930 N/A LYS 634.A N ARG 631.A O no hydrogen 3.203 N/A ARG 635.A N ARG 631.A O no hydrogen 3.354 N/A ARG 636.A N GLN 632.A O no hydrogen 2.784 N/A SER 637.A N HIS 633.A O no hydrogen 2.958 N/A ASP 638.A N LYS 634.A O no hydrogen 3.216 N/A ASP 639.A N ARG 635.A O no hydrogen 2.625 N/A SER 643.A N ASP 641.A OD1 no hydrogen 2.900 N/A SER 643.A OG ASP 641.A OD1 no hydrogen 2.497 N/A SER 643.A OG ASP 641.A OD2 no hydrogen 3.049 N/A SER 644.A OG ASP 641.A O no hydrogen 2.628 N/A LYS 647.A NZ ASP 641.A OD2 no hydrogen 3.429 N/A ASP 648.A N SER 644.A O no hydrogen 3.216 N/A GLY 649.A N ASP 645.A O no hydrogen 3.151 N/A VAL 650.A N ARG 646.A O no hydrogen 3.050 N/A LEU 651.A N LYS 647.A O no hydrogen 3.445 N/A GLU 652.A N ASP 648.A O no hydrogen 2.757 N/A GLU 653.A N GLY 649.A O no hydrogen 3.023 N/A GLN 654.A N VAL 650.A O no hydrogen 2.850 N/A ILE 655.A N LEU 651.A O no hydrogen 2.557 N/A GLU 656.A N GLU 652.A O no hydrogen 3.252 N/A LEU 658.A N GLN 654.A O no hydrogen 3.244 N/A GLN 659.A N ILE 655.A O no hydrogen 2.819 N/A GLU 660.A N GLU 656.A O no hydrogen 2.848 N/A LYS 661.A N ARG 657.A O no hydrogen 2.758 N/A VAL 662.A N LEU 658.A O no hydrogen 2.594 N/A GLU 663.A N GLN 659.A O no hydrogen 3.003 N/A SER 664.A N GLU 660.A O no hydrogen 2.827 N/A ALA 665.A N LYS 661.A O no hydrogen 2.659 N/A GLN 666.A N VAL 662.A O no hydrogen 2.700 N/A SER 667.A N GLU 663.A O no hydrogen 2.927 N/A SER 667.A OG GLU 663.A O no hydrogen 2.914 N/A SER 667.A OG SER 664.A O no hydrogen 2.593 N/A GLU 668.A N SER 664.A O no hydrogen 2.896 N/A GLN 669.A N ALA 665.A O no hydrogen 2.714 N/A LYS 670.A N GLN 666.A O no hydrogen 2.748 N/A LYS 670.A NZ THR 727.A OG1 no hydrogen 2.648 N/A ASN 671.A N SER 667.A O no hydrogen 2.951 N/A LEU 672.A N GLU 668.A O no hydrogen 3.164 N/A PHE 673.A N GLN 669.A O no hydrogen 3.383 N/A LEU 674.A N LYS 670.A O no hydrogen 2.936 N/A VAL 675.A N ASN 671.A O no hydrogen 2.719 N/A ILE 676.A N LEU 672.A O no hydrogen 3.128 N/A PHE 677.A N PHE 673.A O no hydrogen 3.050 N/A GLN 678.A N LEU 674.A O no hydrogen 2.997 N/A ARG 679.A N VAL 675.A O no hydrogen 2.807 N/A PHE 680.A N ILE 676.A O no hydrogen 2.583 N/A ILE 681.A N PHE 677.A O no hydrogen 2.854 N/A THR 685.A N ILE 681.A O no hydrogen 3.170 N/A THR 685.A OG1 ILE 681.A O no hydrogen 3.323 N/A THR 685.A OG1 MET 682.A O no hydrogen 2.764 N/A GLU 686.A N MET 682.A O no hydrogen 3.088 N/A HIS 687.A N ILE 683.A O no hydrogen 3.249 N/A LEU 688.A N LEU 684.A O no hydrogen 2.789 N/A VAL 689.A N THR 685.A O no hydrogen 2.897 N/A ARG 690.A N GLU 686.A O no hydrogen 3.166 N/A CYS 691.A N HIS 687.A O no hydrogen 2.954 N/A CYS 691.A SG HIS 687.A O no hydrogen 3.196 N/A CYS 691.A SG THR 696.A OG1 no hydrogen 3.534 N/A GLU 692.A N LEU 688.A O no hydrogen 2.997 N/A THR 693.A N VAL 689.A O no hydrogen 2.996 N/A THR 693.A OG1 VAL 689.A O no hydrogen 2.876 N/A ASP 694.A N ARG 690.A O no hydrogen 2.930 N/A TYR 703.A N THR 700.A OG1 no hydrogen 2.929 N/A LYS 704.A N THR 700.A O no hydrogen 2.900 N/A LYS 704.A NZ MET 379.A O no hydrogen 2.850 N/A LYS 704.A NZ GLU 708.A OE1 no hydrogen 3.471 N/A LYS 704.A NZ GLU 708.A OE2 no hydrogen 2.632 N/A ASN 705.A ND2 THR 596.A O no hydrogen 3.001 N/A CYS 706.A N TRP 702.A O no hydrogen 2.948 N/A ILE 707.A N TYR 703.A O no hydrogen 2.826 N/A GLU 708.A N LYS 704.A O no hydrogen 3.287 N/A ARG 709.A N ASN 705.A O no hydrogen 3.180 N/A ARG 709.A NE ASN 705.A OD1 no hydrogen 3.348 N/A ARG 709.A NH1 ASP 385.A OD2 no hydrogen 2.460 N/A ARG 709.A NH1 GLN 712.A OE1 no hydrogen 2.819 N/A ARG 709.A NH2 ASP 385.A OD1 no hydrogen 3.320 N/A LEU 710.A N CYS 706.A O no hydrogen 3.456 N/A GLN 711.A N ILE 707.A O no hydrogen 3.274 N/A GLN 712.A N GLU 708.A O no hydrogen 2.945 N/A GLN 712.A NE2 GLN 716.A OE1 no hydrogen 2.715 N/A ILE 713.A N ARG 709.A O no hydrogen 3.121 N/A LEU 715.A N GLN 711.A O no hydrogen 3.049 N/A GLN 716.A N GLN 712.A O no hydrogen 3.027 N/A HIS 718.A ND1 LEU 715.A O no hydrogen 3.080 N/A ILE 721.A N HIS 717.A O no hydrogen 3.029 N/A GLN 722.A N HIS 718.A O no hydrogen 3.104 N/A GLN 723.A N ILE 720.A O no hydrogen 3.034 N/A TYR 724.A N ILE 721.A O no hydrogen 2.765 N/A LEU 728.A N TYR 724.A O no hydrogen 2.987 N/A LEU 731.A N THR 727.A O no hydrogen 3.135 N/A LEU 732.A N LEU 728.A O no hydrogen 3.037 N/A PHE 733.A N LEU 728.A O no hydrogen 2.845 N/A THR 734.A OG1 GLU 736.A OE1 no hydrogen 2.929 N/A GLU 736.A N GLU 736.A OE1 no hydrogen 2.612 N/A LEU 737.A N THR 734.A O no hydrogen 3.128 N/A HIS 740.A N ASP 738.A OD1 no hydrogen 2.668 N/A LEU 742.A N ASP 738.A O no hydrogen 2.920 N/A ALA 743.A N PRO 739.A O no hydrogen 2.961 N/A VAL 744.A N ILE 741.A O no hydrogen 3.236 N/A GLN 746.A N LEU 742.A O no hydrogen 2.868 N/A GLN 747.A N ALA 743.A O no hydrogen 3.175 N/A PHE 748.A N VAL 744.A O no hydrogen 3.085 N/A CYS 749.A N PHE 745.A O no hydrogen 3.217 N/A CYS 749.A SG PHE 745.A O no hydrogen 3.234 N/A CYS 749.A SG GLN 746.A O no hydrogen 3.185 N/A LEU 751.A N PHE 748.A O no hydrogen 3.096 N/A ALA 753.A N CYS 749.A O no hydrogen 3.406 N/A