Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bn4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 ASP 54.A OD2 no hydrogen 2.948 N/A ILE 4.A N ASP 54.A O no hydrogen 3.250 N/A ALA 5.A N SER 57.A OG no hydrogen 2.956 N/A VAL 7.A N ASP 3.A O no hydrogen 2.774 N/A VAL 8.A N ILE 4.A O no hydrogen 2.984 N/A THR 9.A N ALA 5.A O no hydrogen 3.352 N/A THR 9.A OG1 ALA 5.A O no hydrogen 3.085 N/A THR 9.A OG1 GLN 6.A O no hydrogen 3.077 N/A GLU 10.A N GLN 6.A O no hydrogen 3.046 N/A ASN 11.A N VAL 7.A O no hydrogen 3.232 N/A ASN 11.A ND2 VAL 7.A O no hydrogen 2.777 N/A ASN 12.A N THR 9.A O no hydrogen 2.871 N/A LYS 13.A N VAL 8.A O no hydrogen 2.973 N/A LYS 13.A NZ VAL 45.A O no hydrogen 3.415 N/A LYS 13.A NZ ASP 291.A OD2 no hydrogen 3.564 N/A ASN 14.A N ASN 44.A O no hydrogen 3.097 N/A TYR 15.A OH SER 66.A OG no hydrogen 2.838 N/A LEU 16.A N ILE 64.A O no hydrogen 3.335 N/A VAL 17.A N MET 46.A O no hydrogen 2.809 N/A LEU 18.A N SER 66.A O no hydrogen 2.632 N/A TYR 19.A N ALA 48.A O no hydrogen 3.148 N/A TYR 19.A OH GLU 27.A OE2 no hydrogen 2.841 N/A TYR 19.A OH ASP 49.A OD1 no hydrogen 3.292 N/A ALA 20.A N PHE 68.A O no hydrogen 2.754 N/A THR 25.A OG1 THR 23.A O no hydrogen 3.523 N/A ALA 26.A N SER 21.A OG no hydrogen 3.316 N/A ASP 28.A N GLY 24.A O no hydrogen 2.458 N/A TYR 29.A N THR 25.A O no hydrogen 3.098 N/A TYR 29.A OH ASP 147.A OD1 no hydrogen 2.695 N/A ALA 30.A N ALA 26.A O no hydrogen 2.745 N/A LYS 31.A N GLU 27.A O no hydrogen 3.169 N/A LYS 31.A N ASP 28.A O no hydrogen 3.096 N/A LYS 32.A N ASP 28.A O no hydrogen 3.104 N/A PHE 33.A N TYR 29.A O no hydrogen 2.891 N/A SER 34.A N ALA 30.A O no hydrogen 2.961 N/A SER 34.A OG ALA 30.A O no hydrogen 2.932 N/A LYS 35.A N LYS 31.A O no hydrogen 2.733 N/A GLU 36.A N LYS 32.A O no hydrogen 3.062 N/A LEU 37.A N SER 34.A O no hydrogen 3.155 N/A VAL 38.A N LYS 35.A O no hydrogen 3.000 N/A LYS 40.A N GLU 36.A O no hydrogen 3.264 N/A LYS 40.A NZ GLU 36.A OE2 no hydrogen 2.982 N/A ASN 42.A ND2 GLN 170.A OE1 no hydrogen 2.484 N/A LEU 43.A N LEU 37.A O no hydrogen 3.418 N/A ASN 44.A N ASN 14.A OD1 no hydrogen 3.180 N/A MET 46.A N TYR 15.A O no hydrogen 2.910 N/A CYS 47.A SG SER 34.A OG no hydrogen 3.559 N/A ALA 48.A N VAL 17.A O no hydrogen 2.854 N/A VAL 50.A N TYR 19.A O no hydrogen 2.921 N/A GLU 51.A N ASP 49.A OD2 no hydrogen 3.160 N/A ASN 52.A N ASP 49.A O no hydrogen 2.924 N/A ASP 54.A N ARG 2.A O no hydrogen 2.613 N/A GLU 56.A N ASP 54.A OD1 no hydrogen 3.318 N/A SER 57.A OG ASP 3.A OD2 no hydrogen 2.609 N/A ASN 59.A ND2 ALA 95.A O no hydrogen 2.600 N/A ASP 60.A N SER 57.A O no hydrogen 3.017 N/A VAL 61.A N LEU 58.A O no hydrogen 2.783 N/A VAL 65.A N ARG 100.A O no hydrogen 2.826 N/A SER 66.A N LEU 16.A O no hydrogen 2.832 N/A SER 66.A OG TYR 15.A OH no hydrogen 2.838 N/A SER 66.A OG ASN 102.A OD1 no hydrogen 3.030 N/A ILE 67.A N ASN 102.A O no hydrogen 3.180 N/A PHE 68.A N LEU 18.A O no hydrogen 2.736 N/A ILE 69.A N PHE 104.A O no hydrogen 3.138 N/A SER 70.A N ALA 20.A O no hydrogen 3.286 N/A TYR 72.A N ASP 76.A O no hydrogen 2.747 N/A GLU 74.A N ASP 76.A OD1 no hydrogen 2.582 N/A GLY 75.A N TYR 72.A O no hydrogen 2.864 N/A ASP 76.A N TYR 72.A O no hydrogen 2.719 N/A ASP 86.A N VAL 82.A O no hydrogen 2.577 N/A PHE 87.A N ASN 83.A O no hydrogen 2.722 N/A ILE 88.A N PHE 84.A O no hydrogen 2.863 N/A CYS 89.A N GLU 85.A O no hydrogen 2.779 N/A ASN 90.A N PHE 87.A O no hydrogen 2.793 N/A ALA 91.A N PHE 87.A O no hydrogen 2.709 N/A ALA 93.A N GLU 92.A OE1 no hydrogen 3.015 N/A ALA 95.A N GLU 92.A O no hydrogen 3.150 N/A LEU 96.A N ALA 128.A O no hydrogen 2.530 N/A ASN 98.A N ASN 59.A OD1 no hydrogen 3.075 N/A ASN 98.A ND2 ASN 59.A OD1 no hydrogen 2.812 N/A LEU 99.A N LEU 96.A O no hydrogen 2.590 N/A ARG 100.A NH2 PRO 62.A O no hydrogen 2.864 N/A TYR 101.A N ILE 131.A O no hydrogen 3.138 N/A ASN 102.A N VAL 65.A O no hydrogen 2.997 N/A ASN 102.A ND2 TYR 15.A OH no hydrogen 2.819 N/A PHE 104.A N ILE 67.A O no hydrogen 2.887 N/A GLY 105.A N GLY 137.A O no hydrogen 2.614 N/A LEU 106.A N ILE 69.A O no hydrogen 2.912 N/A GLY 107.A N ALA 139.A O no hydrogen 2.944 N/A SER 109.A N ASP 140.A OD1 no hydrogen 2.678 N/A SER 109.A OG ASP 140.A OD1 no hydrogen 2.965 N/A SER 109.A OG ASP 140.A OD2 no hydrogen 2.854 N/A THR 110.A N ASN 108.A OD1 no hydrogen 3.013 N/A THR 110.A OG1 ALA 599.A O no hydrogen 3.089 N/A THR 110.A OG1 LYS 600.A O no hydrogen 2.900 N/A TYR 111.A N ASN 108.A O no hydrogen 3.086 N/A ASN 115.A ND2 GLY 105.A O no hydrogen 2.847 N/A ALA 117.A N THR 71.A OG1 no hydrogen 3.205 N/A LYS 119.A N ASN 115.A O no hydrogen 2.879 N/A LYS 119.A NZ PHE 114.A O no hydrogen 3.203 N/A LYS 120.A N GLY 116.A O no hydrogen 2.708 N/A LYS 120.A NZ GLY 75.A O no hydrogen 3.155 N/A LYS 120.A NZ GLU 85.A OE2 no hydrogen 3.454 N/A ALA 121.A N ALA 117.A O no hydrogen 2.826 N/A GLU 122.A N ALA 118.A O no hydrogen 3.104 N/A GLU 122.A N LYS 119.A O no hydrogen 3.311 N/A LYS 123.A N LYS 120.A O no hydrogen 2.703 N/A HIS 124.A N LYS 120.A O no hydrogen 3.026 N/A LEU 125.A N ALA 121.A O no hydrogen 3.121 N/A SER 126.A N GLU 122.A O no hydrogen 3.378 N/A ALA 127.A N LYS 123.A O no hydrogen 3.170 N/A ALA 128.A N HIS 124.A O no hydrogen 2.703 N/A GLY 129.A N SER 126.A O no hydrogen 2.611 N/A ALA 130.A N LEU 125.A O no hydrogen 2.991 N/A ILE 131.A N LEU 99.A O no hydrogen 2.783 N/A ARG 132.A NE GLY 134.A O no hydrogen 2.858 N/A ARG 132.A NH2 GLY 134.A O no hydrogen 3.329 N/A LEU 133.A N TYR 101.A O no hydrogen 2.571 N/A GLY 137.A N MET 103.A O no hydrogen 2.992 N/A ALA 139.A N GLY 105.A O no hydrogen 2.937 N/A ASP 141.A N GLY 107.A O no hydrogen 2.568 N/A GLY 144.A N ASP 141.A O no hydrogen 2.942 N/A THR 145.A N ASP 140.A O no hydrogen 3.342 N/A THR 145.A OG1 ASP 149.A OD2 no hydrogen 2.633 N/A THR 146.A OG1 ASP 141.A OD1 no hydrogen 2.901 N/A ASP 149.A N THR 145.A O no hydrogen 2.641 N/A ASP 149.A N THR 146.A O no hydrogen 2.822 N/A TYR 150.A N THR 146.A O no hydrogen 2.751 N/A MET 151.A N ASP 147.A O no hydrogen 2.865 N/A ALA 152.A N GLU 148.A O no hydrogen 3.451 N/A TRP 153.A N ASP 149.A O no hydrogen 3.116 N/A TRP 153.A NE1 LYS 135.A O no hydrogen 2.958 N/A LYS 154.A N TYR 150.A O no hydrogen 2.711 N/A LYS 154.A NZ GLU 36.A OE2 no hydrogen 3.067 N/A LYS 154.A NZ ASP 155.A OD1 no hydrogen 3.496 N/A ASP 155.A N MET 151.A O no hydrogen 3.001 N/A SER 156.A N ALA 152.A O no hydrogen 3.237 N/A ILE 157.A N TRP 153.A O no hydrogen 2.997 N/A LEU 158.A N LYS 154.A O no hydrogen 2.807 N/A GLU 159.A N ASP 155.A O no hydrogen 3.140 N/A VAL 160.A N SER 156.A O no hydrogen 2.968 N/A LEU 161.A N ILE 157.A O no hydrogen 2.835 N/A LYS 162.A N LEU 158.A O no hydrogen 3.125 N/A LYS 162.A NZ GLU 169.A OE2 no hydrogen 3.546 N/A ASP 163.A N GLU 159.A O no hydrogen 3.300 N/A GLU 164.A N VAL 160.A O no hydrogen 3.036 N/A LEU 165.A N LEU 161.A O no hydrogen 2.922 N/A HIS 166.A N ASP 163.A O no hydrogen 2.536 N/A LEU 167.A N LYS 162.A O no hydrogen 2.919 N/A PHE 174.A N GLN 328.A OE1 no hydrogen 2.701 N/A SER 176.A OG PHE 178.A O no hydrogen 2.832 N/A SER 176.A OG GLU 383.A OE2 no hydrogen 3.224 N/A GLN 177.A N GLU 383.A OE1 no hydrogen 3.212 N/A GLN 177.A N GLU 383.A OE2 no hydrogen 3.384 N/A PHE 178.A N SER 176.A OG no hydrogen 2.771 N/A LEU 183.A N ILE 284.A O no hydrogen 3.267 N/A THR 187.A OG1 GLU 185.A O no hydrogen 3.247 N/A SER 191.A N PRO 301.A O no hydrogen 2.935 N/A SER 191.A OG GLU 194.A O no hydrogen 3.551 N/A SER 191.A OG GLU 194.A OE1 no hydrogen 2.853 N/A SER 191.A OG TYR 311.A OH no hydrogen 2.836 N/A LEU 192.A N GLU 194.A OE1 no hydrogen 2.507 N/A GLY 193.A N SER 191.A OG no hydrogen 3.192 N/A SER 196.A OG HIS 198.A ND1 no hydrogen 2.964 N/A HIS 198.A ND1 SER 196.A OG no hydrogen 2.964 N/A SER 202.A N ASP 188.A O no hydrogen 3.340 N/A SER 202.A OG ASP 188.A O no hydrogen 3.288 N/A HIS 203.A N LEU 200.A O no hydrogen 2.625 N/A ASP 208.A N ARG 205.A O no hydrogen 2.662 N/A ASP 216.A N GLN 219.A O no hydrogen 2.485 N/A SER 218.A N ASP 216.A OD2 no hydrogen 2.859 N/A SER 218.A OG ASP 216.A OD2 no hydrogen 2.517 N/A GLN 219.A N ASP 216.A OD2 no hydrogen 3.370 N/A TYR 221.A N VAL 471.A O no hydrogen 2.624 N/A ALA 223.A N LEU 469.A O no hydrogen 3.068 N/A ILE 225.A N TYR 467.A O no hydrogen 2.807 N/A VAL 226.A N GLU 243.A O no hydrogen 2.766 N/A SER 228.A OG GLN 438.A O no hydrogen 3.378 N/A SER 228.A OG GLN 441.A OE1 no hydrogen 2.798 N/A SER 228.A OG ASN 442.A OD1 no hydrogen 3.005 N/A ARG 229.A N HIS 241.A O no hydrogen 3.214 N/A ARG 229.A NH2 GLU 543.A OE2 no hydrogen 3.257 N/A PHE 232.A N GLU 230.A OE1 no hydrogen 2.672 N/A SER 233.A N ASP 536.A O no hydrogen 2.645 N/A SER 234.A OG ASP 236.A OD1 no hydrogen 3.565 N/A CYS 239.A N GLU 230.A OE2 no hydrogen 3.010 N/A ILE 240.A N SER 410.A O no hydrogen 3.248 N/A HIS 241.A N ARG 229.A O no hydrogen 3.155 N/A SER 242.A N VAL 408.A O no hydrogen 2.909 N/A GLU 243.A N LYS 227.A O no hydrogen 2.875 N/A PHE 244.A N VAL 406.A O no hydrogen 2.738 N/A ASP 245.A N PRO 224.A O no hydrogen 2.922 N/A LEU 246.A N GLN 404.A O no hydrogen 3.092 N/A SER 247.A N ASP 245.A OD1 no hydrogen 3.008 N/A SER 247.A OG ASP 245.A OD1 no hydrogen 2.827 N/A SER 249.A N LEU 246.A O no hydrogen 2.987 N/A SER 249.A OG LEU 246.A O no hydrogen 2.744 N/A ASN 250.A N GLN 211.A O no hydrogen 3.145 N/A ASN 250.A N ASN 250.A OD1 no hydrogen 2.457 N/A TYR 253.A OH SER 398.A O no hydrogen 2.900 N/A TYR 253.A OH GLU 402.A O no hydrogen 2.859 N/A TYR 253.A OH THR 405.A O no hydrogen 2.730 N/A SER 254.A N ASP 257.A OD2 no hydrogen 2.475 N/A THR 255.A OG1 SER 399.A OG no hydrogen 3.372 N/A THR 255.A OG1 GLU 506.A OE1 no hydrogen 2.716 N/A ASP 257.A N SER 254.A O no hydrogen 3.382 N/A HIS 258.A N ARG 474.A O no hydrogen 3.187 N/A HIS 258.A NE2 ASP 641.A OD2 no hydrogen 3.008 N/A LEU 259.A N TYR 393.A O no hydrogen 2.736 N/A ALA 260.A N HIS 472.A O no hydrogen 2.959 N/A VAL 261.A N ARG 391.A O no hydrogen 2.966 N/A TRP 262.A N PRO 470.A O no hydrogen 2.973 N/A LEU 267.A N HIS 454.A O no hydrogen 2.929 N/A GLU 268.A N GLU 268.A OE2 no hydrogen 2.417 N/A VAL 270.A N PRO 266.A O no hydrogen 3.144 N/A GLU 271.A N LEU 267.A O no hydrogen 3.180 N/A GLN 272.A N GLU 268.A O no hydrogen 3.238 N/A GLN 272.A NE2 GLU 268.A O no hydrogen 2.753 N/A PHE 273.A N LYS 269.A O no hydrogen 3.038 N/A LEU 274.A N VAL 270.A O no hydrogen 3.141 N/A SER 275.A N GLU 271.A O no hydrogen 2.925 N/A SER 275.A OG GLU 271.A O no hydrogen 2.826 N/A ILE 276.A N GLN 272.A O no hydrogen 3.479 N/A ASN 278.A N SER 275.A O no hydrogen 2.445 N/A LEU 279.A N LEU 274.A O no hydrogen 2.891 N/A THR 283.A N ASP 280.A O no hydrogen 2.911 N/A THR 283.A OG1 ASP 280.A O no hydrogen 2.509 N/A THR 283.A OG1 ASP 280.A OD2 no hydrogen 3.280 N/A PHE 285.A N THR 302.A O no hydrogen 2.699 N/A LEU 290.A N GLN 177.A O no hydrogen 3.043 N/A VAL 294.A N ASP 291.A O no hydrogen 3.113 N/A THR 302.A N PHE 285.A O no hydrogen 2.848 N/A THR 302.A OG1 SER 191.A O no hydrogen 3.192 N/A THR 302.A OG1 THR 303.A O no hydrogen 2.923 N/A ILE 304.A N THR 283.A O no hydrogen 3.071 N/A GLY 305.A N PRO 281.A O no hydrogen 2.626 N/A ALA 306.A N THR 303.A OG1 no hydrogen 3.272 N/A ALA 307.A N THR 303.A O no hydrogen 3.467 N/A ILE 308.A N ILE 304.A O no hydrogen 3.197 N/A ILE 308.A N GLY 305.A O no hydrogen 3.223 N/A LYS 309.A N GLY 305.A O no hydrogen 3.005 N/A LYS 309.A NZ ASP 456.A OD2 no hydrogen 3.057 N/A HIS 310.A N ALA 306.A O no hydrogen 2.637 N/A TYR 311.A N ALA 307.A O no hydrogen 3.163 N/A TYR 311.A OH GLU 194.A O no hydrogen 3.016 N/A GLU 313.A N PRO 386.A O no hydrogen 2.723 N/A THR 315.A OG1 ASN 359.A OD1 no hydrogen 3.373 N/A GLY 316.A N ASN 359.A OD1 no hydrogen 2.628 N/A SER 319.A OG ASP 147.A OD1 no hydrogen 2.929 N/A ARG 320.A N ASP 147.A OD2 no hydrogen 2.931 N/A ARG 320.A NE SER 343.A O no hydrogen 3.072 N/A ARG 320.A NH2 SER 343.A O no hydrogen 3.543 N/A GLN 321.A N SER 319.A OG no hydrogen 3.119 N/A LEU 322.A N SER 319.A O no hydrogen 2.746 N/A PHE 323.A N ARG 320.A O no hydrogen 3.240 N/A SER 324.A N ARG 320.A O no hydrogen 3.322 N/A SER 325.A N GLN 321.A O no hydrogen 3.066 N/A SER 325.A OG GLN 321.A O no hydrogen 2.834 N/A LEU 326.A N PHE 323.A O no hydrogen 2.912 N/A GLN 328.A NE2 SER 325.A O no hydrogen 3.344 N/A PHE 329.A N LEU 326.A O no hydrogen 2.513 N/A ALA 330.A N ILE 327.A O no hydrogen 3.012 N/A VAL 335.A N ASN 332.A O no hydrogen 2.565 N/A LYS 336.A N ASN 332.A O no hydrogen 3.158 N/A GLU 337.A N ALA 333.A O no hydrogen 3.356 N/A LYS 338.A N ASP 334.A O no hydrogen 3.354 N/A LEU 339.A N VAL 335.A O no hydrogen 2.781 N/A THR 340.A N LYS 336.A O no hydrogen 3.337 N/A THR 340.A OG1 LYS 336.A O no hydrogen 2.722 N/A LEU 341.A N GLU 337.A O no hydrogen 3.181 N/A LEU 342.A N LYS 338.A O no hydrogen 2.940 N/A SER 343.A N LEU 339.A O no hydrogen 2.861 N/A SER 343.A OG LEU 339.A O no hydrogen 3.442 N/A SER 343.A OG THR 340.A O no hydrogen 2.800 N/A LYS 344.A N LEU 341.A O no hydrogen 3.042 N/A ASP 345.A N LEU 342.A O no hydrogen 2.950 N/A PHE 349.A N ASP 345.A O no hydrogen 3.032 N/A ALA 350.A N LYS 346.A O no hydrogen 3.316 N/A VAL 351.A N ASP 347.A O no hydrogen 2.890 N/A GLU 352.A N GLN 348.A O no hydrogen 2.798 N/A ILE 353.A N PHE 349.A O no hydrogen 2.777 N/A ILE 353.A N ALA 350.A O no hydrogen 3.328 N/A THR 354.A N PHE 349.A O no hydrogen 3.129 N/A SER 355.A N ALA 350.A O no hydrogen 2.793 N/A SER 355.A OG ALA 350.A O no hydrogen 2.988 N/A TYR 357.A N THR 354.A O no hydrogen 2.945 N/A PHE 358.A N ILE 353.A O no hydrogen 3.420 N/A ASN 359.A N ASP 362.A OD2 no hydrogen 3.089 N/A ASN 359.A ND2 ASP 362.A OD2 no hydrogen 3.090 N/A ALA 363.A N ASN 359.A O no hydrogen 2.724 N/A LEU 364.A N ILE 360.A O no hydrogen 3.039 N/A LYS 365.A N ALA 361.A O no hydrogen 2.922 N/A TYR 366.A N ASP 362.A O no hydrogen 3.097 N/A TYR 366.A OH GLU 352.A OE1 no hydrogen 3.095 N/A LEU 367.A N ALA 363.A O no hydrogen 3.233 N/A SER 368.A N LEU 364.A O no hydrogen 3.270 N/A SER 368.A OG LEU 364.A O no hydrogen 2.873 N/A ASP 369.A N TYR 366.A O no hydrogen 3.289 N/A GLY 370.A N LYS 365.A O no hydrogen 3.237 N/A ALA 371.A N SER 368.A O no hydrogen 2.724 N/A TRP 373.A N ILE 276.A O no hydrogen 2.880 N/A VAL 376.A N TRP 373.A O no hydrogen 3.424 N/A VAL 382.A N MET 378.A O no hydrogen 2.831 N/A GLU 383.A N PHE 380.A O no hydrogen 2.843 N/A SER 384.A N PHE 380.A O no hydrogen 2.656 N/A SER 384.A N LEU 381.A O no hydrogen 3.018 N/A SER 384.A OG PHE 380.A O no hydrogen 2.493 N/A VAL 385.A N LEU 381.A O no hydrogen 2.864 N/A MET 388.A N TYR 311.A O no hydrogen 3.195 N/A ARG 391.A N VAL 261.A O no hydrogen 3.163 N/A ARG 391.A NH1 GLU 313.A OE2 no hydrogen 2.777 N/A ARG 391.A NH1 THR 389.A O no hydrogen 2.516 N/A ARG 391.A NH2 GLU 313.A OE2 no hydrogen 2.765 N/A TYR 393.A N LEU 259.A O no hydrogen 2.909 N/A ILE 395.A N ASP 257.A O no hydrogen 3.130 N/A SER 396.A N HIS 407.A O no hydrogen 3.101 N/A SER 397.A OG TYR 253.A OH no hydrogen 3.304 N/A SER 398.A N GLU 402.A OE1 no hydrogen 3.098 N/A SER 398.A OG GLU 506.A OE1 no hydrogen 2.800 N/A SER 399.A N THR 255.A OG1 no hydrogen 2.936 N/A SER 399.A OG THR 255.A OG1 no hydrogen 3.372 N/A LEU 400.A N GLU 506.A OE1 no hydrogen 3.344 N/A SER 401.A N SER 398.A OG no hydrogen 3.302 N/A SER 401.A OG GLU 402.A OE2 no hydrogen 2.512 N/A GLU 402.A N SER 399.A O no hydrogen 3.236 N/A THR 405.A N GLU 402.A O no hydrogen 2.953 N/A VAL 406.A N PHE 244.A O no hydrogen 3.105 N/A HIS 407.A N SER 397.A OG no hydrogen 2.694 N/A VAL 408.A N SER 242.A O no hydrogen 2.813 N/A SER 410.A N ILE 240.A O no hydrogen 2.751 N/A VAL 412.A N ASN 238.A O no hydrogen 2.740 N/A GLU 413.A N THR 431.A OG1 no hydrogen 3.197 N/A PHE 415.A N VAL 426.A O no hydrogen 3.211 N/A ASN 417.A ND2 LYS 356.A O no hydrogen 3.183 N/A GLU 419.A N ASN 417.A OD1 no hydrogen 3.181 N/A LEU 420.A N ASN 417.A OD1 no hydrogen 3.041 N/A ALA 423.A N LEU 420.A O no hydrogen 2.743 N/A VAL 426.A N PHE 415.A O no hydrogen 2.738 N/A GLY 428.A N GLU 413.A O no hydrogen 3.258 N/A ASN 432.A ND2 GLU 413.A O no hydrogen 3.346 N/A ASN 432.A ND2 GLY 428.A O no hydrogen 2.807 N/A LEU 433.A N VAL 429.A O no hydrogen 3.076 N/A LEU 434.A N THR 430.A O no hydrogen 3.104 N/A ARG 435.A N THR 431.A O no hydrogen 3.133 N/A ARG 435.A NH1 ASN 450.A OD1 no hydrogen 3.022 N/A ARG 435.A NH2 ASN 450.A OD1 no hydrogen 2.951 N/A ASN 436.A N ASN 432.A O no hydrogen 2.708 N/A ILE 437.A N LEU 433.A O no hydrogen 3.165 N/A GLN 438.A N LEU 434.A O no hydrogen 2.723 N/A LEU 439.A N ARG 435.A O no hydrogen 2.671 N/A ALA 440.A N ASN 436.A O no hydrogen 2.841 N/A GLN 441.A N ILE 437.A O no hydrogen 2.534 N/A ASN 442.A N GLN 438.A O no hydrogen 3.034 N/A ASN 442.A ND2 SER 228.A O no hydrogen 3.408 N/A VAL 444.A N LEU 439.A O no hydrogen 3.063 N/A ASN 445.A ND2 GLU 448.A OE1 no hydrogen 3.370 N/A GLU 448.A N ASN 445.A O no hydrogen 2.640 N/A THR 449.A N ASN 445.A O no hydrogen 3.352 N/A THR 449.A N ILE 446.A O no hydrogen 2.723 N/A THR 449.A OG1 ILE 446.A O no hydrogen 2.301 N/A ASN 450.A ND2 ASP 236.A O no hydrogen 3.631 N/A HIS 454.A N GLU 268.A OE2 no hydrogen 2.970 N/A TYR 455.A OH VAL 429.A O no hydrogen 2.715 N/A GLY 459.A N ASP 456.A OD1 no hydrogen 2.632 N/A PHE 464.A N ASN 458.A O no hydrogen 2.741 N/A ALA 465.A N LYS 462.A O no hydrogen 3.416 N/A LYS 468.A N PHE 464.A O no hydrogen 2.851 N/A LEU 469.A N ALA 223.A O no hydrogen 3.051 N/A VAL 471.A N TYR 221.A O no hydrogen 3.082 N/A HIS 472.A N ALA 260.A O no hydrogen 3.278 N/A ARG 474.A N HIS 258.A O no hydrogen 3.090 N/A ARG 474.A NH1 HIS 258.A ND1 no hydrogen 3.460 N/A ARG 475.A NH1 SER 254.A OG no hydrogen 2.938 N/A ARG 475.A NH2 SER 254.A OG no hydrogen 2.977 N/A SER 476.A N ASP 257.A OD1 no hydrogen 2.762 N/A SER 476.A OG GLY 256.A O no hydrogen 2.778 N/A ARG 479.A N GLN 639.A OE1 no hydrogen 3.125 N/A ARG 479.A NH1 PHE 478.A O no hydrogen 2.922 N/A ARG 479.A NH2 ASP 257.A OD1 no hydrogen 2.886 N/A SER 485.A OG ASN 483.A OD1 no hydrogen 2.943 N/A THR 486.A N ASN 483.A O no hydrogen 2.893 N/A THR 486.A OG1 ASN 483.A O no hydrogen 3.158 N/A VAL 488.A N LYS 525.A O no hydrogen 2.848 N/A ILE 489.A N PHE 592.A O no hydrogen 2.750 N/A MET 490.A N ILE 527.A O no hydrogen 2.737 N/A ILE 491.A N TYR 594.A O no hydrogen 2.676 N/A GLY 492.A N PHE 529.A O no hydrogen 3.203 N/A GLY 494.A N GLY 531.A O no hydrogen 2.510 N/A GLY 496.A N PRO 493.A O no hydrogen 3.022 N/A VAL 497.A N GLY 494.A O no hydrogen 2.677 N/A ALA 498.A N THR 495.A O no hydrogen 3.197 N/A PHE 500.A N VAL 497.A O no hydrogen 2.755 N/A ARG 501.A N VAL 497.A O no hydrogen 3.024 N/A ARG 501.A N ALA 498.A O no hydrogen 3.023 N/A ARG 501.A NE GLU 543.A OE1 no hydrogen 2.727 N/A ARG 501.A NE GLU 543.A OE2 no hydrogen 3.502 N/A ARG 501.A NH1 SER 396.A O no hydrogen 3.071 N/A ARG 501.A NH2 GLU 543.A OE2 no hydrogen 3.337 N/A GLY 502.A N ALA 498.A O no hydrogen 3.363 N/A PHE 503.A N PRO 499.A O no hydrogen 3.058 N/A ILE 504.A N PHE 500.A O no hydrogen 2.936 N/A ARG 505.A N ARG 501.A O no hydrogen 2.839 N/A GLU 506.A N GLY 502.A O no hydrogen 2.528 N/A ARG 507.A N PHE 503.A O no hydrogen 2.763 N/A ARG 507.A NH2 PRO 481.A O no hydrogen 3.536 N/A VAL 508.A N ARG 505.A O no hydrogen 2.927 N/A ALA 509.A N ARG 505.A O no hydrogen 2.806 N/A PHE 510.A N GLU 506.A O no hydrogen 3.231 N/A GLU 512.A N VAL 508.A O no hydrogen 2.967 N/A SER 513.A N ALA 509.A O no hydrogen 3.354 N/A SER 513.A OG ALA 509.A O no hydrogen 3.161 N/A GLN 514.A N PHE 510.A O no hydrogen 2.965 N/A LYS 515.A N LEU 511.A O no hydrogen 3.131 N/A LYS 515.A N GLU 512.A O no hydrogen 2.933 N/A LYS 516.A N GLU 512.A O no hydrogen 2.975 N/A GLY 524.A N PRO 484.A O no hydrogen 3.229 N/A LYS 525.A NZ GLU 556.A OE2 no hydrogen 2.717 N/A HIS 526.A N SER 554.A O no hydrogen 2.692 N/A ILE 527.A N VAL 488.A O no hydrogen 2.673 N/A LEU 528.A N GLU 556.A O no hydrogen 2.975 N/A PHE 529.A N MET 490.A O no hydrogen 2.702 N/A TYR 530.A N VAL 558.A O no hydrogen 2.900 N/A TYR 530.A OH ASP 537.A O no hydrogen 3.194 N/A SER 532.A N ALA 560.A O no hydrogen 3.084 N/A SER 532.A OG ASN 534.A O no hydrogen 3.141 N/A SER 532.A OG ASP 537.A OD1 no hydrogen 3.028 N/A ARG 533.A N ASP 537.A OD2 no hydrogen 2.722 N/A ASN 534.A N ASP 537.A OD1 no hydrogen 2.753 N/A ASN 534.A ND2 ASP 537.A OD1 no hydrogen 2.705 N/A THR 535.A OG1 ASP 536.A OD2 no hydrogen 3.284 N/A LEU 539.A N TYR 530.A OH no hydrogen 3.014 N/A TYR 540.A OH HIS 241.A ND1 no hydrogen 3.150 N/A GLU 543.A N TYR 540.A O no hydrogen 2.663 N/A TRP 544.A NE1 LEU 539.A O no hydrogen 3.091 N/A GLU 546.A N GLU 543.A O no hydrogen 2.935 N/A TYR 547.A N GLU 543.A O no hydrogen 3.266 N/A TYR 547.A OH GLU 543.A OE1 no hydrogen 2.563 N/A ALA 548.A N TRP 544.A O no hydrogen 2.709 N/A LYS 549.A N PRO 545.A O no hydrogen 3.403 N/A LYS 549.A N GLU 546.A O no hydrogen 3.162 N/A LYS 550.A N GLU 546.A O no hydrogen 3.373 N/A LEU 551.A N TYR 547.A O no hydrogen 2.925 N/A ASP 552.A N LYS 549.A O no hydrogen 2.795 N/A SER 554.A N LEU 551.A O no hydrogen 3.414 N/A SER 554.A OG LEU 523.A O no hydrogen 3.369 N/A SER 554.A OG LEU 551.A O no hydrogen 3.385 N/A VAL 558.A N LEU 528.A O no hydrogen 2.902 N/A HIS 561.A ND1 SER 532.A O no hydrogen 3.003 N/A SER 562.A N SER 532.A O no hydrogen 3.184 N/A ARG 563.A N SER 562.A OG no hydrogen 2.665 N/A LEU 564.A N SER 562.A O no hydrogen 2.707 N/A THR 567.A N LEU 564.A O no hydrogen 2.833 N/A THR 567.A OG1 PRO 565.A O no hydrogen 3.525 N/A LYS 568.A NZ LYS 569.A O no hydrogen 2.774 N/A TYR 571.A N ASP 574.A OD2 no hydrogen 2.716 N/A ASP 574.A N TYR 571.A O no hydrogen 2.921 N/A LYS 575.A N TYR 571.A O no hydrogen 3.287 N/A LYS 575.A NZ ASP 578.A OD2 no hydrogen 3.024 N/A ASP 578.A N ASP 574.A O no hydrogen 3.004 N/A TYR 579.A N LYS 575.A O no hydrogen 2.779 N/A GLU 580.A N LYS 577.A O no hydrogen 3.422 N/A GLN 582.A NE2 GLU 556.A OE2 no hydrogen 3.324 N/A VAL 583.A N TYR 579.A O no hydrogen 2.914 N/A PHE 584.A N GLU 580.A O no hydrogen 2.514 N/A GLU 585.A N ASP 581.A O no hydrogen 2.863 N/A MET 586.A N GLN 582.A O no hydrogen 2.952 N/A ILE 587.A N VAL 583.A O no hydrogen 2.925 N/A ASN 588.A N PHE 584.A O no hydrogen 3.051 N/A ASN 589.A N MET 586.A O no hydrogen 3.122 N/A ASN 589.A ND2 GLU 585.A O no hydrogen 3.204 N/A GLY 590.A N ILE 587.A O no hydrogen 2.763 N/A ALA 591.A N MET 586.A O no hydrogen 2.921 N/A PHE 592.A N PRO 487.A O no hydrogen 2.817 N/A ILE 593.A N ARG 637.A O no hydrogen 2.765 N/A TYR 594.A N ILE 489.A O no hydrogen 2.818 N/A TYR 594.A OH ARG 479.A O no hydrogen 2.624 N/A VAL 595.A N GLN 639.A O no hydrogen 3.023 N/A CYS 596.A N ILE 491.A O no hydrogen 2.861 N/A CYS 596.A SG GLY 496.A O no hydrogen 3.569 N/A CYS 596.A SG ASP 641.A O no hydrogen 2.948 N/A GLY 597.A N ASP 641.A O no hydrogen 3.215 N/A ALA 599.A N TRP 643.A O no hydrogen 2.851 N/A LYS 604.A NZ TYR 111.A O no hydrogen 3.248 N/A GLY 605.A N GLY 601.A O no hydrogen 3.222 N/A VAL 606.A N MET 602.A O no hydrogen 3.162 N/A SER 607.A N ALA 603.A O no hydrogen 2.856 N/A THR 608.A N LYS 604.A O no hydrogen 2.626 N/A THR 608.A OG1 LYS 604.A O no hydrogen 3.163 N/A ALA 609.A N GLY 605.A O no hydrogen 2.675 N/A LEU 610.A N VAL 606.A O no hydrogen 2.907 N/A VAL 611.A N SER 607.A O no hydrogen 2.908 N/A GLY 612.A N THR 608.A O no hydrogen 2.813 N/A ILE 613.A N ALA 609.A O no hydrogen 2.917 N/A LEU 614.A N LEU 610.A O no hydrogen 3.012 N/A SER 615.A N VAL 611.A O no hydrogen 2.797 N/A SER 615.A OG ILE 620.A O no hydrogen 2.467 N/A ARG 616.A N GLY 612.A O no hydrogen 2.947 N/A ARG 616.A NE GLY 612.A O no hydrogen 3.007 N/A GLY 617.A N ILE 613.A O no hydrogen 3.027 N/A LYS 618.A N LEU 614.A O no hydrogen 2.748 N/A SER 619.A N ARG 616.A O no hydrogen 2.980 N/A ILE 620.A N SER 615.A O no hydrogen 2.844 N/A GLU 624.A N THR 621.A OG1 no hydrogen 2.963 N/A ALA 625.A N THR 621.A O no hydrogen 3.078 N/A THR 626.A N THR 622.A O no hydrogen 3.082 N/A THR 626.A OG1 THR 622.A O no hydrogen 2.684 N/A GLU 627.A N ASP 623.A O no hydrogen 2.999 N/A LEU 628.A N GLU 624.A O no hydrogen 3.036 N/A ILE 629.A N ALA 625.A O no hydrogen 2.911 N/A LYS 630.A N THR 626.A O no hydrogen 2.970 N/A LYS 630.A NZ GLU 112.A OE2 no hydrogen 3.541 N/A MET 631.A N GLU 627.A O no hydrogen 2.812 N/A LEU 632.A N LEU 628.A O no hydrogen 3.291 N/A LYS 633.A N ILE 629.A O no hydrogen 2.925 N/A THR 634.A N LYS 630.A O no hydrogen 2.941 N/A SER 635.A N MET 631.A O no hydrogen 2.859 N/A SER 635.A OG LEU 632.A O no hydrogen 2.983 N/A GLY 636.A N LEU 632.A O no hydrogen 2.757 N/A ARG 637.A N LEU 632.A O no hydrogen 3.048 N/A ARG 637.A N SER 635.A OG no hydrogen 3.264 N/A ARG 637.A NE ALA 591.A O no hydrogen 2.900 N/A ARG 637.A NH2 ILE 587.A O no hydrogen 2.811 N/A ARG 637.A NH2 ALA 591.A O no hydrogen 2.925 N/A GLN 639.A N ILE 593.A O no hydrogen 2.766 N/A GLN 639.A NE2 ARG 479.A O no hydrogen 3.378 N/A GLN 639.A NE2 GLY 636.A O no hydrogen 3.187 N/A ASP 641.A N VAL 595.A O no hydrogen 2.875 N/A TRP 643.A N GLY 597.A O no hydrogen 2.845 N/A