Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pix_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH ASP 297.A OD1 no hydrogen 2.703 N/A TYR 8.A N MET 5.A O no hydrogen 2.896 N/A PHE 9.A N MET 5.A O no hydrogen 3.072 N/A GLN 10.A N PRO 6.A O no hydrogen 2.836 N/A MET 12.A N GLU 334.A OE1 no hydrogen 2.676 N/A GLN 14.A NE2 ASN 332.A O no hydrogen 2.854 N/A VAL 15.A N SER 333.A O no hydrogen 2.980 N/A LYS 17.A N ASN 324.A OD1 no hydrogen 2.905 N/A ASP 23.A N SER 310.A OG no hydrogen 3.049 N/A ASN 26.A N ASP 23.A OD2 no hydrogen 3.062 N/A ASN 26.A ND2 TYR 309.A O no hydrogen 2.804 N/A ASN 26.A ND2 VAL 312.A O no hydrogen 2.812 N/A GLU 27.A N ASP 23.A O no hydrogen 2.998 N/A GLU 28.A N ALA 24.A O no hydrogen 3.023 N/A GLN 29.A N ALA 25.A O no hydrogen 3.037 N/A GLN 29.A NE2 ALA 25.A O no hydrogen 3.240 N/A LEU 30.A N ASN 26.A O no hydrogen 2.874 N/A LYS 31.A N GLU 27.A O no hydrogen 2.869 N/A LYS 31.A NZ GLU 27.A OE1 no hydrogen 2.720 N/A LYS 32.A N GLU 28.A O no hydrogen 2.944 N/A ILE 33.A N GLN 29.A O no hydrogen 3.327 N/A GLU 34.A N LEU 30.A O no hydrogen 2.916 N/A GLU 35.A N LYS 31.A O no hydrogen 2.738 N/A GLU 36.A N LYS 32.A O no hydrogen 3.044 N/A ILE 37.A N ILE 33.A O no hydrogen 3.105 N/A HIS 38.A N GLU 34.A O no hydrogen 2.917 N/A HIS 38.A NE2 ASP 543.A OD2 no hydrogen 2.659 N/A GLN 39.A N GLU 35.A O no hydrogen 2.948 N/A LEU 40.A N GLU 36.A O no hydrogen 2.917 N/A ILE 41.A N ILE 37.A O no hydrogen 2.869 N/A LYS 42.A N HIS 38.A O no hydrogen 2.812 N/A GLU 43.A N GLN 39.A O no hydrogen 3.099 N/A ALA 44.A N LEU 40.A O no hydrogen 3.032 N/A GLN 45.A N ILE 41.A O no hydrogen 2.853 N/A GLU 46.A N LYS 42.A O no hydrogen 3.028 N/A ALA 47.A N GLU 43.A O no hydrogen 3.108 N/A LYS 49.A N LYS 114.A O no hydrogen 2.713 N/A VAL 54.A N ALA 50.A O no hydrogen 2.990 N/A ASN 55.A N ASP 51.A O no hydrogen 2.698 N/A ASN 55.A ND2 GLN 64.A OE1 no hydrogen 3.058 N/A LYS 56.A N ALA 52.A O no hydrogen 2.852 N/A GLY 58.A N ASN 55.A O no hydrogen 2.693 N/A LEU 60.A N GLU 271.A OE1 no hydrogen 3.088 N/A GLN 64.A N THR 61.A OG1 no hydrogen 3.224 N/A GLN 64.A NE2 ASN 55.A OD1 no hydrogen 2.790 N/A ARG 65.A N THR 61.A O no hydrogen 2.885 N/A ARG 65.A NE GLU 271.A OE1 no hydrogen 2.869 N/A ARG 65.A NH1 ASN 147.A OD1 no hydrogen 3.128 N/A ARG 65.A NH2 GLU 59.A OE1 no hydrogen 3.314 N/A ARG 65.A NH2 ASN 147.A OD1 no hydrogen 3.376 N/A ARG 65.A NH2 GLU 271.A OE1 no hydrogen 3.119 N/A ARG 65.A NH2 GLU 271.A OE2 no hydrogen 3.237 N/A ILE 66.A N ALA 62.A O no hydrogen 2.945 N/A GLU 67.A N LEU 63.A O no hydrogen 2.982 N/A LYS 68.A N GLN 64.A O no hydrogen 3.229 N/A LYS 68.A N ARG 65.A O no hydrogen 3.048 N/A LYS 68.A NZ GLU 272.A OE1 no hydrogen 2.793 N/A LEU 69.A N ILE 66.A O no hydrogen 2.989 N/A VAL 70.A N ILE 66.A O no hydrogen 2.985 N/A GLU 71.A N ARG 100.A O no hydrogen 2.794 N/A SER 74.A N GLU 71.A O no hydrogen 2.989 N/A SER 74.A OG GLU 71.A O no hydrogen 2.735 N/A ARG 76.A N LEU 98.A O no hydrogen 2.769 N/A ARG 76.A NE TRP 75.A O no hydrogen 2.747 N/A ARG 76.A NH2 GLY 73.A O no hydrogen 2.463 N/A ARG 76.A NH2 TRP 75.A O no hydrogen 2.974 N/A LEU 78.A N LYS 96.A O no hydrogen 3.052 N/A ASN 79.A N ASP 539.A O no hydrogen 2.635 N/A ASN 79.A ND2 ASP 539.A O no hydrogen 3.054 N/A ASN 79.A ND2 ASP 539.A OD1 no hydrogen 2.918 N/A THR 80.A N GLU 540.A OE2 no hydrogen 2.537 N/A THR 80.A OG1 GLU 540.A OE1 no hydrogen 3.469 N/A THR 80.A OG1 GLU 540.A OE2 no hydrogen 2.890 N/A PHE 82.A N ASN 79.A O no hydrogen 3.067 N/A ASN 83.A N GLU 534.A O no hydrogen 2.819 N/A GLY 86.A N ASN 83.A O no hydrogen 2.927 N/A ASN 87.A ND2 SER 91.A O no hydrogen 2.809 N/A ASN 87.A ND2 PRO 122.A O no hydrogen 2.978 N/A GLY 90.A N ASN 87.A O no hydrogen 2.869 N/A SER 91.A N ASN 89.A OD1 no hydrogen 2.686 N/A ALA 93.A N SER 91.A OG no hydrogen 2.766 N/A VAL 95.A N ALA 110.A O no hydrogen 2.871 N/A LYS 96.A NZ ASN 79.A OD1 no hydrogen 2.626 N/A LYS 96.A NZ CYS 127.A O no hydrogen 2.890 N/A GLY 97.A N VAL 108.A O no hydrogen 3.057 N/A LEU 98.A N ARG 76.A O no hydrogen 2.974 N/A GLY 99.A N CYS 106.A O no hydrogen 2.996 N/A ARG 100.A N SER 74.A OG no hydrogen 3.013 N/A ARG 100.A NE GLU 71.A OE1 no hydrogen 2.850 N/A VAL 101.A N LYS 104.A O no hydrogen 2.735 N/A GLY 103.A N GLU 71.A OE2 no hydrogen 2.886 N/A LYS 104.A N VAL 101.A O no hydrogen 2.982 N/A LYS 104.A NZ VAL 282.A O no hydrogen 3.013 N/A LYS 104.A NZ GLY 283.A O no hydrogen 3.204 N/A LYS 104.A NZ LEU 285.A O no hydrogen 2.795 N/A TRP 105.A N GLN 560.A OE1 no hydrogen 2.666 N/A TRP 105.A NE1 GLU 556.A OE1 no hydrogen 2.711 N/A CYS 106.A N GLY 99.A O no hydrogen 2.807 N/A CYS 106.A SG LYS 104.A O no hydrogen 3.417 N/A VAL 107.A N PRO 141.A O no hydrogen 3.024 N/A VAL 108.A N GLY 97.A O no hydrogen 2.748 N/A VAL 109.A N VAL 143.A O no hydrogen 2.827 N/A ALA 110.A N VAL 95.A O no hydrogen 2.930 N/A SER 111.A N VAL 145.A O no hydrogen 3.010 N/A ASP 112.A N ALA 93.A O no hydrogen 3.166 N/A ASN 113.A ND2 GLU 59.A OE1 no hydrogen 3.467 N/A ASN 113.A ND2 LEU 60.A O no hydrogen 2.923 N/A ASN 113.A ND2 ASN 147.A OD1 no hydrogen 3.203 N/A LYS 114.A N ASP 112.A OD2 no hydrogen 2.962 N/A LYS 114.A NZ GLU 46.A O no hydrogen 3.022 N/A LYS 114.A NZ LYS 49.A O no hydrogen 2.610 N/A LYS 114.A NZ ASP 51.A OD2 no hydrogen 2.852 N/A LYS 115.A N ASP 112.A O no hydrogen 3.118 N/A LYS 115.A NZ ALA 44.A O no hydrogen 2.944 N/A LYS 115.A NZ ALA 47.A O no hydrogen 2.949 N/A LYS 115.A NZ ASP 112.A OD1 no hydrogen 2.687 N/A GLY 118.A N LYS 115.A O no hydrogen 3.000 N/A ALA 119.A N LEU 116.A O no hydrogen 3.089 N/A TRP 120.A N GLY 150.A O no hydrogen 2.633 N/A GLN 124.A N VAL 121.A O no hydrogen 2.923 N/A GLN 124.A NE2 VAL 92.A O no hydrogen 3.105 N/A GLN 124.A NE2 ALA 119.A O no hydrogen 3.132 N/A CYS 127.A N GLY 123.A O no hydrogen 3.166 N/A CYS 127.A SG ASN 79.A OD1 no hydrogen 3.836 N/A LEU 128.A N GLN 124.A O no hydrogen 2.867 N/A LEU 129.A N ALA 125.A O no hydrogen 2.792 N/A ARG 130.A N GLU 126.A O no hydrogen 3.112 N/A ARG 130.A NH1 GLY 536.A O no hydrogen 3.085 N/A ARG 130.A NH1 ASP 539.A OD1 no hydrogen 2.823 N/A ALA 131.A N CYS 127.A O no hydrogen 3.177 N/A SER 132.A N LEU 128.A O no hydrogen 3.033 N/A SER 132.A OG LEU 128.A O no hydrogen 3.459 N/A SER 132.A OG LEU 129.A O no hydrogen 3.151 N/A ASP 133.A N LEU 129.A O no hydrogen 2.935 N/A THR 134.A N ARG 130.A O no hydrogen 2.877 N/A THR 134.A OG1 ARG 130.A O no hydrogen 2.921 N/A THR 134.A OG1 ALA 472.A O no hydrogen 2.785 N/A ALA 135.A N ALA 131.A O no hydrogen 3.091 N/A LYS 136.A N SER 132.A O no hydrogen 2.835 N/A LYS 136.A NZ GLU 175.A OE1 no hydrogen 3.091 N/A LYS 136.A NZ GLU 175.A OE2 no hydrogen 3.461 N/A THR 137.A N ASP 133.A O no hydrogen 2.810 N/A THR 137.A OG1 ASP 133.A O no hydrogen 2.977 N/A THR 137.A OG1 ASP 469.A O no hydrogen 3.071 N/A LEU 138.A N THR 134.A O no hydrogen 2.967 N/A VAL 140.A N ALA 135.A O no hydrogen 3.248 N/A LEU 142.A N PRO 182.A O no hydrogen 3.176 N/A VAL 143.A N VAL 107.A O no hydrogen 2.822 N/A TYR 144.A N ILE 184.A O no hydrogen 2.795 N/A TYR 144.A OH HIS 198.A NE2 no hydrogen 3.381 N/A VAL 145.A N VAL 109.A O no hydrogen 2.854 N/A LEU 146.A N GLY 186.A O no hydrogen 2.947 N/A ASN 147.A N SER 111.A OG no hydrogen 3.061 N/A CYS 148.A N ASN 191.A OD1 no hydrogen 2.755 N/A CYS 148.A SG GLY 118.A O no hydrogen 3.616 N/A SER 149.A N ALA 117.A O no hydrogen 2.952 N/A SER 149.A OG LEU 116.A O no hydrogen 2.778 N/A SER 149.A OG ALA 117.A O no hydrogen 3.123 N/A GLU 155.A N LYS 152.A O no hydrogen 2.841 N/A GLN 156.A N PHE 153.A O no hydrogen 3.237 N/A GLU 157.A N GLU 157.A OE2 no hydrogen 2.666 N/A LYS 158.A N GLU 155.A O no hydrogen 2.811 N/A LYS 158.A NZ GLU 155.A OE1 no hydrogen 3.070 N/A VAL 159.A N GLN 156.A O no hydrogen 3.091 N/A TYR 160.A N GLN 156.A O no hydrogen 3.000 N/A ARG 163.A N ASN 162.A OD1 no hydrogen 2.925 N/A ARG 164.A NE GLU 126.A OE1 no hydrogen 3.087 N/A ARG 164.A NH2 GLU 126.A OE2 no hydrogen 2.600 N/A GLY 165.A N ASN 162.A O no hydrogen 3.297 N/A GLY 166.A N VAL 159.A O no hydrogen 2.801 N/A THR 168.A N GLY 165.A O no hydrogen 3.145 N/A THR 168.A OG1 ARG 163.A O no hydrogen 2.610 N/A THR 168.A OG1 GLY 165.A O no hydrogen 3.268 N/A PHE 170.A N GLY 167.A O no hydrogen 3.162 N/A PHE 171.A N THR 168.A O no hydrogen 2.915 N/A ARG 172.A N THR 168.A O no hydrogen 3.053 N/A ASN 173.A N PRO 169.A O no hydrogen 2.848 N/A ASN 173.A ND2 SER 201.A OG no hydrogen 2.805 N/A ALA 174.A N PHE 170.A O no hydrogen 3.306 N/A GLU 175.A N PHE 171.A O no hydrogen 2.910 N/A LEU 176.A N ARG 172.A O no hydrogen 2.880 N/A ASN 177.A N ASN 173.A O no hydrogen 3.149 N/A ASN 177.A ND2 THR 203.A OG1 no hydrogen 2.544 N/A GLN 178.A N ALA 174.A O no hydrogen 2.853 N/A LEU 179.A N GLU 175.A O no hydrogen 2.768 N/A LEU 179.A N LEU 176.A O no hydrogen 3.033 N/A GLY 180.A N ASN 177.A O no hydrogen 2.736 N/A ILE 181.A N LEU 176.A O no hydrogen 2.740 N/A VAL 183.A N THR 203.A OG1 no hydrogen 2.898 N/A ILE 184.A N LEU 142.A O no hydrogen 2.900 N/A VAL 185.A N VAL 204.A O no hydrogen 3.053 N/A GLY 186.A N TYR 144.A O no hydrogen 2.987 N/A ILE 187.A N ILE 206.A O no hydrogen 2.804 N/A TYR 188.A N LEU 146.A O no hydrogen 2.748 N/A TYR 188.A OH GLU 271.A O no hydrogen 3.052 N/A ASN 191.A N ASN 212.A O no hydrogen 3.183 N/A ASN 191.A N ASN 212.A OD1 no hydrogen 3.288 N/A ASN 191.A ND2 TYR 188.A O no hydrogen 2.989 N/A ASN 191.A ND2 ASN 212.A O no hydrogen 3.220 N/A GLY 195.A N PRO 192.A O no hydrogen 2.862 N/A TYR 197.A N ALA 193.A O no hydrogen 2.834 N/A HIS 198.A N GLY 194.A O no hydrogen 2.967 N/A SER 199.A N GLY 195.A O no hydrogen 2.945 N/A SER 199.A N GLY 196.A O no hydrogen 2.975 N/A SER 199.A OG GLY 195.A O no hydrogen 2.973 N/A ILE 200.A N GLY 196.A O no hydrogen 2.921 N/A SER 201.A N TYR 197.A O no hydrogen 3.013 N/A SER 201.A OG TYR 197.A O no hydrogen 2.787 N/A THR 203.A N VAL 183.A O no hydrogen 2.690 N/A THR 203.A OG1 VAL 183.A O no hydrogen 3.195 N/A VAL 204.A N VAL 183.A O no hydrogen 3.361 N/A ILE 206.A N VAL 185.A O no hydrogen 2.833 N/A ALA 207.A N GLU 266.A O no hydrogen 2.999 N/A HIS 208.A N ILE 187.A O no hydrogen 3.008 N/A GLU 209.A N TYR 268.A O no hydrogen 2.660 N/A LYS 210.A N HIS 208.A ND1 no hydrogen 3.100 N/A ALA 211.A N HIS 208.A O no hydrogen 2.889 N/A ASN 212.A N GLY 189.A O no hydrogen 2.921 N/A ASN 212.A ND2 THR 190.A OG1 no hydrogen 3.137 N/A MET 213.A N GLY 252.A O no hydrogen 2.959 N/A ALA 214.A N ASN 191.A O no hydrogen 3.147 N/A GLY 223.A N MET 221.A O no hydrogen 2.730 N/A ASN 225.A N GLY 223.A O no hydrogen 2.628 N/A PRO 226.A N MET 224.A O no hydrogen 2.691 N/A TYR 234.A N ASP 231.A OD1 no hydrogen 2.466 N/A ALA 235.A N ASP 231.A O no hydrogen 2.722 N/A ASN 236.A N LEU 232.A O no hydrogen 2.745 N/A ILE 238.A N TYR 234.A O no hydrogen 3.355 N/A ALA 239.A N ALA 235.A O no hydrogen 3.270 N/A MET 241.A N GLU 237.A O no hydrogen 2.632 N/A VAL 242.A N ILE 238.A O no hydrogen 2.801 N/A ASP 243.A N ALA 239.A O no hydrogen 2.979 N/A ARG 244.A N ASP 240.A O no hydrogen 2.777 N/A THR 245.A N VAL 242.A O no hydrogen 3.179 N/A THR 245.A OG1 MET 241.A O no hydrogen 3.037 N/A GLY 246.A N VAL 242.A O no hydrogen 2.946 N/A THR 248.A OG1 GLY 246.A O no hydrogen 3.510 N/A THR 248.A OG1 LYS 247.A O no hydrogen 2.462 N/A ILE 256.A N ALA 253.A O no hydrogen 2.765 N/A HIS 257.A N ALA 253.A O no hydrogen 2.947 N/A HIS 257.A ND1 THR 261.A OG1 no hydrogen 2.924 N/A TYR 258.A N VAL 254.A O no hydrogen 2.921 N/A THR 259.A N VAL 254.A O no hydrogen 3.300 N/A GLU 260.A N ILE 256.A O no hydrogen 2.985 N/A THR 261.A N ILE 256.A O no hydrogen 3.009 N/A THR 261.A OG1 HIS 257.A ND1 no hydrogen 2.924 N/A PHE 263.A N THR 261.A OG1 no hydrogen 3.234 N/A MET 264.A N HIS 257.A O no hydrogen 2.851 N/A ARG 265.A N ILE 205.A O no hydrogen 2.873 N/A TYR 268.A N ALA 207.A O no hydrogen 2.961 N/A GLU 272.A N GLU 272.A OE2 no hydrogen 2.631 N/A GLY 273.A N SER 270.A OG no hydrogen 3.053 N/A VAL 274.A N SER 270.A O no hydrogen 3.225 N/A LEU 275.A N GLU 271.A O no hydrogen 3.443 N/A GLU 276.A N GLU 272.A O no hydrogen 2.941 N/A GLY 277.A N GLY 273.A O no hydrogen 2.798 N/A ILE 278.A N VAL 274.A O no hydrogen 2.967 N/A LYS 279.A N LEU 275.A O no hydrogen 2.985 N/A LYS 279.A NZ LYS 68.A O no hydrogen 2.924 N/A LYS 280.A N GLU 276.A O no hydrogen 2.900 N/A LYS 280.A NZ GLU 266.A OE1 no hydrogen 2.991 N/A TYR 281.A N GLY 277.A O no hydrogen 3.066 N/A TYR 281.A OH GLU 266.A OE1 no hydrogen 3.102 N/A VAL 282.A N ILE 278.A O no hydrogen 2.781 N/A GLY 283.A N LYS 279.A O no hydrogen 2.831 N/A MET 284.A N TYR 281.A O no hydrogen 3.214 N/A LEU 285.A N VAL 282.A O no hydrogen 3.164 N/A LYS 287.A NZ GLY 103.A O no hydrogen 2.606 N/A TYR 288.A N GLN 560.A O no hydrogen 2.782 N/A GLU 291.A N ASP 289.A OD1 no hydrogen 2.983 N/A PHE 292.A N ASP 289.A O no hydrogen 2.811 N/A PHE 293.A N PRO 290.A O no hydrogen 2.971 N/A ARG 294.A N GLU 291.A O no hydrogen 3.181 N/A VAL 295.A N GLY 355.A O no hydrogen 2.947 N/A ASP 297.A N ASP 296.A OD1 no hydrogen 2.656 N/A LYS 299.A N ASP 331.A OD2 no hydrogen 2.907 N/A ALA 302.A N SER 333.A OG no hydrogen 2.766 N/A ASP 307.A N PRO 304.A O no hydrogen 3.277 N/A LEU 308.A N ALA 305.A O no hydrogen 2.975 N/A TYR 309.A N ASP 306.A O no hydrogen 2.992 N/A TYR 309.A OH GLU 34.A OE1 no hydrogen 2.491 N/A TYR 309.A OH GLU 34.A OE2 no hydrogen 3.118 N/A SER 310.A N ASP 307.A O no hydrogen 2.777 N/A MET 311.A N ASP 307.A O no hydrogen 2.882 N/A VAL 312.A N LEU 308.A O no hydrogen 2.918 N/A LEU 314.A N ASN 26.A OD1 no hydrogen 2.963 N/A LYS 317.A N ASN 315.A OD1 no hydrogen 2.750 N/A ARG 318.A N ASN 315.A O no hydrogen 3.055 N/A TYR 320.A OH ASP 413.A OD2 no hydrogen 2.459 N/A TYR 323.A N ASP 321.A OD1 no hydrogen 3.167 N/A TYR 323.A OH GLU 337.A OE2 no hydrogen 2.375 N/A ASN 324.A N ASP 321.A O no hydrogen 2.860 N/A VAL 325.A N ILE 322.A O no hydrogen 2.901 N/A ILE 326.A N ILE 322.A O no hydrogen 3.070 N/A ALA 327.A N TYR 323.A O no hydrogen 2.819 N/A ARG 328.A N VAL 325.A O no hydrogen 3.063 N/A ARG 328.A NE PRO 304.A O no hydrogen 2.999 N/A ARG 328.A NE ASP 307.A OD2 no hydrogen 3.221 N/A ARG 328.A NH1 ASN 324.A O no hydrogen 2.943 N/A ARG 328.A NH1 ASN 324.A OD1 no hydrogen 3.398 N/A ARG 328.A NH2 LYS 17.A O no hydrogen 2.866 N/A ARG 328.A NH2 ASP 307.A OD2 no hydrogen 2.912 N/A LEU 329.A N ILE 326.A O no hydrogen 3.105 N/A PHE 330.A N ILE 326.A O no hydrogen 3.224 N/A ASP 331.A N LYS 352.A O no hydrogen 2.820 N/A ASN 332.A N ALA 300.A O no hydrogen 2.889 N/A ASN 332.A ND2 GLU 334.A OE2 no hydrogen 2.895 N/A SER 333.A N PHE 330.A O no hydrogen 2.953 N/A SER 333.A OG ALA 327.A O no hydrogen 2.580 N/A GLU 334.A N ASP 331.A O no hydrogen 2.933 N/A LEU 335.A N PRO 13.A O no hydrogen 2.788 N/A HIS 336.A N LEU 350.A O no hydrogen 2.885 N/A TYR 338.A N THR 348.A O no hydrogen 2.660 N/A TYR 338.A OH GLU 396.A OE1 no hydrogen 3.211 N/A LYS 339.A NZ GLU 396.A OE1 no hydrogen 2.755 N/A TYR 342.A N LYS 339.A O no hydrogen 3.217 N/A GLY 343.A N GLN 389.A OE1 no hydrogen 2.976 N/A MET 346.A N GLY 343.A O no hydrogen 3.122 N/A VAL 347.A N ALA 362.A O no hydrogen 2.771 N/A THR 348.A OG1 TYR 338.A O no hydrogen 3.076 N/A GLY 349.A N VAL 360.A O no hydrogen 2.994 N/A LEU 350.A N HIS 336.A O no hydrogen 2.801 N/A ALA 351.A N VAL 358.A O no hydrogen 2.921 N/A LYS 352.A NZ PHE 9.A O no hydrogen 2.781 N/A LYS 352.A NZ ASP 296.A OD2 no hydrogen 2.789 N/A LYS 352.A NZ GLU 334.A OE1 no hydrogen 2.889 N/A VAL 353.A N LEU 356.A O no hydrogen 2.834 N/A ASN 354.A N ASP 331.A OD1 no hydrogen 2.784 N/A GLY 355.A N ASP 331.A OD2 no hydrogen 2.898 N/A LEU 356.A N VAL 353.A O no hydrogen 2.915 N/A VAL 358.A N ALA 351.A O no hydrogen 2.933 N/A GLY 359.A N PRO 407.A O no hydrogen 2.902 N/A VAL 360.A N GLY 349.A O no hydrogen 2.723 N/A VAL 361.A N VAL 409.A O no hydrogen 3.037 N/A ALA 362.A N VAL 347.A O no hydrogen 2.955 N/A VAL 364.A N GLU 345.A O no hydrogen 2.993 N/A GLN 365.A NE2 ASP 413.A O no hydrogen 2.970 N/A LEU 368.A N GLY 381.A O no hydrogen 2.789 N/A TYR 371.A N SER 379.A O no hydrogen 2.910 N/A TYR 371.A OH GLU 345.A OE2 no hydrogen 2.547 N/A TYR 374.A OH ASP 418.A OD2 no hydrogen 2.488 N/A LYS 375.A N PRO 372.A O no hydrogen 3.375 N/A LYS 375.A NZ ASP 418.A OD1 no hydrogen 3.239 N/A LYS 375.A NZ ASP 418.A OD2 no hydrogen 3.322 N/A GLY 378.A N ASN 370.A OD1 no hydrogen 3.338 N/A SER 379.A N ALA 376.A O no hydrogen 3.137 N/A SER 379.A OG TYR 371.A O no hydrogen 3.042 N/A SER 379.A OG PRO 372.A O no hydrogen 3.453 N/A SER 379.A OG ALA 376.A O no hydrogen 3.114 N/A GLY 381.A N LEU 368.A O no hydrogen 2.641 N/A ILE 382.A N TYR 387.A OH no hydrogen 2.792 N/A GLY 383.A N GLY 366.A O no hydrogen 2.648 N/A LYS 385.A N ILE 382.A O no hydrogen 3.068 N/A LYS 385.A NZ THR 415.A O no hydrogen 2.881 N/A LEU 386.A N GLY 416.A O no hydrogen 2.940 N/A TYR 387.A N GLU 345.A OE1 no hydrogen 2.972 N/A ARG 388.A NH1 ALA 426.A O no hydrogen 2.861 N/A ARG 388.A NH1 GLU 427.A OE2 no hydrogen 2.763 N/A ARG 388.A NH2 GLU 427.A OE2 no hydrogen 3.461 N/A LEU 391.A N TYR 387.A O no hydrogen 3.160 N/A VAL 392.A N ARG 388.A O no hydrogen 2.877 N/A LYS 393.A N GLN 389.A O no hydrogen 2.835 N/A LYS 393.A NZ TYR 342.A O no hydrogen 2.770 N/A LYS 393.A NZ GLY 343.A O no hydrogen 2.948 N/A LYS 393.A NZ MET 346.A O no hydrogen 2.888 N/A MET 394.A N GLY 390.A O no hydrogen 3.039 N/A ASN 395.A N LEU 391.A O no hydrogen 2.989 N/A ASN 395.A ND2 LEU 391.A O no hydrogen 2.880 N/A ASN 395.A ND2 LEU 431.A O no hydrogen 3.331 N/A GLU 396.A N VAL 392.A O no hydrogen 2.970 N/A PHE 397.A N LYS 393.A O no hydrogen 2.816 N/A VAL 398.A N MET 394.A O no hydrogen 2.858 N/A THR 399.A N ASN 395.A O no hydrogen 3.110 N/A THR 399.A OG1 ASN 395.A O no hydrogen 2.795 N/A LEU 400.A N GLU 396.A O no hydrogen 2.902 N/A CYS 401.A N PHE 397.A O no hydrogen 2.853 N/A CYS 401.A SG PHE 397.A O no hydrogen 3.465 N/A ALA 402.A N VAL 398.A O no hydrogen 2.805 N/A ARG 403.A N THR 399.A O no hydrogen 3.126 N/A ARG 403.A NH1 ASP 404.A OD1 no hydrogen 2.759 N/A ARG 403.A NH1 GLN 570.A O no hydrogen 2.961 N/A ARG 403.A NH2 GLN 570.A O no hydrogen 2.987 N/A ASP 404.A N LEU 400.A O no hydrogen 2.977 N/A ARG 405.A N ALA 402.A O no hydrogen 3.172 N/A ARG 405.A NE ARG 403.A O no hydrogen 2.907 N/A ARG 405.A NH1 SER 564.A OG no hydrogen 2.889 N/A ARG 405.A NH2 ARG 403.A O no hydrogen 3.103 N/A LEU 406.A N CYS 401.A O no hydrogen 2.887 N/A ILE 408.A N PRO 445.A O no hydrogen 3.300 N/A VAL 409.A N GLY 359.A O no hydrogen 2.952 N/A TRP 410.A N PHE 447.A O no hydrogen 2.642 N/A TRP 410.A NE1 GLN 446.A OE1 no hydrogen 2.777 N/A ILE 411.A N VAL 361.A O no hydrogen 2.722 N/A GLN 412.A N ILE 449.A O no hydrogen 2.673 N/A GLN 412.A NE2 HIS 459.A O no hydrogen 2.980 N/A GLN 412.A NE2 LEU 462.A O no hydrogen 2.742 N/A ASP 413.A N ASN 363.A OD1 no hydrogen 3.041 N/A THR 414.A N LYS 453.A O no hydrogen 2.868 N/A THR 414.A OG1 GLY 384.A O no hydrogen 2.607 N/A THR 415.A N GLY 384.A O no hydrogen 2.879 N/A GLY 416.A N THR 414.A OG1 no hydrogen 3.092 N/A ASP 418.A N LEU 386.A O no hydrogen 2.981 N/A GLU 424.A N GLY 420.A O no hydrogen 2.898 N/A LYS 425.A N ASN 421.A O no hydrogen 2.919 N/A ALA 426.A N ASP 422.A O no hydrogen 2.913 N/A GLU 427.A N GLU 424.A O no hydrogen 2.983 N/A LEU 428.A N ALA 423.A O no hydrogen 3.289 N/A LEU 431.A N GLU 427.A O no hydrogen 2.717 N/A GLY 432.A N LEU 428.A O no hydrogen 2.848 N/A GLN 433.A N LEU 429.A O no hydrogen 3.206 N/A SER 434.A N GLY 430.A O no hydrogen 2.864 N/A SER 434.A OG GLY 430.A O no hydrogen 2.619 N/A LEU 435.A N LEU 431.A O no hydrogen 3.054 N/A ILE 436.A N GLY 432.A O no hydrogen 3.242 N/A TYR 437.A N GLN 433.A O no hydrogen 2.799 N/A SER 438.A N SER 434.A O no hydrogen 2.723 N/A SER 438.A OG ASN 395.A OD1 no hydrogen 2.727 N/A SER 438.A OG SER 434.A O no hydrogen 3.000 N/A ILE 439.A N LEU 435.A O no hydrogen 2.926 N/A GLN 440.A N ILE 436.A O no hydrogen 2.969 N/A GLN 440.A NE2 ASP 469.A OD2 no hydrogen 2.856 N/A THR 441.A N TYR 437.A O no hydrogen 3.038 N/A SER 442.A N ILE 439.A O no hydrogen 3.007 N/A SER 442.A OG ILE 439.A O no hydrogen 2.638 N/A GLN 446.A N THR 470.A O no hydrogen 2.799 N/A GLN 446.A NE2 ILE 444.A O no hydrogen 3.254 N/A PHE 447.A N ILE 408.A O no hydrogen 2.865 N/A ILE 449.A N TRP 410.A O no hydrogen 2.667 N/A THR 450.A N ILE 475.A O no hydrogen 2.947 N/A THR 450.A OG1 GLU 448.A OE1 no hydrogen 3.227 N/A THR 450.A OG1 GLU 448.A OE2 no hydrogen 2.664 N/A ARG 452.A N GLN 412.A O no hydrogen 3.324 N/A ARG 452.A NE PRO 313.A O no hydrogen 3.092 N/A ARG 452.A NH1 ARG 318.A O no hydrogen 3.283 N/A ARG 452.A NH1 ASP 413.A OD2 no hydrogen 3.271 N/A ARG 452.A NH2 ARG 318.A O no hydrogen 3.253 N/A LYS 453.A N ASP 413.A OD1 no hydrogen 3.134 N/A GLY 454.A N GLU 481.A O no hydrogen 3.108 N/A THR 455.A OG1 THR 414.A O no hydrogen 2.710 N/A ALA 456.A N VAL 484.A O no hydrogen 2.898 N/A HIS 459.A N THR 455.A O no hydrogen 3.347 N/A HIS 459.A N ALA 456.A O no hydrogen 3.378 N/A HIS 459.A ND1 GLN 412.A OE1 no hydrogen 2.696 N/A TYR 460.A N ALA 457.A O no hydrogen 2.913 N/A VAL 461.A N ALA 457.A O no hydrogen 3.060 N/A LEU 462.A N ALA 458.A O no hydrogen 3.009 N/A GLY 464.A N TYR 460.A O no hydrogen 3.054 N/A GLN 466.A NE2 HIS 459.A NE2 no hydrogen 3.672 N/A GLY 467.A N GLY 464.A O no hydrogen 3.148 N/A ASN 468.A ND2 PRO 465.A O no hydrogen 2.916 N/A THR 470.A OG1 GLY 467.A O no hydrogen 3.476 N/A ASN 471.A N GLY 467.A O no hydrogen 2.922 N/A ASN 471.A ND2 PHE 473.A O no hydrogen 3.082 N/A ALA 472.A N GLN 446.A O no hydrogen 2.915 N/A SER 474.A N ASP 539.A OD2 no hydrogen 3.055 N/A ILE 475.A N GLU 448.A O no hydrogen 3.051 N/A GLY 476.A N GLU 540.A O no hydrogen 2.730 N/A THR 477.A N THR 480.A OG1 no hydrogen 2.627 N/A THR 477.A OG1 LEU 451.A O no hydrogen 2.880 N/A ALA 479.A N THR 477.A OG1 no hydrogen 2.973 N/A THR 480.A N THR 477.A O no hydrogen 3.082 N/A THR 480.A OG1 THR 450.A O no hydrogen 2.582 N/A THR 480.A OG1 THR 477.A O no hydrogen 3.202 N/A GLU 481.A N ARG 452.A O no hydrogen 2.905 N/A ILE 482.A N SER 527.A O no hydrogen 3.276 N/A ALA 483.A N GLY 454.A O no hydrogen 3.201 N/A ALA 490.A N ASN 486.A O no hydrogen 2.854 N/A ALA 491.A N GLY 487.A O no hydrogen 2.685 N/A THR 492.A N GLU 488.A O no hydrogen 2.867 N/A THR 492.A OG1 GLU 488.A O no hydrogen 3.419 N/A THR 492.A OG1 THR 489.A O no hydrogen 3.133 N/A ALA 493.A N THR 489.A O no hydrogen 3.018 N/A MET 494.A N ALA 490.A O no hydrogen 2.820 N/A TYR 495.A N ALA 491.A O no hydrogen 2.925 N/A SER 496.A N THR 492.A O no hydrogen 2.733 N/A LEU 499.A N TYR 495.A O no hydrogen 2.924 N/A ALA 500.A N SER 496.A O no hydrogen 3.120 N/A LYS 501.A N ARG 497.A O no hydrogen 3.062 N/A ASP 502.A N ARG 498.A O no hydrogen 2.769 N/A ARG 503.A N LEU 499.A O no hydrogen 3.072 N/A LYS 504.A N ALA 500.A O no hydrogen 3.068 N/A ALA 505.A N LYS 501.A O no hydrogen 3.009 N/A ALA 505.A N ASP 502.A O no hydrogen 3.013 N/A GLY 506.A N ARG 503.A O no hydrogen 3.046 N/A LYS 507.A N ASP 502.A O no hydrogen 2.673 N/A LYS 507.A NZ ALA 505.A O no hydrogen 2.904 N/A GLN 510.A N ASP 508.A OD1 no hydrogen 2.599 N/A GLN 510.A NE2 ASP 514.A OD1 no hydrogen 2.930 N/A ILE 513.A N LEU 509.A O no hydrogen 2.942 N/A ASP 514.A N GLN 510.A O no hydrogen 2.744 N/A LYS 515.A N PRO 511.A O no hydrogen 3.155 N/A MET 516.A N THR 512.A O no hydrogen 3.050 N/A ASN 517.A N ILE 513.A O no hydrogen 2.979 N/A ASN 518.A N ASP 514.A O no hydrogen 2.793 N/A LEU 519.A N LYS 515.A O no hydrogen 2.879 N/A ILE 520.A N MET 516.A O no hydrogen 2.917 N/A GLN 521.A N ASN 517.A O no hydrogen 2.851 N/A GLN 521.A NE2 THR 525.A OG1 no hydrogen 3.277 N/A ALA 522.A N ASN 518.A O no hydrogen 2.788 N/A PHE 523.A N LEU 519.A O no hydrogen 2.834 N/A TYR 524.A N ILE 520.A O no hydrogen 3.115 N/A THR 525.A N GLN 521.A O no hydrogen 3.016 N/A THR 525.A OG1 GLN 521.A O no hydrogen 3.162 N/A LYS 526.A N ALA 522.A O no hydrogen 2.902 N/A SER 527.A N TYR 524.A O no hydrogen 3.267 N/A SER 527.A OG PHE 523.A O no hydrogen 2.673 N/A SER 527.A OG TYR 524.A O no hydrogen 2.938 N/A ARG 528.A NE TYR 524.A O no hydrogen 2.736 N/A ARG 528.A NH2 GLU 481.A OE1 no hydrogen 2.910 N/A ARG 528.A NH2 SER 527.A OG no hydrogen 2.933 N/A LYS 530.A NZ GLU 36.A OE2 no hydrogen 3.204 N/A CYS 532.A N ARG 528.A O no hydrogen 2.933 N/A CYS 532.A SG SER 527.A O no hydrogen 3.504 N/A CYS 532.A SG ARG 528.A O no hydrogen 3.257 N/A ALA 533.A N PRO 529.A O no hydrogen 2.896 N/A GLU 534.A N LYS 530.A O no hydrogen 3.066 N/A LEU 535.A N VAL 531.A O no hydrogen 2.956 N/A GLY 536.A N CYS 532.A O no hydrogen 2.954 N/A GLY 536.A N ALA 533.A O no hydrogen 3.126 N/A LEU 537.A N CYS 532.A O no hydrogen 2.684 N/A ASP 539.A N SER 474.A O no hydrogen 2.641 N/A VAL 542.A N GLY 476.A O no hydrogen 2.727 N/A MET 544.A N GLU 34.A OE2 no hydrogen 2.896 N/A ASN 545.A ND2 ASP 306.A OD2 no hydrogen 3.269 N/A LYS 546.A N ASP 543.A O no hydrogen 2.644 N/A ARG 548.A NE GLU 552.A OE1 no hydrogen 2.827 N/A ARG 548.A NH1 LEU 329.A O no hydrogen 2.643 N/A ARG 548.A NH2 ASP 331.A OD1 no hydrogen 2.511 N/A GLY 549.A N LYS 546.A O no hydrogen 3.153 N/A TYR 550.A N ILE 547.A O no hydrogen 2.903 N/A TYR 550.A OH PRO 77.A O no hydrogen 2.618 N/A VAL 551.A N ILE 547.A O no hydrogen 3.113 N/A GLU 552.A N ARG 548.A O no hydrogen 2.873 N/A ALA 553.A N GLY 549.A O no hydrogen 2.995 N/A PHE 554.A N TYR 550.A O no hydrogen 2.865 N/A THR 555.A N VAL 551.A O no hydrogen 3.029 N/A THR 555.A OG1 VAL 551.A O no hydrogen 2.774 N/A GLU 556.A N GLU 552.A O no hydrogen 2.944 N/A ALA 557.A N ALA 553.A O no hydrogen 2.982 N/A ALA 558.A N PHE 554.A O no hydrogen 2.777 N/A TYR 559.A N THR 555.A O no hydrogen 3.001 N/A TYR 559.A OH LEU 357.A O no hydrogen 2.587 N/A GLN 560.A N ALA 557.A O no hydrogen 3.033 N/A GLN 560.A NE2 TRP 105.A O no hydrogen 2.935 N/A CYS 566.A SG PRO 567.A O no hydrogen 3.647 N/A CYS 566.A SG GLN 570.A O no hydrogen 3.548 N/A GLN 570.A N PRO 567.A O no hydrogen 2.728 N/A GLN 570.A NE2 HIS 569.A NE2 no hydrogen 3.528 N/A MET 571.A N PHE 568.A O no hydrogen 3.084 N/A ILE 572.A N ASP 404.A OD1 no hydrogen 2.992 N/A LEU 573.A N ASP 404.A OD2 no hydrogen 2.789 N/A ARG 575.A NH1 HIS 569.A O no hydrogen 2.826 N/A ARG 575.A NH2 HIS 569.A O no hydrogen 3.083 N/A ALA 576.A N ILE 572.A O no hydrogen 2.788 N/A ILE 577.A N LEU 573.A O no hydrogen 2.957 N/A ARG 578.A N PRO 574.A O no hydrogen 3.299 N/A GLU 579.A N ARG 575.A O no hydrogen 2.876 N/A PHE 580.A N ALA 576.A O no hydrogen 2.998 N/A GLU 581.A N ILE 577.A O no hydrogen 3.286 N/A THR 582.A N ARG 578.A O no hydrogen 3.079 N/A THR 582.A OG1 ARG 578.A O no hydrogen 3.496 N/A PHE 583.A N GLU 579.A O no hydrogen 2.969 N/A