Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e0d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 7.A ND1 GLU 171.A OE2 no hydrogen 2.950 N/A HIS 7.A NE2 HIS 9.A NE2 no hydrogen 3.020 N/A HIS 7.A NE2 GLU 68.A OE1 no hydrogen 2.887 N/A GLN 8.A NE2 HIS 9.A O no hydrogen 2.821 N/A HIS 9.A N GLY 204.A O no hydrogen 2.956 N/A HIS 9.A ND1 SER 13.A OG no hydrogen 3.087 N/A HIS 9.A NE2 HIS 7.A NE2 no hydrogen 3.020 N/A THR 10.A N ASP 42.A OD1 no hydrogen 2.837 N/A THR 10.A OG1 ASP 42.A OD1 no hydrogen 3.343 N/A THR 10.A OG1 ASP 42.A OD2 no hydrogen 2.836 N/A PHE 12.A N THR 10.A OG1 no hydrogen 3.062 N/A SER 13.A N THR 10.A O no hydrogen 3.204 N/A SER 13.A OG HIS 9.A ND1 no hydrogen 3.087 N/A SER 13.A OG ASP 42.A OD1 no hydrogen 2.679 N/A ASN 16.A ND2 HIS 43.A NE2 no hydrogen 3.193 N/A GLY 17.A N SER 13.A O no hydrogen 2.675 N/A ALA 18.A N HIS 205.A O no hydrogen 2.853 N/A LEU 24.A N LYS 20.A O no hydrogen 3.188 N/A LYS 26.A N GLN 22.A O no hydrogen 3.211 N/A TRP 27.A N ASP 23.A O no hydrogen 3.210 N/A TRP 27.A NE1 VAL 242.A O no hydrogen 3.032 N/A VAL 28.A N LEU 24.A O no hydrogen 3.126 N/A LYS 29.A N LEU 25.A O no hydrogen 3.225 N/A LYS 29.A NZ PRO 33.A O no hydrogen 3.451 N/A GLU 30.A N LYS 26.A O no hydrogen 2.712 N/A THR 31.A N TRP 27.A O no hydrogen 3.184 N/A THR 31.A OG1 TRP 27.A O no hydrogen 2.610 N/A THR 32.A N VAL 28.A O no hydrogen 3.024 N/A LEU 38.A N LYS 62.A O no hydrogen 3.118 N/A ALA 39.A N HIS 5.A O no hydrogen 3.215 N/A MET 40.A N ILE 64.A O no hydrogen 2.790 N/A THR 41.A N GLN 8.A O no hydrogen 2.990 N/A THR 41.A OG1 GLN 8.A O no hydrogen 3.407 N/A THR 41.A OG1 THR 41.A O no hydrogen 2.650 N/A HIS 43.A N SER 13.A OG no hydrogen 2.958 N/A HIS 43.A NE2 HIS 205.A NE2 no hydrogen 3.262 N/A GLY 44.A N GLU 68.A O no hydrogen 2.897 N/A ASN 45.A ND2 PHE 12.A O no hydrogen 2.922 N/A LEU 46.A N GLN 577.A OE1 no hydrogen 3.112 N/A PHE 47.A N ASN 45.A OD1 no hydrogen 2.999 N/A ALA 49.A N LEU 46.A O no hydrogen 3.157 N/A PHE 52.A N GLY 48.A O no hydrogen 2.878 N/A TYR 53.A N ALA 49.A O no hydrogen 2.884 N/A TYR 53.A OH ASP 275.A OD1 no hydrogen 3.326 N/A LYS 54.A N VAL 50.A O no hydrogen 3.000 N/A LYS 55.A N GLU 51.A O no hydrogen 2.937 N/A LYS 55.A NZ GLU 51.A OE2 no hydrogen 3.484 N/A ALA 56.A N PHE 52.A O no hydrogen 3.028 N/A THR 57.A N TYR 53.A O no hydrogen 3.023 N/A MET 59.A N ALA 56.A O no hydrogen 3.161 N/A VAL 61.A N ALA 56.A O no hydrogen 2.967 N/A LYS 62.A N PRO 36.A O no hydrogen 2.910 N/A LYS 62.A NZ ALA 269.A O no hydrogen 3.012 N/A LYS 62.A NZ CYS 272.A O no hydrogen 3.357 N/A ILE 64.A N LEU 38.A O no hydrogen 2.775 N/A GLY 66.A N MET 40.A O no hydrogen 2.706 N/A TYR 67.A N LEU 89.A O no hydrogen 2.924 N/A GLU 68.A N ASP 42.A O no hydrogen 2.935 N/A ALA 69.A N LEU 87.A O no hydrogen 2.811 N/A VAL 71.A N PHE 85.A O no hydrogen 2.695 N/A ALA 72.A N ILE 118.A O no hydrogen 2.951 N/A ALA 73.A N GLY 83.A O no hydrogen 3.183 N/A SER 75.A N ASP 78.A OD2 no hydrogen 2.965 N/A ARG 76.A N ASP 119.A OD2 no hydrogen 3.265 N/A ARG 76.A NE GLU 110.A OE1 no hydrogen 2.742 N/A ARG 76.A NH1 ASP 119.A OD2 no hydrogen 2.512 N/A ARG 76.A NH1 GLU 121.A OE1 no hydrogen 3.229 N/A ARG 76.A NH2 GLU 110.A OE1 no hydrogen 3.082 N/A PHE 77.A N SER 75.A OG no hydrogen 3.153 N/A ASP 78.A N SER 75.A O no hydrogen 3.085 N/A ARG 79.A NH1 ARG 76.A O no hydrogen 2.800 N/A ARG 79.A NH1 ASP 78.A O no hydrogen 2.959 N/A ARG 79.A NH2 GLU 110.A O no hydrogen 3.318 N/A ARG 81.A NE TYR 113.A OH no hydrogen 2.715 N/A PHE 85.A N VAL 71.A O no hydrogen 2.695 N/A HIS 86.A N GLY 138.A O no hydrogen 3.254 N/A HIS 86.A ND1 GLU 68.A OE2 no hydrogen 2.819 N/A LEU 87.A N ALA 69.A O no hydrogen 2.970 N/A THR 88.A OG1 HIS 7.A ND1 no hydrogen 3.301 N/A THR 88.A OG1 GLU 171.A OE1 no hydrogen 2.749 N/A LEU 89.A N TYR 67.A O no hydrogen 2.858 N/A LEU 90.A N ILE 131.A O no hydrogen 2.822 N/A ALA 91.A N ILE 65.A O no hydrogen 3.106 N/A LYS 92.A N GLY 129.A O no hydrogen 3.156 N/A GLY 96.A N ASP 93.A OD1 no hydrogen 3.186 N/A TYR 97.A N ASP 93.A O no hydrogen 2.852 N/A TYR 97.A OH LEU 563.A O no hydrogen 2.902 N/A TYR 97.A OH TYR 578.A OH no hydrogen 2.964 N/A GLN 98.A N PHE 94.A O no hydrogen 2.802 N/A ASN 99.A N THR 95.A O no hydrogen 2.924 N/A ASN 99.A ND2 GLN 128.A O no hydrogen 2.913 N/A LEU 100.A N GLY 96.A O no hydrogen 3.022 N/A VAL 101.A N TYR 97.A O no hydrogen 3.013 N/A ARG 102.A N GLN 98.A O no hydrogen 2.913 N/A ARG 102.A NH2 ASP 562.A OD1 no hydrogen 3.525 N/A LEU 103.A N ASN 99.A O no hydrogen 2.896 N/A ALA 104.A N LEU 100.A O no hydrogen 2.779 N/A SER 105.A N VAL 101.A O no hydrogen 3.060 N/A SER 105.A OG VAL 101.A O no hydrogen 2.883 N/A ARG 106.A N ARG 102.A O no hydrogen 2.761 N/A ARG 106.A NE GLU 110.A OE2 no hydrogen 3.292 N/A ARG 106.A NH1 GLU 125.A OE1 no hydrogen 3.276 N/A ARG 106.A NH2 GLU 125.A OE1 no hydrogen 3.568 N/A ALA 107.A N LEU 103.A O no hydrogen 2.793 N/A TYR 108.A N SER 105.A O no hydrogen 3.052 N/A LEU 109.A N SER 105.A O no hydrogen 2.889 N/A GLU 110.A N ARG 106.A O no hydrogen 2.740 N/A GLY 111.A N ARG 106.A O no hydrogen 3.103 N/A TYR 113.A N LYS 115.A O no hydrogen 3.134 N/A ARG 117.A N GLY 111.A O no hydrogen 2.877 N/A ARG 117.A NE GLY 111.A O no hydrogen 3.193 N/A ARG 117.A NH2 ASP 78.A O no hydrogen 3.079 N/A ILE 118.A N TYR 70.A O no hydrogen 2.871 N/A ARG 120.A NE GLU 140.A OE2 no hydrogen 3.168 N/A ARG 120.A NH1 GLU 159.A OE1 no hydrogen 3.136 N/A ARG 120.A NH2 ALA 72.A O no hydrogen 3.508 N/A LEU 123.A N ASP 119.A O no hydrogen 2.897 N/A ARG 124.A N ARG 120.A O no hydrogen 3.214 N/A ARG 124.A NH1 SER 162.A O no hydrogen 3.546 N/A ARG 124.A NH2 SER 162.A OG no hydrogen 2.904 N/A GLU 125.A N GLU 121.A O no hydrogen 3.151 N/A HIS 126.A N ILE 122.A O no hydrogen 2.943 N/A LEU 130.A N ALA 127.A O no hydrogen 3.094 N/A ILE 131.A N LEU 90.A O no hydrogen 2.865 N/A ALA 132.A N ARG 167.A O no hydrogen 2.790 N/A LEU 133.A N THR 88.A O no hydrogen 2.905 N/A SER 134.A N PHE 169.A O no hydrogen 2.877 N/A SER 134.A OG GLU 171.A O no hydrogen 3.329 N/A CYS 136.A SG GLU 68.A OE2 no hydrogen 3.208 N/A CYS 136.A SG HIS 86.A ND1 no hydrogen 3.037 N/A ALA 139.A N CYS 136.A O no hydrogen 2.734 N/A GLN 143.A N ALA 139.A O no hydrogen 3.167 N/A PHE 144.A N GLU 140.A O no hydrogen 2.821 N/A ILE 145.A N ILE 141.A O no hydrogen 2.976 N/A LEU 146.A N PRO 142.A O no hydrogen 2.985 N/A GLN 147.A N GLN 143.A O no hydrogen 3.261 N/A GLN 147.A N PHE 144.A O no hydrogen 3.105 N/A ASP 148.A N ILE 145.A O no hydrogen 3.145 N/A ARG 149.A N PHE 144.A O no hydrogen 3.125 N/A ARG 149.A NE ASP 151.A OD1 no hydrogen 3.284 N/A ARG 149.A NH2 ASP 151.A OD2 no hydrogen 3.378 N/A ALA 153.A N ARG 149.A O no hydrogen 3.221 N/A GLU 154.A N LEU 150.A O no hydrogen 2.981 N/A ALA 155.A N ASP 151.A O no hydrogen 3.096 N/A ARG 156.A N LEU 152.A O no hydrogen 2.733 N/A ARG 156.A NE GLU 140.A OE2 no hydrogen 2.721 N/A LEU 157.A N ALA 153.A O no hydrogen 2.751 N/A ASN 158.A N GLU 154.A O no hydrogen 2.844 N/A ASN 158.A ND2 TYR 194.A OH no hydrogen 3.328 N/A GLU 159.A N ALA 155.A O no hydrogen 3.048 N/A ASP 160.A N ARG 156.A O no hydrogen 3.021 N/A LEU 161.A N LEU 157.A O no hydrogen 2.959 N/A SER 162.A N ASN 158.A O no hydrogen 2.911 N/A ILE 163.A N ASP 160.A O no hydrogen 2.994 N/A PHE 164.A N ASP 160.A O no hydrogen 2.918 N/A GLY 165.A N LEU 161.A O no hydrogen 2.987 N/A ARG 167.A N PHE 164.A O no hydrogen 3.075 N/A ARG 167.A NH1 LEU 130.A O no hydrogen 3.279 N/A PHE 169.A N ALA 132.A O no hydrogen 2.991 N/A ILE 170.A N GLY 197.A O no hydrogen 3.327 N/A GLU 171.A N SER 134.A OG no hydrogen 2.867 N/A ILE 172.A N VAL 199.A O no hydrogen 2.964 N/A ASN 174.A ND2 MET 251.A O no hydrogen 2.768 N/A HIS 175.A N GLN 180.A OE1 no hydrogen 3.021 N/A HIS 175.A NE2 ASN 202.A O no hydrogen 3.060 N/A GLU 179.A N GLU 179.A OE1 no hydrogen 2.896 N/A GLN 180.A N LEU 177.A O no hydrogen 3.083 N/A GLN 180.A NE2 HIS 175.A ND1 no hydrogen 3.020 N/A LYS 182.A NZ LEU 146.A O no hydrogen 3.523 N/A LYS 182.A NZ ASP 148.A OD1 no hydrogen 2.686 N/A VAL 183.A N GLU 179.A O no hydrogen 3.018 N/A ASN 184.A N GLN 180.A O no hydrogen 2.935 N/A ASN 184.A ND2 GLN 173.A O no hydrogen 2.971 N/A GLN 185.A N LYS 181.A O no hydrogen 3.215 N/A VAL 186.A N LYS 182.A O no hydrogen 3.375 N/A LEU 187.A N VAL 183.A O no hydrogen 2.718 N/A LYS 188.A N ASN 184.A O no hydrogen 2.671 N/A LYS 188.A NZ GLU 256.A OE2 no hydrogen 3.086 N/A GLU 189.A N GLN 185.A O no hydrogen 3.424 N/A PHE 190.A N VAL 186.A O no hydrogen 3.100 N/A ALA 191.A N LEU 187.A O no hydrogen 2.840 N/A ARG 192.A N LYS 188.A O no hydrogen 3.138 N/A ARG 192.A N GLU 189.A O no hydrogen 3.280 N/A LYS 193.A N GLU 189.A O no hydrogen 2.953 N/A LYS 193.A N PHE 190.A O no hydrogen 3.259 N/A LYS 193.A NZ GLU 154.A OE2 no hydrogen 2.650 N/A TYR 194.A N PHE 190.A O no hydrogen 3.065 N/A TYR 194.A OH GLU 154.A OE2 no hydrogen 2.539 N/A LEU 196.A N ALA 191.A O no hydrogen 2.769 N/A VAL 199.A N ILE 170.A O no hydrogen 2.980 N/A ALA 200.A N PRO 261.A O no hydrogen 3.060 N/A THR 201.A N ILE 172.A O no hydrogen 3.292 N/A THR 201.A OG1 GLU 171.A OE2 no hydrogen 2.738 N/A THR 201.A OG1 GLN 173.A OE1 no hydrogen 2.907 N/A ASN 202.A ND2 GLU 239.A O no hydrogen 3.047 N/A GLY 204.A N HIS 7.A O no hydrogen 3.248 N/A HIS 205.A N PHE 240.A O no hydrogen 2.992 N/A HIS 205.A ND1 ASN 203.A O no hydrogen 3.130 N/A HIS 205.A NE2 HIS 43.A NE2 no hydrogen 3.262 N/A TYR 206.A N PHE 240.A O no hydrogen 3.229 N/A ARG 208.A N ASP 211.A OD2 no hydrogen 2.905 N/A GLU 210.A N GLU 210.A OE2 no hydrogen 2.646 N/A ASP 211.A N ARG 208.A O no hydrogen 3.067 N/A ALA 212.A N LYS 209.A O no hydrogen 3.433 N/A HIS 215.A N ASP 211.A O no hydrogen 2.861 N/A HIS 215.A NE2 ASN 16.A O no hydrogen 2.983 N/A GLU 216.A N ALA 212.A O no hydrogen 2.804 N/A VAL 217.A N ARG 213.A O no hydrogen 2.857 N/A LEU 218.A N ALA 214.A O no hydrogen 3.081 N/A LEU 219.A N HIS 215.A O no hydrogen 3.095 N/A ILE 221.A N LEU 218.A O no hydrogen 2.923 N/A GLN 222.A N LEU 218.A O no hydrogen 3.219 N/A SER 223.A N LEU 219.A O no hydrogen 2.742 N/A THR 225.A N ALA 220.A O no hydrogen 3.083 N/A ARG 234.A NE GLU 216.A OE2 no hydrogen 3.527 N/A PHE 240.A N TYR 206.A OH no hydrogen 3.124 N/A TYR 241.A N GLU 239.A O no hydrogen 2.820 N/A VAL 242.A N VAL 207.A O no hydrogen 2.976 N/A LYS 243.A NZ GLU 239.A OE1 no hydrogen 3.100 N/A THR 244.A N GLU 247.A OE1 no hydrogen 3.255 N/A MET 248.A N THR 244.A O no hydrogen 3.026 N/A ARG 249.A N PRO 245.A O no hydrogen 3.303 N/A ARG 249.A NH1 LEU 252.A O no hydrogen 3.202 N/A ARG 249.A NH1 GLY 258.A O no hydrogen 2.820 N/A ARG 249.A NH2 GLY 258.A O no hydrogen 2.814 N/A ALA 250.A N GLU 246.A O no hydrogen 3.238 N/A MET 251.A N MET 248.A O no hydrogen 3.121 N/A LEU 252.A N MET 248.A O no hydrogen 2.967 N/A TRP 257.A N PRO 253.A O no hydrogen 3.018 N/A GLY 258.A N GLU 254.A O no hydrogen 3.024 N/A PHE 262.A N ASP 259.A O no hydrogen 2.994 N/A ASP 263.A N ASP 259.A O no hydrogen 2.808 N/A ASN 264.A N GLU 260.A O no hydrogen 2.911 N/A THR 265.A N PHE 262.A O no hydrogen 3.225 N/A THR 265.A OG1 PRO 261.A O no hydrogen 3.539 N/A GLU 267.A N ASP 263.A O no hydrogen 3.114 N/A ILE 268.A N ASN 264.A O no hydrogen 3.007 N/A ALA 269.A N THR 265.A O no hydrogen 3.340 N/A ARG 270.A N VAL 266.A O no hydrogen 3.105 N/A MET 271.A N GLU 267.A O no hydrogen 3.086 N/A CYS 272.A SG ALA 91.A O no hydrogen 4.033 N/A CYS 272.A SG ILE 268.A O no hydrogen 3.262 N/A ILE 278.A N LEU 276.A O no hydrogen 2.981 N/A LYS 281.A NZ TYR 53.A OH no hydrogen 3.336 N/A ARG 285.A N GLY 587.A O no hydrogen 2.795 N/A ARG 285.A NH1 LEU 586.A O no hydrogen 2.425 N/A TYR 298.A N THR 294.A O no hydrogen 3.029 N/A ARG 300.A N ALA 296.A O no hydrogen 3.329 N/A ARG 300.A NH2 GLU 341.A OE2 no hydrogen 3.441 N/A GLU 301.A N GLN 297.A O no hydrogen 2.782 N/A LEU 302.A N TYR 298.A O no hydrogen 2.927 N/A THR 303.A N LEU 299.A O no hydrogen 3.166 N/A THR 303.A N ARG 300.A O no hydrogen 2.890 N/A THR 303.A OG1 LEU 299.A O no hydrogen 2.665 N/A PHE 304.A N ARG 300.A O no hydrogen 3.074 N/A LEU 305.A N GLU 301.A O no hydrogen 3.068 N/A GLY 306.A N THR 303.A O no hydrogen 3.071 N/A LEU 307.A N THR 303.A O no hydrogen 2.941 N/A ARG 310.A N GLY 306.A O no hydrogen 2.847 N/A ARG 310.A N LEU 307.A O no hydrogen 2.835 N/A ARG 310.A NH1 TYR 408.A O no hydrogen 2.410 N/A TYR 311.A N LEU 307.A O no hydrogen 2.680 N/A TYR 311.A OH ASP 416.A OD1 no hydrogen 2.982 N/A ARG 314.A N TYR 311.A O no hydrogen 3.299 N/A ILE 315.A N TYR 311.A O no hydrogen 2.777 N/A GLU 317.A N GLU 317.A OE1 no hydrogen 2.792 N/A TYR 320.A N THR 316.A O no hydrogen 3.159 N/A TYR 320.A OH PHE 304.A O no hydrogen 2.758 N/A ARG 321.A N GLU 317.A O no hydrogen 3.069 N/A GLU 322.A N ALA 318.A O no hydrogen 3.170 N/A VAL 323.A N PHE 319.A O no hydrogen 3.261 N/A LEU 324.A N TYR 320.A O no hydrogen 2.954 N/A ARG 325.A N ARG 321.A O no hydrogen 2.775 N/A ARG 325.A NH1 GLU 322.A OE1 no hydrogen 3.281 N/A LEU 326.A N VAL 323.A O no hydrogen 3.177 N/A LEU 327.A N LEU 324.A O no hydrogen 2.719 N/A LEU 332.A N GLU 329.A O no hydrogen 3.264 N/A GLU 334.A N ARG 330.A O no hydrogen 2.977 N/A ALA 335.A N ALA 331.A O no hydrogen 3.178 N/A LEU 336.A N LEU 332.A O no hydrogen 2.793 N/A ALA 337.A N ALA 333.A O no hydrogen 2.929 N/A ARG 338.A N ALA 335.A O no hydrogen 3.149 N/A ARG 338.A NH2 GLU 334.A OE1 no hydrogen 3.192 N/A ALA 343.A N GLU 340.A O no hydrogen 3.216 N/A TRP 344.A N GLU 340.A O no hydrogen 3.110 N/A LEU 347.A N TRP 344.A O no hydrogen 3.354 N/A ILE 357.A N THR 353.A O no hydrogen 3.138 N/A LEU 358.A N ALA 354.A O no hydrogen 3.241 N/A HIS 359.A N GLU 355.A O no hydrogen 3.132 N/A ARG 360.A N ALA 356.A O no hydrogen 3.128 N/A ARG 360.A NE GLU 364.A OE1 no hydrogen 2.809 N/A ARG 360.A NH2 LEU 422.A O no hydrogen 3.451 N/A ALA 361.A N ILE 357.A O no hydrogen 2.956 N/A LEU 362.A N LEU 358.A O no hydrogen 2.743 N/A TYR 363.A N HIS 359.A O no hydrogen 2.661 N/A GLU 364.A N ARG 360.A O no hydrogen 2.909 N/A LEU 365.A N ALA 361.A O no hydrogen 3.007 N/A SER 366.A N LEU 362.A O no hydrogen 3.057 N/A VAL 367.A N TYR 363.A O no hydrogen 3.031 N/A ILE 368.A N GLU 364.A O no hydrogen 2.812 N/A GLU 369.A N LEU 365.A O no hydrogen 2.891 N/A ARG 370.A N SER 366.A O no hydrogen 3.111 N/A MET 371.A N VAL 367.A O no hydrogen 3.102 N/A PHE 373.A N ILE 368.A O no hydrogen 2.707 N/A PHE 377.A N PHE 373.A O no hydrogen 3.297 N/A LEU 378.A N PRO 374.A O no hydrogen 2.993 N/A ILE 379.A N GLY 375.A O no hydrogen 3.078 N/A VAL 380.A N TYR 376.A O no hydrogen 3.288 N/A GLN 381.A N PHE 377.A O no hydrogen 2.831 N/A ASP 382.A N LEU 378.A O no hydrogen 2.920 N/A TYR 383.A N ILE 379.A O no hydrogen 3.385 N/A ILE 384.A N VAL 380.A O no hydrogen 3.258 N/A ASN 385.A N GLN 381.A O no hydrogen 3.005 N/A ASN 385.A ND2 VAL 410.A O no hydrogen 3.543 N/A TRP 386.A N ASP 382.A O no hydrogen 2.961 N/A ALA 387.A N TYR 383.A O no hydrogen 3.114 N/A ARG 388.A N ILE 384.A O no hydrogen 3.101 N/A ARG 388.A NH1 GLY 411.A O no hydrogen 2.718 N/A ARG 388.A NH2 GLY 411.A O no hydrogen 2.957 N/A GLY 389.A N ASN 385.A O no hydrogen 3.359 N/A HIS 390.A N ALA 387.A O no hydrogen 3.410 N/A VAL 392.A N ALA 387.A O no hydrogen 2.961 N/A SER 393.A OG ASP 603.A OD1 no hydrogen 2.962 N/A SER 393.A OG ASP 603.A OD2 no hydrogen 3.208 N/A GLY 395.A N ASP 441.A O no hydrogen 2.944 N/A ARG 398.A NE TYR 795.A OH no hydrogen 2.703 N/A ARG 398.A NH2 TYR 795.A OH no hydrogen 2.943 N/A GLY 403.A N SER 400.A O no hydrogen 3.021 N/A SER 404.A N ALA 401.A O no hydrogen 3.217 N/A SER 404.A OG GLU 364.A OE2 no hydrogen 2.599 N/A LEU 405.A N GLU 364.A OE1 no hydrogen 3.076 N/A VAL 406.A N GLU 364.A OE2 no hydrogen 3.034 N/A ALA 407.A N SER 404.A OG no hydrogen 3.256 N/A TYR 408.A N SER 404.A O no hydrogen 3.105 N/A ALA 409.A N LEU 405.A O no hydrogen 2.595 N/A VAL 410.A N VAL 406.A O no hydrogen 2.868 N/A GLY 411.A N TYR 408.A O no hydrogen 3.401 N/A ILE 412.A N ALA 407.A O no hydrogen 2.914 N/A THR 413.A N ALA 407.A O no hydrogen 3.213 N/A ASN 414.A N PRO 396.A O no hydrogen 2.531 N/A ASN 414.A ND2 THR 413.A O no hydrogen 3.525 N/A LEU 418.A N ASP 416.A OD1 no hydrogen 3.107 N/A ARG 419.A N ASP 416.A OD1 no hydrogen 3.317 N/A PHE 420.A N ASP 416.A O no hydrogen 3.304 N/A LEU 422.A N PRO 417.A O no hydrogen 2.976 N/A GLU 425.A N GLU 425.A OE1 no hydrogen 2.593 N/A ARG 426.A N LEU 423.A O no hydrogen 3.324 N/A ARG 426.A NH1 ARG 426.A O no hydrogen 3.296 N/A ARG 426.A NH2 GLN 718.A OE1 no hydrogen 2.681 N/A PHE 427.A N PHE 424.A O no hydrogen 2.964 N/A LEU 428.A N PHE 424.A O no hydrogen 2.983 N/A GLU 431.A N ASN 429.A OD1 no hydrogen 3.187 N/A ARG 432.A N ASN 429.A O no hydrogen 3.200 N/A ILE 438.A N TYR 376.A OH no hydrogen 3.032 N/A THR 440.A N ASP 592.A O no hydrogen 3.022 N/A PHE 442.A N LEU 594.A O no hydrogen 2.844 N/A SER 443.A N SER 393.A O no hydrogen 3.103 N/A ARG 445.A NH2 GLU 604.A OE2 no hydrogen 3.025 N/A GLU 446.A N SER 443.A O no hydrogen 3.028 N/A ARG 447.A N SER 443.A O no hydrogen 2.953 N/A ARG 447.A NH1 PHE 593.A O no hydrogen 3.122 N/A ARG 449.A N GLU 446.A O no hydrogen 2.824 N/A ARG 449.A NH1 GLU 446.A OE1 no hydrogen 2.876 N/A ARG 449.A NH2 HIS 390.A O no hydrogen 2.715 N/A VAL 450.A N ARG 447.A O no hydrogen 2.980 N/A ILE 451.A N ARG 447.A O no hydrogen 3.174 N/A GLN 452.A N ASP 448.A O no hydrogen 2.862 N/A GLN 452.A NE2 GLU 456.A OE2 no hydrogen 2.962 N/A TYR 453.A N ARG 449.A O no hydrogen 2.866 N/A TYR 453.A OH ASP 382.A OD1 no hydrogen 3.358 N/A TYR 453.A OH ASP 382.A OD2 no hydrogen 2.915 N/A VAL 454.A N VAL 450.A O no hydrogen 3.104 N/A ARG 455.A N ILE 451.A O no hydrogen 2.828 N/A GLU 456.A N GLN 452.A O no hydrogen 3.084 N/A ARG 457.A N TYR 453.A O no hydrogen 2.831 N/A TYR 458.A N VAL 454.A O no hydrogen 2.730 N/A GLY 459.A N ARG 455.A O no hydrogen 3.033 N/A LYS 462.A N GLY 459.A O no hydrogen 3.112 N/A ALA 464.A N VAL 554.A O no hydrogen 3.261 N/A GLN 465.A N PRO 574.A O no hydrogen 2.897 N/A GLN 465.A NE2 HIS 549.A O no hydrogen 2.931 N/A GLY 467.A N TYR 578.A O no hydrogen 2.981 N/A THR 468.A N SER 547.A O no hydrogen 2.840 N/A SER 471.A OG ASN 543.A OD1 no hydrogen 3.496 N/A SER 474.A OG LYS 507.A O no hydrogen 2.949 N/A SER 474.A OG GLU 540.A OE2 no hydrogen 2.627 N/A ALA 477.A N ALA 473.A O no hydrogen 2.705 N/A LEU 478.A N SER 474.A O no hydrogen 3.205 N/A LYS 479.A N LYS 475.A O no hydrogen 3.169 N/A LYS 479.A NZ GLU 493.A OE1 no hydrogen 3.359 N/A ASP 480.A N ALA 476.A O no hydrogen 3.017 N/A VAL 481.A N ALA 477.A O no hydrogen 3.115 N/A ALA 482.A N LEU 478.A O no hydrogen 2.961 N/A ARG 483.A N LYS 479.A O no hydrogen 2.939 N/A VAL 484.A N ASP 480.A O no hydrogen 3.510 N/A TYR 485.A N VAL 481.A O no hydrogen 3.124 N/A TYR 485.A OH GLN 531.A OE1 no hydrogen 3.347 N/A GLY 486.A N ARG 483.A O no hydrogen 2.905 N/A ILE 487.A N ALA 482.A O no hydrogen 3.225 N/A ALA 492.A N PRO 488.A O no hydrogen 3.389 N/A GLU 493.A N HIS 489.A O no hydrogen 2.919 N/A GLU 494.A N LYS 490.A O no hydrogen 3.151 N/A ALA 496.A N ALA 492.A O no hydrogen 3.049 N/A LYS 497.A N GLU 493.A O no hydrogen 3.291 N/A LEU 498.A N LEU 495.A O no hydrogen 3.455 N/A LYS 505.A N PHE 503.A O no hydrogen 2.706 N/A LYS 507.A N PRO 500.A O no hydrogen 2.931 N/A LEU 509.A N GLU 540.A OE2 no hydrogen 3.014 N/A GLU 514.A N GLU 511.A O no hydrogen 2.629 N/A GLU 518.A N GLU 516.A OE2 no hydrogen 2.972 N/A LEU 519.A N GLU 516.A O no hydrogen 3.171 N/A ARG 520.A NH1 PRO 517.A O no hydrogen 2.919 N/A ALA 521.A N GLU 518.A O no hydrogen 3.422 N/A GLU 522.A N GLU 518.A O no hydrogen 2.994 N/A GLU 524.A N ALA 521.A O no hydrogen 2.216 N/A LYS 525.A NZ GLU 522.A OE1 no hydrogen 2.887 N/A ARG 528.A N ASP 526.A OD1 no hydrogen 3.441 N/A VAL 532.A N ARG 528.A O no hydrogen 3.370 N/A ILE 533.A N ILE 529.A O no hydrogen 3.124 N/A GLU 534.A N ARG 530.A O no hydrogen 3.366 N/A VAL 535.A N GLN 531.A O no hydrogen 2.723 N/A ALA 536.A N VAL 532.A O no hydrogen 2.986 N/A MET 537.A N ILE 533.A O no hydrogen 3.343 N/A ARG 538.A N GLU 534.A O no hydrogen 3.128 N/A ARG 538.A N VAL 535.A O no hydrogen 2.968 N/A LEU 539.A N VAL 535.A O no hydrogen 2.964 N/A LEU 542.A N GLU 540.A O no hydrogen 2.163 N/A ARG 544.A NH2 ASP 480.A OD2 no hydrogen 2.229 N/A SER 547.A N THR 468.A O no hydrogen 3.034 N/A HIS 549.A N ILE 466.A O no hydrogen 2.891 N/A VAL 553.A N MET 591.A O no hydrogen 3.116 N/A VAL 554.A N ALA 464.A O no hydrogen 2.722 N/A ILE 555.A N LEU 589.A O no hydrogen 3.117 N/A ALA 556.A N LYS 462.A O no hydrogen 2.872 N/A LEU 560.A N ASP 461.A O no hydrogen 2.740 N/A ASP 562.A N PRO 559.A O no hydrogen 2.868 N/A LEU 563.A N LEU 560.A O no hydrogen 2.909 N/A VAL 564.A N LEU 560.A O no hydrogen 2.847 N/A LEU 566.A N SER 105.A OG no hydrogen 3.227 N/A MET 567.A N VAL 575.A O no hydrogen 2.568 N/A ARG 568.A NH1 GLY 572.A O no hydrogen 2.728 N/A ASP 569.A N ARG 573.A O no hydrogen 2.902 N/A GLY 572.A N ASP 569.A O no hydrogen 3.124 N/A ARG 573.A N ASP 569.A OD1 no hydrogen 2.659 N/A ARG 573.A NE GLU 571.A OE1 no hydrogen 3.245 N/A ARG 573.A NH1 ASP 448.A OD1 no hydrogen 3.330 N/A ARG 573.A NH1 GLN 465.A OE1 no hydrogen 2.796 N/A ARG 573.A NH2 ASP 448.A OD1 no hydrogen 3.510 N/A ARG 573.A NH2 ASP 448.A OD2 no hydrogen 2.774 N/A VAL 575.A N MET 567.A O no hydrogen 2.863 N/A THR 576.A N GLN 465.A O no hydrogen 2.814 N/A THR 576.A OG1 GLN 465.A O no hydrogen 3.249 N/A GLN 577.A N PRO 565.A O no hydrogen 2.817 N/A GLN 577.A NE2 LEU 566.A O no hydrogen 2.935 N/A TYR 578.A OH TYR 97.A OH no hydrogen 2.964 N/A GLY 581.A N ASP 579.A OD2 no hydrogen 3.154 N/A VAL 583.A N ASP 579.A O no hydrogen 3.024 N/A GLU 584.A N MET 580.A O no hydrogen 3.110 N/A ALA 585.A N GLY 581.A O no hydrogen 2.661 N/A LEU 586.A N VAL 583.A O no hydrogen 3.034 N/A GLY 587.A N GLU 584.A O no hydrogen 3.076 N/A LYS 590.A NZ ASP 437.A OD2 no hydrogen 3.024 N/A LYS 590.A NZ GLU 584.A OE2 no hydrogen 3.437 N/A MET 591.A N VAL 553.A O no hydrogen 2.934 N/A PHE 593.A N ALA 551.A O no hydrogen 2.935 N/A LEU 594.A N THR 440.A O no hydrogen 2.936 N/A LEU 596.A N PHE 442.A O no hydrogen 3.100 N/A THR 600.A OG1 ASP 444.A OD2 no hydrogen 2.443 N/A PHE 601.A N ARG 597.A O no hydrogen 2.935 N/A LEU 602.A N THR 598.A O no hydrogen 2.859 N/A ASP 603.A N LEU 599.A O no hydrogen 3.139 N/A GLU 604.A N THR 600.A O no hydrogen 3.498 N/A ALA 605.A N PHE 601.A O no hydrogen 3.053 N/A ARG 606.A N LEU 602.A O no hydrogen 3.245 N/A ARG 606.A NH2 ASP 603.A OD1 no hydrogen 3.414 N/A ARG 607.A N ASP 603.A O no hydrogen 2.931 N/A ARG 607.A NH1 GLU 604.A OE1 no hydrogen 2.712 N/A ILE 608.A N GLU 604.A O no hydrogen 2.781 N/A VAL 609.A N ALA 605.A O no hydrogen 2.838 N/A LYS 610.A N ARG 606.A O no hydrogen 3.050 N/A GLU 611.A N ARG 607.A O no hydrogen 3.157 N/A SER 612.A N ILE 608.A O no hydrogen 2.790 N/A SER 612.A OG GLU 812.A OE1 no hydrogen 2.109 N/A LYS 613.A N VAL 609.A O no hydrogen 2.902 N/A GLY 614.A N LYS 610.A O no hydrogen 2.744 N/A TYR 619.A OH LEU 602.A O no hydrogen 2.665 N/A ARG 621.A N ASP 618.A O no hydrogen 2.790 N/A LEU 622.A N TYR 619.A O no hydrogen 3.489 N/A ASP 626.A N TYR 800.A OH no hydrogen 3.052 N/A THR 629.A N ASP 626.A OD2 no hydrogen 3.144 N/A THR 629.A OG1 ASP 626.A OD2 no hydrogen 2.656 N/A GLU 631.A N PRO 627.A O no hydrogen 3.013 N/A LEU 632.A N THR 629.A O no hydrogen 3.166 N/A LEU 633.A N THR 629.A O no hydrogen 3.184 N/A SER 634.A N PHE 630.A O no hydrogen 2.765 N/A SER 634.A OG PHE 630.A O no hydrogen 3.068 N/A SER 634.A OG PRO 658.A O no hydrogen 3.501 N/A ARG 635.A N GLU 631.A O no hydrogen 2.978 N/A ARG 635.A NH1 GLU 637.A OE2 no hydrogen 3.217 N/A GLY 636.A N LEU 633.A O no hydrogen 2.846 N/A GLU 637.A N LEU 632.A O no hydrogen 3.219 N/A THR 638.A OG1 THR 650.A OG1 no hydrogen 2.584 N/A VAL 641.A N THR 638.A O no hydrogen 3.018 N/A LEU 644.A N VAL 641.A O no hydrogen 3.268 N/A THR 650.A N SER 646.A O no hydrogen 2.856 N/A THR 650.A OG1 THR 638.A OG1 no hydrogen 2.584 N/A THR 650.A OG1 SER 646.A O no hydrogen 3.103 N/A ALA 651.A N GLY 647.A O no hydrogen 3.265 N/A THR 652.A N GLY 648.A O no hydrogen 2.963 N/A THR 652.A OG1 GLY 648.A O no hydrogen 3.053 N/A VAL 653.A N MET 649.A O no hydrogen 2.983 N/A ARG 654.A N THR 650.A O no hydrogen 3.238 N/A GLY 655.A N ALA 651.A O no hydrogen 2.990 N/A LEU 656.A N THR 652.A O no hydrogen 2.760 N/A LYS 657.A N VAL 653.A O no hydrogen 2.863 N/A LYS 657.A NZ SER 634.A O no hydrogen 2.897 N/A ARG 659.A N ASP 663.A OD2 no hydrogen 2.800 N/A ARG 660.A N ASP 663.A OD2 no hydrogen 3.108 N/A GLU 662.A N GLU 662.A OE1 no hydrogen 2.665 N/A ASP 663.A N ARG 660.A O no hydrogen 3.058 N/A ILE 665.A N LEU 661.A O no hydrogen 3.095 N/A ALA 666.A N GLU 662.A O no hydrogen 3.091 N/A LEU 667.A N ASP 663.A O no hydrogen 2.859 N/A VAL 668.A N ILE 664.A O no hydrogen 2.918 N/A SER 669.A N ILE 665.A O no hydrogen 3.134 N/A SER 669.A OG ILE 665.A O no hydrogen 2.786 N/A LEU 670.A N ALA 666.A O no hydrogen 2.996 N/A TYR 671.A N LEU 667.A O no hydrogen 2.959 N/A ARG 672.A NE SER 669.A O no hydrogen 3.147 N/A MET 676.A N ARG 672.A O no hydrogen 2.537 N/A HIS 678.A N PRO 675.A O no hydrogen 2.678 N/A ILE 679.A N MET 676.A O no hydrogen 3.237 N/A THR 681.A OG1 HIS 678.A O no hydrogen 3.434 N/A TYR 682.A N HIS 678.A O no hydrogen 3.053 N/A ILE 683.A N ILE 679.A O no hydrogen 2.817 N/A ARG 684.A N PRO 680.A O no hydrogen 3.037 N/A ARG 685.A N THR 681.A O no hydrogen 3.116 N/A ARG 685.A NE GLU 690.A OE2 no hydrogen 2.898 N/A ARG 685.A NH1 TYR 712.A O no hydrogen 2.863 N/A HIS 686.A N TYR 682.A O no hydrogen 2.725 N/A HIS 686.A ND1 TYR 712.A OH no hydrogen 2.888 N/A HIS 687.A N ILE 683.A O no hydrogen 2.700 N/A GLY 688.A N ARG 685.A O no hydrogen 3.094 N/A GLN 689.A N ARG 684.A O no hydrogen 3.376 N/A GLN 689.A NE2 HIS 687.A O no hydrogen 3.326 N/A TYR 694.A OH ASP 709.A OD2 no hydrogen 2.892 N/A PHE 697.A N TYR 694.A O no hydrogen 3.055 N/A HIS 699.A N GLU 771.A OE1 no hydrogen 2.999 N/A ALA 700.A N PHE 697.A O no hydrogen 3.134 N/A TYR 703.A N ALA 700.A O no hydrogen 2.818 N/A LEU 704.A N ALA 700.A O no hydrogen 3.006 N/A ARG 705.A N GLU 701.A O no hydrogen 2.999 N/A ILE 707.A N LEU 704.A O no hydrogen 3.198 N/A LEU 708.A N LEU 704.A O no hydrogen 2.836 N/A ASP 709.A N ARG 705.A O no hydrogen 2.780 N/A THR 711.A N LEU 708.A O no hydrogen 3.179 N/A TYR 712.A N ASP 709.A O no hydrogen 2.931 N/A TYR 712.A OH HIS 686.A ND1 no hydrogen 2.888 N/A GLY 713.A N LEU 708.A O no hydrogen 2.635 N/A ILE 714.A N THR 711.A O no hydrogen 3.202 N/A GLN 718.A NE2 GLY 786.A O no hydrogen 3.192 N/A GLU 719.A N GLU 719.A OE1 no hydrogen 2.686 N/A GLU 719.A N PHE 787.A O no hydrogen 3.312 N/A GLN 720.A N TYR 717.A O no hydrogen 2.975 N/A GLN 720.A NE2 ILE 714.A O no hydrogen 3.412 N/A ILE 721.A N TYR 717.A O no hydrogen 3.368 N/A MET 722.A N GLN 718.A O no hydrogen 2.979 N/A GLN 723.A N GLU 719.A O no hydrogen 3.023 N/A ILE 724.A N GLN 720.A O no hydrogen 3.066 N/A ALA 725.A N ILE 721.A O no hydrogen 2.914 N/A SER 726.A N MET 722.A O no hydrogen 2.826 N/A SER 726.A OG TYR 731.A O no hydrogen 2.692 N/A GLN 727.A N GLN 723.A O no hydrogen 2.833 N/A GLN 727.A N ILE 724.A O no hydrogen 3.264 N/A VAL 728.A N ILE 724.A O no hydrogen 2.861 N/A ALA 729.A N ALA 725.A O no hydrogen 3.332 N/A SER 732.A N GLU 735.A OE1 no hydrogen 3.215 N/A SER 732.A OG GLU 431.A OE2 no hydrogen 1.748 N/A GLY 734.A N SER 732.A OG no hydrogen 3.108 N/A ALA 736.A N SER 732.A O no hydrogen 2.918 N/A ASP 737.A N LEU 733.A O no hydrogen 3.364 N/A LEU 738.A N GLY 734.A O no hydrogen 3.408 N/A LEU 739.A N GLU 735.A O no hydrogen 2.858 N/A ARG 740.A N ALA 736.A O no hydrogen 2.989 N/A ARG 740.A NH1 ASP 737.A OD1 no hydrogen 2.540 N/A ARG 741.A N ASP 737.A O no hydrogen 3.048 N/A ARG 741.A NE ASP 737.A OD2 no hydrogen 3.139 N/A ARG 741.A NH2 ASP 737.A OD2 no hydrogen 2.801 N/A ALA 742.A N LEU 738.A O no hydrogen 2.940 N/A MET 743.A N LEU 739.A O no hydrogen 2.782 N/A GLY 744.A N ARG 740.A O no hydrogen 3.111 N/A LYS 745.A N ARG 741.A O no hydrogen 2.870 N/A LYS 746.A N ALA 742.A O no hydrogen 3.217 N/A LYS 746.A NZ ASN 784.A OD1 no hydrogen 2.872 N/A GLN 752.A N GLU 749.A O no hydrogen 3.120 N/A LYS 753.A N GLU 750.A O no hydrogen 3.297 N/A ARG 755.A N MET 751.A O no hydrogen 3.214 N/A ARG 755.A NH1 ASN 773.A O no hydrogen 3.383 N/A ARG 755.A NH2 ASN 773.A O no hydrogen 3.391 N/A GLU 756.A N GLN 752.A O no hydrogen 3.420 N/A ARG 757.A N LYS 753.A O no hydrogen 3.228 N/A ARG 757.A NH2 GLU 735.A OE1 no hydrogen 3.220 N/A PHE 758.A N HIS 754.A O no hydrogen 2.665 N/A VAL 759.A N ARG 755.A O no hydrogen 2.990 N/A ARG 760.A N GLU 756.A O no hydrogen 3.015 N/A GLY 761.A N ARG 757.A O no hydrogen 3.336 N/A ALA 762.A N PHE 758.A O no hydrogen 2.784 N/A LYS 763.A N VAL 759.A O no hydrogen 2.831 N/A GLU 764.A N ARG 760.A O no hydrogen 3.125 N/A ARG 765.A N ALA 762.A O no hydrogen 3.242 N/A GLY 766.A N ALA 762.A O no hydrogen 2.827 N/A ASN 773.A N GLU 769.A O no hydrogen 3.288 N/A LEU 775.A N GLU 771.A O no hydrogen 2.608 N/A PHE 776.A N ALA 772.A O no hydrogen 2.817 N/A ASP 777.A N ASN 773.A O no hydrogen 3.312 N/A MET 778.A N ARG 774.A O no hydrogen 3.007 N/A LEU 779.A N LEU 775.A O no hydrogen 2.960 N/A GLU 780.A N PHE 776.A O no hydrogen 2.935 N/A ALA 781.A N ASP 777.A O no hydrogen 3.211 N/A PHE 782.A N MET 778.A O no hydrogen 3.075 N/A ALA 783.A N LEU 779.A O no hydrogen 2.806 N/A TYR 785.A N PHE 782.A O no hydrogen 3.387 N/A ASN 788.A ND2 GLU 719.A OE2 no hydrogen 1.966 N/A ASN 788.A ND2 SER 790.A OG no hydrogen 2.926 N/A LYS 789.A N GLU 719.A OE1 no hydrogen 2.848 N/A LYS 789.A N GLU 719.A OE2 no hydrogen 2.356 N/A SER 790.A OG GLY 399.A O no hydrogen 3.326 N/A ALA 792.A N ASN 788.A O no hydrogen 3.166 N/A ALA 793.A N LYS 789.A O no hydrogen 2.654 N/A ALA 794.A N SER 790.A O no hydrogen 3.029 N/A TYR 795.A N HIS 791.A O no hydrogen 3.101 N/A TYR 795.A OH ASP 441.A OD2 no hydrogen 2.980 N/A SER 796.A N ALA 792.A O no hydrogen 2.848 N/A SER 796.A OG ALA 792.A O no hydrogen 2.640 N/A LEU 797.A N ALA 793.A O no hydrogen 3.220 N/A LEU 797.A N ALA 794.A O no hydrogen 3.264 N/A LEU 798.A N TYR 795.A O no hydrogen 2.810 N/A SER 799.A N TYR 795.A O no hydrogen 3.294 N/A SER 799.A OG PHE 642.A O no hydrogen 2.904 N/A SER 799.A OG GLN 643.A OE1 no hydrogen 3.290 N/A TYR 800.A N SER 796.A O no hydrogen 2.897 N/A TYR 800.A OH PRO 623.A O no hydrogen 2.543 N/A GLN 801.A N LEU 797.A O no hydrogen 2.909 N/A THR 802.A N LEU 798.A O no hydrogen 2.862 N/A THR 802.A OG1 LEU 798.A O no hydrogen 3.107 N/A ALA 803.A N SER 799.A O no hydrogen 2.863 N/A TYR 804.A N TYR 800.A O no hydrogen 2.622 N/A VAL 805.A N GLN 801.A O no hydrogen 3.050 N/A LYS 806.A N THR 802.A O no hydrogen 3.167 N/A LYS 806.A NZ GLU 637.A O no hydrogen 2.918 N/A ALA 807.A N ALA 803.A O no hydrogen 2.768 N/A HIS 808.A N TYR 804.A O no hydrogen 3.035 N/A HIS 808.A NE2 ASP 626.A OD1 no hydrogen 3.210 N/A HIS 808.A NE2 ASP 626.A OD2 no hydrogen 2.846 N/A TYR 809.A N VAL 805.A O no hydrogen 2.704 N/A MET 814.A N PRO 810.A O no hydrogen 3.186 N/A ALA 815.A N VAL 811.A O no hydrogen 2.880 N/A ALA 816.A N GLU 812.A O no hydrogen 2.727 N/A ALA 816.A N PHE 813.A O no hydrogen 3.110 N/A LEU 817.A N PHE 813.A O no hydrogen 2.942 N/A LEU 818.A N MET 814.A O no hydrogen 2.940 N/A SER 819.A N ALA 815.A O no hydrogen 2.897 N/A SER 819.A OG ASP 853.A OD2 no hydrogen 1.592 N/A VAL 820.A N ALA 816.A O no hydrogen 2.830 N/A GLU 821.A N LEU 818.A O no hydrogen 3.167 N/A ARG 822.A N SER 819.A O no hydrogen 3.248 N/A ARG 822.A NE ASP 853.A OD2 no hydrogen 2.633 N/A ARG 822.A NH1 HIS 823.A NE2 no hydrogen 3.358 N/A ARG 822.A NH2 ASP 853.A OD2 no hydrogen 2.778 N/A ASP 824.A N GLU 821.A O no hydrogen 3.175 N/A LYS 827.A N ASP 824.A OD1 no hydrogen 2.998 N/A VAL 828.A N ASP 824.A O no hydrogen 2.863 N/A ALA 829.A N SER 825.A O no hydrogen 3.041 N/A GLU 830.A N ASP 826.A O no hydrogen 3.001 N/A TYR 831.A N LYS 827.A O no hydrogen 2.697 N/A ILE 832.A N VAL 828.A O no hydrogen 2.952 N/A ARG 833.A N ALA 829.A O no hydrogen 3.080 N/A ASP 834.A N GLU 830.A O no hydrogen 2.931 N/A ALA 835.A N TYR 831.A O no hydrogen 2.942 N/A ARG 836.A N ILE 832.A O no hydrogen 2.851 N/A ARG 836.A NE VAL 842.A O no hydrogen 3.349 N/A ARG 836.A NH2 VAL 842.A O no hydrogen 3.056 N/A ALA 837.A N ARG 833.A O no hydrogen 3.264 N/A LEU 843.A N ILE 861.A O no hydrogen 2.763 N/A ASP 846.A N SER 850.A OG no hydrogen 2.774 N/A VAL 847.A N ALA 917.A O no hydrogen 2.884 N/A ASN 848.A N ASP 846.A OD1 no hydrogen 3.006 N/A ASN 848.A ND2 PHE 889.A O no hydrogen 3.449 N/A ARG 849.A N ASP 846.A O no hydrogen 3.128 N/A ARG 849.A N ASP 846.A OD1 no hydrogen 2.796 N/A ARG 849.A NH2 GLU 860.A OE1 no hydrogen 2.985 N/A SER 850.A N ASP 846.A O no hydrogen 2.787 N/A SER 850.A OG ASP 846.A O no hydrogen 3.183 N/A SER 850.A OG PHE 863.A O no hydrogen 2.794 N/A PHE 854.A N ASP 853.A OD1 no hydrogen 3.041 N/A LYS 855.A N LEU 862.A O no hydrogen 2.931 N/A VAL 857.A N GLU 860.A O no hydrogen 3.160 N/A GLU 860.A N VAL 857.A O no hydrogen 3.089 N/A ILE 861.A N PRO 841.A O no hydrogen 2.966 N/A LEU 862.A N LYS 855.A O no hydrogen 2.717 N/A PHE 863.A N LEU 843.A O no hydrogen 3.076 N/A LEU 865.A N GLY 851.A O no hydrogen 3.205 N/A SER 866.A N PHE 852.A O no hydrogen 3.241 N/A SER 866.A OG PHE 852.A O no hydrogen 2.623 N/A VAL 868.A N LEU 865.A O no hydrogen 3.071 N/A LYS 869.A N ALA 979.A O no hydrogen 2.763 N/A ARG 877.A N GLU 873.A O no hydrogen 3.229 N/A ALA 878.A N MET 874.A O no hydrogen 2.854 N/A ILE 879.A N ALA 875.A O no hydrogen 2.814 N/A LEU 880.A N ALA 876.A O no hydrogen 3.187 N/A GLU 881.A N ARG 877.A O no hydrogen 2.774 N/A GLU 882.A N ALA 878.A O no hydrogen 2.818 N/A ARG 883.A N ILE 879.A O no hydrogen 2.925 N/A ARG 883.A NH1 VAL 847.A O no hydrogen 2.827 N/A ARG 883.A NH1 SER 850.A O no hydrogen 2.937 N/A ARG 883.A NH2 SER 850.A O no hydrogen 3.364 N/A GLU 884.A N GLU 881.A O no hydrogen 3.117 N/A ARG 885.A N GLU 881.A O no hydrogen 3.150 N/A ARG 885.A NE GLU 882.A OE1 no hydrogen 3.500 N/A ARG 885.A NH2 GLU 882.A OE1 no hydrogen 3.467 N/A GLY 886.A N GLU 882.A O no hydrogen 3.136 N/A PHE 889.A N ASN 848.A OD1 no hydrogen 2.733 N/A LYS 890.A N ASP 894.A OD1 no hydrogen 2.825 N/A SER 891.A OG GLU 958.A OE1 no hydrogen 2.649 N/A SER 891.A OG GLU 958.A OE2 no hydrogen 3.066 N/A ASP 894.A N SER 891.A OG no hydrogen 3.221 N/A PHE 895.A N SER 891.A O no hydrogen 3.019 N/A LEU 896.A N LEU 892.A O no hydrogen 2.993 N/A LYS 897.A N GLY 893.A O no hydrogen 3.004 N/A LYS 897.A NZ GLU 955.A OE2 no hydrogen 2.879 N/A ARG 898.A N ASP 894.A O no hydrogen 3.327 N/A ARG 898.A NE ASP 894.A OD2 no hydrogen 3.372 N/A ARG 898.A NH1 GLU 882.A OE2 no hydrogen 3.333 N/A ARG 898.A NH1 GLY 887.A O no hydrogen 3.316 N/A ARG 898.A NH2 GLY 887.A O no hydrogen 2.955 N/A LEU 899.A N PHE 895.A O no hydrogen 3.037 N/A VAL 903.A N PRO 900.A O no hydrogen 3.033 N/A VAL 904.A N PRO 900.A O no hydrogen 3.269 N/A ARG 907.A NH2 ASN 870.A OD1 no hydrogen 3.554 N/A ALA 908.A N ASN 905.A OD1 no hydrogen 2.798 N/A LEU 909.A N ASN 905.A O no hydrogen 2.862 N/A GLU 910.A N LYS 906.A O no hydrogen 3.028 N/A SER 911.A N ARG 907.A O no hydrogen 3.342 N/A LEU 912.A N ALA 908.A O no hydrogen 3.103 N/A VAL 913.A N LEU 909.A O no hydrogen 3.069 N/A LYS 914.A N GLU 910.A O no hydrogen 3.039 N/A LYS 914.A NZ GLU 978.A OE2 no hydrogen 2.866 N/A ALA 915.A N SER 911.A O no hydrogen 2.710 N/A GLY 916.A N VAL 913.A O no hydrogen 2.990 N/A ALA 917.A N LEU 912.A O no hydrogen 3.058 N/A ASP 919.A N GLY 916.A O no hydrogen 3.306 N/A PHE 921.A N LEU 918.A O no hydrogen 2.928 N/A GLY 922.A N ASP 919.A O no hydrogen 3.273 N/A ARG 924.A NE ASP 919.A OD1 no hydrogen 2.912 N/A ARG 924.A NE ASP 919.A OD2 no hydrogen 2.999 N/A ARG 924.A NH2 ASP 919.A OD2 no hydrogen 2.900 N/A ARG 926.A NE LEU 961.A O no hydrogen 3.271 N/A ARG 926.A NH2 LEU 961.A O no hydrogen 3.497 N/A LEU 927.A N ASP 923.A O no hydrogen 2.854 N/A LEU 928.A N ARG 924.A O no hydrogen 2.866 N/A ALA 929.A N ALA 925.A O no hydrogen 3.211 N/A SER 930.A N ARG 926.A O no hydrogen 2.964 N/A SER 930.A OG ARG 926.A O no hydrogen 2.648 N/A SER 930.A OG VAL 962.A O no hydrogen 3.482 N/A LEU 931.A N LEU 928.A O no hydrogen 3.465 N/A LEU 934.A N SER 930.A O no hydrogen 3.199 N/A LEU 935.A N LEU 931.A O no hydrogen 2.800 N/A ARG 936.A N GLU 932.A O no hydrogen 3.043 N/A TRP 937.A N PRO 933.A O no hydrogen 2.937 N/A TRP 937.A NE1 VAL 956.A O no hydrogen 3.316 N/A ALA 938.A N LEU 934.A O no hydrogen 2.783 N/A ALA 939.A N LEU 935.A O no hydrogen 2.909 N/A GLU 940.A N ARG 936.A O no hydrogen 2.957 N/A THR 941.A N TRP 937.A O no hydrogen 2.965 N/A THR 941.A N ALA 938.A O no hydrogen 3.277 N/A THR 941.A OG1 TRP 937.A O no hydrogen 2.969 N/A ARG 942.A NH1 LYS 897.A O no hydrogen 2.807 N/A ARG 942.A NH2 LEU 896.A O no hydrogen 2.970 N/A ARG 944.A N GLU 940.A O no hydrogen 3.287 N/A ARG 944.A NH1 ALA 954.A O no hydrogen 2.982 N/A GLY 945.A N THR 941.A O no hydrogen 2.830 N/A ARG 946.A N ARG 942.A O no hydrogen 2.649 N/A SER 947.A N ARG 944.A O no hydrogen 3.227 N/A THR 971.A N ASP 968.A OD2 no hydrogen 3.271 N/A MET 972.A N ASP 968.A O no hydrogen 2.925 N/A LEU 973.A N GLU 969.A O no hydrogen 2.792 N/A ARG 974.A N ILE 970.A O no hydrogen 2.826 N/A TYR 975.A N THR 971.A O no hydrogen 3.065 N/A GLU 976.A N MET 972.A O no hydrogen 3.144 N/A LYS 977.A N LEU 973.A O no hydrogen 3.259 N/A LYS 977.A NZ GLU 1044.A OE2 no hydrogen 3.077 N/A LYS 977.A NZ ASP 1045.A OD1 no hydrogen 1.751 N/A GLU 978.A N ARG 974.A O no hydrogen 3.226 N/A ALA 979.A N TYR 975.A O no hydrogen 2.972 N/A ALA 979.A N GLU 976.A O no hydrogen 3.031 N/A LEU 980.A N GLU 976.A O no hydrogen 2.688 N/A GLY 981.A N LYS 977.A O no hydrogen 2.569 N/A LEU 990.A N HIS 987.A O no hydrogen 2.295 N/A ARG 991.A N PRO 988.A O no hydrogen 3.184 N/A ARG 996.A NH2 CYS 1001.A O no hydrogen 3.365 N/A GLU 997.A N PRO 993.A O no hydrogen 3.233 N/A VAL 998.A N LEU 995.A O no hydrogen 3.133 N/A ALA 999.A N LEU 995.A O no hydrogen 3.119 N/A SER 1000.A OG LEU 1020.A O no hydrogen 2.067 N/A CYS 1001.A SG THR 1002.A O no hydrogen 3.958 N/A CYS 1001.A SG GLU 1005.A OE1 no hydrogen 3.098 N/A THR 1002.A OG1 THR 1036.A OG1 no hydrogen 2.584 N/A ILE 1003.A N ASP 1034.A OD2 no hydrogen 3.328 N/A GLU 1005.A N THR 1002.A O no hydrogen 1.931 N/A LEU 1006.A N ILE 1003.A O no hydrogen 3.414 N/A PHE 1009.A N GLU 1005.A O no hydrogen 2.709 N/A VAL 1010.A N LEU 1006.A O no hydrogen 2.782 N/A ARG 1011.A N SER 1007.A O no hydrogen 3.221 N/A LYS 1016.A NZ GLU 1055.A OE2 no hydrogen 3.547 N/A VAL 1019.A N ALA 1052.A O no hydrogen 2.800 N/A LEU 1021.A N VAL 1050.A O no hydrogen 2.823 N/A GLY 1023.A N LEU 1048.A O no hydrogen 3.184 N/A MET 1024.A N SER 1033.A O no hydrogen 2.972 N/A VAL 1025.A N ILE 1046.A O no hydrogen 3.354 N/A GLU 1026.A N THR 1031.A O no hydrogen 3.004 N/A THR 1031.A OG1 LEU 1039.A O no hydrogen 3.521 N/A LEU 1032.A N LEU 1039.A O no hydrogen 3.159 N/A SER 1033.A N MET 1024.A O no hydrogen 2.967 N/A SER 1033.A OG GLU 1026.A OE2 no hydrogen 2.639 N/A ASP 1034.A N GLY 1037.A O no hydrogen 2.815 N/A GLU 1035.A N GLU 1035.A OE2 no hydrogen 2.601 N/A THR 1036.A OG1 THR 1002.A OG1 no hydrogen 2.584 N/A LEU 1039.A N LEU 1032.A O no hydrogen 2.921 N/A VAL 1041.A N PHE 1030.A O no hydrogen 3.178 N/A ASP 1045.A N VAL 1025.A O no hydrogen 3.199 N/A LEU 1048.A N GLY 1023.A O no hydrogen 3.194 N/A VAL 1050.A N LEU 1021.A O no hydrogen 2.665 N/A LEU 1051.A N ALA 1061.A O no hydrogen 2.874 N/A ALA 1052.A N VAL 1019.A O no hydrogen 2.814 N/A GLU 1053.A N LEU 1058.A O no hydrogen 2.784 N/A VAL 1054.A N PRO 1017.A O no hydrogen 2.900 N/A GLU 1055.A N ARG 1056.A O no hydrogen 3.197 N/A ARG 1056.A NE GLU 1055.A OE1 no hydrogen 2.804 N/A ARG 1056.A NH2 GLU 1055.A OE1 no hydrogen 3.070 N/A LEU 1058.A N GLU 1053.A O no hydrogen 2.799 N/A GLN 1060.A N LEU 1051.A O no hydrogen 2.750 N/A ALA 1061.A N LEU 1051.A O no hydrogen 3.048 N/A THR 1064.A OG1 GLU 1067.A OE2 no hydrogen 2.725 N/A VAL 1068.A N THR 1064.A O no hydrogen 3.088 N/A LEU 1069.A N LEU 1065.A O no hydrogen 3.100 N/A GLU 1070.A N GLU 1067.A O no hydrogen 3.180 N/A ALA 1071.A N GLU 1067.A O no hydrogen 3.267 N/A GLU 1076.A N TYR 1140.A O no hydrogen 2.928 N/A VAL 1077.A N TYR 1105.A O no hydrogen 3.037 N/A GLU 1078.A N ARG 1138.A O no hydrogen 2.857 N/A VAL 1079.A N ARG 1107.A O no hydrogen 2.959 N/A ALA 1082.A N ASP 1080.A OD1 no hydrogen 3.518 N/A LEU 1083.A N HIS 1081.A O no hydrogen 3.011 N/A LEU 1091.A N LYS 1087.A O no hydrogen 2.778 N/A SER 1093.A N ALA 1089.A O no hydrogen 2.878 N/A SER 1093.A OG ALA 1089.A O no hydrogen 3.318 N/A SER 1093.A OG ARG 1090.A O no hydrogen 3.272 N/A LEU 1094.A N ARG 1090.A O no hydrogen 3.144 N/A LEU 1095.A N LEU 1091.A O no hydrogen 3.232 N/A ASP 1096.A N LYS 1092.A O no hydrogen 3.149 N/A GLU 1097.A N SER 1093.A O no hydrogen 3.085 N/A HIS 1098.A N LEU 1095.A O no hydrogen 3.195 N/A LEU 1102.A N VAL 1124.A O no hydrogen 2.838 N/A TYR 1105.A N LEU 1075.A O no hydrogen 2.980 N/A TYR 1105.A OH ASP 1144.A OD1 no hydrogen 2.641 N/A LEU 1106.A N PHE 1117.A O no hydrogen 2.786 N/A ARG 1107.A N VAL 1077.A O no hydrogen 3.136 N/A ARG 1107.A NE GLU 1076.A OE2 no hydrogen 3.351 N/A ARG 1107.A NH2 GLU 997.A O no hydrogen 3.257 N/A ARG 1107.A NH2 ALA 999.A O no hydrogen 2.699 N/A VAL 1108.A N ALA 1115.A O no hydrogen 3.162 N/A LEU 1109.A N VAL 1079.A O no hydrogen 3.366 N/A GLY 1110.A N GLY 1113.A O no hydrogen 3.106 N/A ALA 1115.A N VAL 1108.A O no hydrogen 3.305 N/A PHE 1117.A N LEU 1106.A O no hydrogen 3.038 N/A LEU 1119.A N VAL 1104.A O no hydrogen 2.660 N/A ARG 1123.A NH2 SER 1101.A O no hydrogen 3.441 N/A VAL 1124.A N LEU 1102.A O no hydrogen 2.987 N/A GLY 1125.A N HIS 1098.A O no hydrogen 3.041 N/A GLU 1127.A N GLY 1125.A O no hydrogen 2.940 N/A LEU 1129.A N GLU 1126.A O no hydrogen 3.158 N/A LEU 1132.A N LEU 1129.A O no hydrogen 3.143 N/A GLU 1133.A N LEU 1129.A O no hydrogen 2.868 N/A TYR 1137.A N GLU 1135.A O no hydrogen 2.581 N/A TYR 1140.A N GLU 1076.A O no hydrogen 2.959 N/A GLU 1146.A N ASP 1144.A OD1 no hydrogen 3.203 N/A PHE 1148.A N ARG 1145.A O no hydrogen 3.444 N/A