Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a3i_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASP 1.A O no hydrogen 3.324 N/A THR 7.A N ASP 10.A OD2 no hydrogen 2.716 N/A SER 11.A N ALA 8.A O no hydrogen 3.018 N/A SER 11.A OG ALA 8.A O no hydrogen 2.658 N/A SER 11.A OG ILE 647.A O no hydrogen 3.086 N/A TRP 12.A N GLU 9.A O no hydrogen 3.211 N/A ALA 13.A N ASP 10.A O no hydrogen 2.922 N/A VAL 14.A N SER 11.A O no hydrogen 3.176 N/A ILE 15.A N SER 11.A O no hydrogen 3.146 N/A SER 16.A N TRP 12.A O no hydrogen 2.787 N/A SER 16.A OG GLU 584.A OE1 no hydrogen 3.375 N/A ALA 17.A N ALA 13.A O no hydrogen 3.217 N/A PHE 18.A N VAL 14.A O no hydrogen 2.776 N/A PHE 18.A N ILE 15.A O no hydrogen 3.171 N/A PHE 19.A N ILE 15.A O no hydrogen 3.391 N/A ARG 20.A N SER 16.A O no hydrogen 3.033 N/A ARG 20.A NH1 ASP 587.A OD2 no hydrogen 3.222 N/A ARG 20.A NH2 SER 16.A OG no hydrogen 3.072 N/A GLU 21.A N ALA 17.A O no hydrogen 3.397 N/A GLU 21.A N PHE 18.A O no hydrogen 3.109 N/A LYS 22.A N PHE 18.A O no hydrogen 2.738 N/A GLY 23.A N PHE 19.A O no hydrogen 3.060 N/A GLN 27.A NE2 LEU 24.A O no hydrogen 3.228 N/A GLN 28.A NE2 LEU 145.A O no hydrogen 3.581 N/A LEU 29.A N VAL 25.A O no hydrogen 3.157 N/A ASP 30.A N SER 26.A O no hydrogen 3.050 N/A SER 31.A N GLN 27.A O no hydrogen 3.106 N/A PHE 32.A N LEU 29.A O no hydrogen 3.066 N/A ASN 33.A N LEU 29.A O no hydrogen 3.223 N/A GLN 34.A N ASP 30.A O no hydrogen 3.207 N/A PHE 35.A N SER 31.A O no hydrogen 3.397 N/A VAL 36.A N PHE 32.A O no hydrogen 2.771 N/A ASP 37.A N ASN 33.A O no hydrogen 3.013 N/A TYR 38.A N GLN 34.A O no hydrogen 3.097 N/A THR 39.A N GLN 34.A O no hydrogen 3.324 N/A THR 39.A OG1 GLN 34.A O no hydrogen 3.147 N/A LEU 40.A N PHE 35.A O no hydrogen 2.996 N/A GLN 41.A N TYR 38.A O no hydrogen 2.807 N/A GLN 41.A NE2 GLY 55.A O no hydrogen 2.992 N/A ASP 42.A N TYR 38.A O no hydrogen 3.480 N/A ILE 43.A N THR 39.A O no hydrogen 3.036 N/A ILE 44.A N LEU 40.A O no hydrogen 3.136 N/A CYS 45.A SG GLN 41.A O no hydrogen 3.351 N/A SER 48.A OG ILE 44.A O no hydrogen 3.007 N/A THR 49.A N SER 48.A OG no hydrogen 2.704 N/A LEU 50.A N ILE 52.A O no hydrogen 2.726 N/A SER 53.A N LYS 95.A O no hydrogen 2.998 N/A SER 53.A OG LYS 95.A O no hydrogen 3.435 N/A GLY 55.A N ASP 93.A O no hydrogen 2.746 N/A ILE 57.A N GLN 41.A OE1 no hydrogen 3.082 N/A TYR 58.A N PHE 91.A O no hydrogen 2.539 N/A TYR 58.A OH ASP 93.A OD1 no hydrogen 3.064 N/A TYR 58.A OH ASP 93.A OD2 no hydrogen 2.733 N/A THR 60.A N GLY 89.A O no hydrogen 3.096 N/A THR 60.A OG1 LYS 61.A O no hydrogen 3.057 N/A THR 60.A OG1 GLY 89.A O no hydrogen 3.545 N/A LYS 61.A NZ LYS 110.A O no hydrogen 3.424 N/A LYS 61.A NZ CYS 112.A O no hydrogen 3.183 N/A LYS 61.A NZ GLU 116.A OE1 no hydrogen 3.450 N/A VAL 64.A N HIS 72.A O no hydrogen 2.898 N/A SER 67.A OG ASP 850.A O no hydrogen 2.666 N/A HIS 72.A N VAL 64.A O no hydrogen 3.309 N/A HIS 72.A NE2 GLU 78.A OE1 no hydrogen 3.068 N/A LEU 74.A N PRO 62.A O no hydrogen 3.198 N/A ALA 79.A N TYR 75.A O no hydrogen 3.415 N/A ARG 80.A N PRO 76.A O no hydrogen 3.122 N/A ARG 80.A NH2 GLU 127.A OE1 no hydrogen 3.356 N/A LEU 81.A N GLN 77.A O no hydrogen 3.385 N/A ARG 82.A N GLU 78.A O no hydrogen 2.694 N/A ARG 82.A NE THR 847.A O no hydrogen 2.918 N/A ARG 82.A NH1 GLU 66.A OE1 no hydrogen 2.774 N/A ARG 82.A NH1 GLU 66.A OE2 no hydrogen 3.527 N/A ARG 82.A NH2 GLU 66.A OE1 no hydrogen 3.173 N/A ARG 82.A NH2 THR 847.A O no hydrogen 3.311 N/A ARG 82.A NH2 ASN 848.A O no hydrogen 2.990 N/A LEU 84.A N ALA 79.A O no hydrogen 2.934 N/A THR 85.A OG1 ASN 139.A OD1 no hydrogen 3.122 N/A TYR 86.A N ILE 137.A O no hydrogen 2.728 N/A SER 88.A N LEU 103.A O no hydrogen 2.826 N/A SER 88.A OG THR 60.A O no hydrogen 2.676 N/A GLY 89.A N THR 60.A OG1 no hydrogen 2.703 N/A LEU 90.A N GLY 101.A O no hydrogen 2.788 N/A PHE 91.A N TYR 58.A O no hydrogen 2.856 N/A VAL 92.A N VAL 98.A O no hydrogen 2.971 N/A ASP 93.A N LYS 56.A O no hydrogen 3.385 N/A LYS 95.A N SER 53.A O no hydrogen 3.142 N/A LYS 97.A NZ VAL 94.A O no hydrogen 2.687 N/A VAL 98.A N VAL 92.A O no hydrogen 3.145 N/A ILE 100.A N LEU 90.A O no hydrogen 2.642 N/A ARG 102.A N THR 379.A OG1 no hydrogen 2.814 N/A ARG 102.A NH1 SER 87.A O no hydrogen 2.943 N/A ARG 102.A NH1 SER 87.A OG no hydrogen 3.191 N/A LEU 103.A N SER 88.A O no hydrogen 2.581 N/A ILE 105.A N TYR 86.A O no hydrogen 2.842 N/A LEU 107.A N TYR 135.A O no hydrogen 2.934 N/A ARG 108.A NH2 PRO 129.A O no hydrogen 3.124 N/A SER 109.A N MET 106.A O no hydrogen 3.264 N/A SER 109.A OG MET 106.A O no hydrogen 2.533 N/A LYS 110.A N ASN 33.A OD1 no hydrogen 2.795 N/A LYS 110.A NZ ASP 37.A OD2 no hydrogen 3.020 N/A ASN 111.A ND2 VAL 59.A O no hydrogen 3.501 N/A ASN 111.A ND2 THR 60.A O no hydrogen 3.037 N/A ASN 111.A ND2 ASN 111.A O no hydrogen 3.626 N/A CYS 112.A N SER 109.A O no hydrogen 2.870 N/A CYS 112.A SG TYR 86.A OH no hydrogen 3.286 N/A TYR 113.A N TYR 86.A OH no hydrogen 3.422 N/A TYR 113.A OH PRO 62.A O no hydrogen 2.573 N/A SER 115.A OG LYS 110.A O no hydrogen 3.296 N/A SER 115.A OG CYS 112.A O no hydrogen 2.815 N/A SER 115.A OG GLU 116.A OE1 no hydrogen 2.761 N/A THR 118.A N ASP 121.A OD2 no hydrogen 3.202 N/A THR 118.A OG1 SER 120.A OG no hydrogen 3.098 N/A SER 120.A OG THR 118.A OG1 no hydrogen 3.098 N/A ASP 121.A N THR 118.A OG1 no hydrogen 3.043 N/A LEU 122.A N THR 118.A O no hydrogen 3.098 N/A LEU 122.A N GLU 119.A O no hydrogen 3.084 N/A TYR 123.A N GLU 119.A O no hydrogen 3.305 N/A LYS 124.A N SER 120.A O no hydrogen 3.366 N/A LEU 125.A N ASP 121.A O no hydrogen 2.815 N/A LYS 126.A N TYR 123.A O no hydrogen 3.171 N/A CYS 128.A SG THR 687.A OG1 no hydrogen 3.062 N/A ASP 131.A N CYS 128.A O no hydrogen 3.000 N/A GLY 134.A N LEU 107.A O no hydrogen 3.073 N/A TYR 135.A OH ASP 131.A OD1 no hydrogen 3.157 N/A TYR 135.A OH ASP 131.A OD2 no hydrogen 2.617 N/A PHE 136.A N LYS 143.A O no hydrogen 2.938 N/A ILE 138.A N SER 141.A O no hydrogen 3.104 N/A ASN 139.A N THR 85.A OG1 no hydrogen 3.188 N/A GLY 140.A N LEU 84.A O no hydrogen 3.128 N/A SER 141.A N ASN 139.A O no hydrogen 2.836 N/A SER 141.A OG ILE 138.A O no hydrogen 3.530 N/A LYS 143.A N PHE 136.A O no hydrogen 2.710 N/A LYS 143.A NZ SER 141.A OG no hydrogen 3.324 N/A LYS 143.A NZ ALA 387.A O no hydrogen 3.088 N/A VAL 144.A N GLN 406.A O no hydrogen 2.669 N/A ILE 146.A N VAL 404.A O no hydrogen 2.665 N/A GLN 148.A N ASP 340.A O no hydrogen 3.027 N/A GLN 148.A NE2 ILE 146.A O no hydrogen 3.049 N/A GLU 149.A N ASN 424.A O no hydrogen 2.923 N/A ARG 150.A N ARG 338.A O no hydrogen 2.944 N/A ARG 150.A NH1 ASP 340.A OD1 no hydrogen 2.690 N/A ALA 152.A N LYS 336.A O no hydrogen 2.800 N/A ASN 154.A N ARG 174.A O no hydrogen 2.526 N/A ASN 154.A ND2 ALA 176.A O no hydrogen 3.387 N/A ASN 154.A ND2 ASN 502.A O no hydrogen 3.644 N/A GLN 157.A N GLU 172.A O no hydrogen 3.073 N/A PHE 159.A N VAL 170.A O no hydrogen 2.861 N/A LYS 160.A N GLN 328.A OE1 no hydrogen 2.729 N/A LYS 160.A NZ HIS 169.A NE2 no hydrogen 3.511 N/A LYS 160.A NZ CYS 321.A O no hydrogen 3.441 N/A LYS 160.A NZ ASP 324.A OD1 no hydrogen 2.938 N/A LYS 161.A N SER 168.A O no hydrogen 2.906 N/A SER 165.A OG ILE 167.A O no hydrogen 3.142 N/A ILE 167.A N SER 165.A OG no hydrogen 3.371 N/A SER 168.A N LEU 191.A O no hydrogen 3.225 N/A SER 168.A OG HIS 169.A ND1 no hydrogen 2.781 N/A SER 168.A OG LEU 191.A O no hydrogen 3.567 N/A SER 168.A OG GLY 193.A O no hydrogen 3.486 N/A HIS 169.A ND1 SER 168.A OG no hydrogen 2.781 N/A VAL 170.A N PHE 159.A O no hydrogen 2.956 N/A ALA 171.A N VAL 189.A O no hydrogen 3.022 N/A GLU 172.A N GLN 157.A O no hydrogen 2.700 N/A ILE 173.A N LEU 187.A O no hydrogen 3.000 N/A SER 175.A OG SER 185.A O no hydrogen 2.592 N/A ALA 176.A N ASN 154.A OD1 no hydrogen 2.802 N/A LYS 179.A NZ ASP 42.A OD2 no hydrogen 2.767 N/A SER 185.A OG GLU 292.A O no hydrogen 3.434 N/A LEU 187.A N ILE 173.A O no hydrogen 3.142 N/A VAL 189.A N ALA 171.A O no hydrogen 2.959 N/A LYS 190.A N LYS 203.A O no hydrogen 2.833 N/A LYS 190.A NZ ASP 212.A OD2 no hydrogen 2.863 N/A LEU 191.A N HIS 169.A O no hydrogen 2.949 N/A GLY 193.A N PRO 166.A O no hydrogen 2.758 N/A ARG 194.A N SER 197.A OG no hydrogen 2.818 N/A ARG 194.A NE SER 165.A O no hydrogen 3.215 N/A ARG 194.A NH2 ALA 162.A O no hydrogen 3.238 N/A SER 197.A N ARG 194.A O no hydrogen 2.917 N/A SER 197.A OG ARG 194.A O no hydrogen 3.119 N/A SER 197.A OG SER 198.A O no hydrogen 3.508 N/A THR 201.A N ALA 199.A O no hydrogen 2.875 N/A THR 201.A OG1 ASP 253.A OD2 no hydrogen 2.716 N/A LYS 203.A N LYS 190.A O no hydrogen 3.038 N/A LYS 203.A NZ ASP 253.A OD1 no hydrogen 3.466 N/A LYS 203.A NZ ASP 253.A OD2 no hydrogen 3.225 N/A ALA 204.A N ILE 213.A O no hydrogen 2.790 N/A THR 205.A N GLN 188.A O no hydrogen 2.879 N/A THR 205.A OG1 GLN 188.A O no hydrogen 3.274 N/A ILE 209.A N LEU 206.A O no hydrogen 2.931 N/A LYS 210.A N GLY 271.A O no hydrogen 3.349 N/A LYS 210.A NZ THR 272.A O no hydrogen 3.278 N/A GLN 211.A NE2 LYS 210.A O no hydrogen 2.883 N/A ILE 215.A N ILE 202.A O no hydrogen 3.409 N/A ILE 217.A N PRO 214.A O no hydrogen 2.823 N/A ILE 218.A N PRO 214.A O no hydrogen 3.483 N/A PHE 219.A N ILE 215.A O no hydrogen 3.044 N/A ARG 220.A N VAL 216.A O no hydrogen 3.077 N/A ARG 220.A NE ILE 225.A O no hydrogen 2.746 N/A ARG 220.A NH2 ILE 225.A O no hydrogen 3.565 N/A ALA 221.A N ILE 217.A O no hydrogen 2.738 N/A LEU 222.A N ILE 218.A O no hydrogen 2.703 N/A GLY 223.A N PHE 219.A O no hydrogen 2.937 N/A GLY 223.A N ARG 220.A O no hydrogen 3.069 N/A ILE 224.A N PHE 219.A O no hydrogen 2.943 N/A GLU 229.A N PRO 226.A O no hydrogen 3.226 N/A ILE 230.A N PRO 226.A O no hydrogen 3.094 N/A GLU 232.A N GLY 228.A O no hydrogen 2.870 N/A HIS 233.A N ILE 230.A O no hydrogen 3.067 N/A ILE 234.A N LEU 231.A O no hydrogen 3.107 N/A CYS 235.A N LEU 231.A O no hydrogen 2.872 N/A CYS 235.A SG ASP 237.A O no hydrogen 3.123 N/A ASP 240.A N ASP 237.A O no hydrogen 3.349 N/A LEU 244.A N ASP 240.A O no hydrogen 3.192 N/A GLU 245.A N TRP 241.A O no hydrogen 2.810 N/A MET 246.A N MET 243.A O no hydrogen 3.259 N/A LEU 247.A N LEU 244.A O no hydrogen 2.774 N/A LYS 248.A N LEU 244.A O no hydrogen 3.261 N/A LYS 248.A NZ GLU 245.A OE2 no hydrogen 3.311 N/A CYS 250.A SG MET 246.A O no hydrogen 3.879 N/A CYS 250.A SG LEU 247.A O no hydrogen 3.312 N/A VAL 251.A N LEU 247.A O no hydrogen 3.255 N/A GLU 252.A N LYS 248.A O no hydrogen 3.450 N/A ASP 253.A N PRO 249.A O no hydrogen 2.978 N/A GLY 254.A N CYS 250.A O no hydrogen 3.061 N/A GLY 254.A N VAL 251.A O no hydrogen 3.267 N/A PHE 255.A N VAL 251.A O no hydrogen 2.759 N/A ILE 257.A N GLY 254.A O no hydrogen 2.818 N/A ARG 260.A NE ALA 221.A O no hydrogen 3.142 N/A ARG 260.A NH2 GLU 304.A OE1 no hydrogen 2.972 N/A GLU 261.A N GLU 261.A OE1 no hydrogen 2.693 N/A THR 262.A N ASP 259.A OD1 no hydrogen 3.248 N/A THR 262.A OG1 ASP 259.A O no hydrogen 3.190 N/A THR 262.A OG1 ASP 259.A OD1 no hydrogen 2.627 N/A ALA 263.A N ASP 259.A O no hydrogen 3.050 N/A LEU 264.A N ARG 260.A O no hydrogen 2.837 N/A ASP 265.A N GLU 261.A O no hydrogen 3.083 N/A ILE 267.A N ALA 263.A O no hydrogen 3.264 N/A ILE 267.A N LEU 264.A O no hydrogen 3.170 N/A GLY 268.A N LEU 264.A O no hydrogen 2.975 N/A ARG 269.A N ASP 265.A O no hydrogen 2.893 N/A ARG 270.A NE PHE 266.A O no hydrogen 2.912 N/A THR 272.A OG1 GLY 268.A O no hydrogen 3.520 N/A THR 272.A OG1 LEU 274.A O no hydrogen 3.401 N/A ARG 281.A N LYS 277.A O no hydrogen 3.211 N/A ARG 281.A NH1 ASP 265.A OD1 no hydrogen 2.730 N/A GLN 283.A N GLU 279.A O no hydrogen 3.465 N/A TYR 284.A N LYS 280.A O no hydrogen 3.111 N/A ILE 288.A N TYR 284.A O no hydrogen 3.231 N/A LEU 289.A N ALA 285.A O no hydrogen 3.136 N/A GLN 290.A N LYS 286.A O no hydrogen 3.168 N/A GLN 290.A NE2 GLU 301.A OE1 no hydrogen 3.268 N/A LYS 291.A N ASP 287.A O no hydrogen 2.712 N/A GLU 292.A N ILE 288.A O no hydrogen 2.742 N/A PHE 293.A N ILE 288.A O no hydrogen 2.903 N/A HIS 296.A NE2 GLY 503.A O no hydrogen 2.811 N/A THR 298.A OG1 ILE 297.A O no hydrogen 2.948 N/A GLN 299.A NE2 LYS 291.A O no hydrogen 2.954 N/A GLU 304.A N GLY 302.A O no hydrogen 2.748 N/A SER 305.A OG GLU 486.A O no hydrogen 3.517 N/A ARG 306.A NE GLU 486.A OE2 no hydrogen 2.912 N/A LYS 307.A N PHE 303.A O no hydrogen 3.390 N/A LYS 307.A NZ LEU 289.A O no hydrogen 2.821 N/A LYS 307.A NZ PHE 293.A O no hydrogen 3.037 N/A LYS 307.A NZ THR 298.A O no hydrogen 2.720 N/A ALA 308.A N GLU 304.A O no hydrogen 2.872 N/A PHE 309.A N SER 305.A O no hydrogen 3.364 N/A PHE 310.A N ARG 306.A O no hydrogen 3.316 N/A LEU 311.A N LYS 307.A O no hydrogen 2.976 N/A GLY 312.A N ALA 308.A O no hydrogen 2.975 N/A TYR 313.A N PHE 309.A O no hydrogen 2.792 N/A TYR 313.A OH GLU 542.A OE2 no hydrogen 2.693 N/A MET 314.A N PHE 310.A O no hydrogen 2.934 N/A ILE 315.A N LEU 311.A O no hydrogen 3.063 N/A ASN 316.A N GLY 312.A O no hydrogen 2.866 N/A ASN 316.A ND2 ILE 234.A O no hydrogen 2.880 N/A ARG 317.A N TYR 313.A O no hydrogen 3.081 N/A ARG 317.A NE TYR 313.A OH no hydrogen 3.438 N/A ARG 317.A NH1 ASP 329.A OD1 no hydrogen 3.515 N/A ARG 317.A NH2 ASP 329.A OD1 no hydrogen 3.267 N/A ARG 317.A NH2 ASP 329.A OD2 no hydrogen 3.566 N/A LEU 318.A N MET 314.A O no hydrogen 2.943 N/A LEU 319.A N ILE 315.A O no hydrogen 2.741 N/A LEU 320.A N ASN 316.A O no hydrogen 3.206 N/A CYS 321.A N ARG 317.A O no hydrogen 3.378 N/A CYS 321.A SG LYS 326.A O no hydrogen 3.867 N/A ALA 322.A N LEU 318.A O no hydrogen 3.146 N/A LEU 323.A N LEU 319.A O no hydrogen 2.933 N/A LEU 323.A N LEU 320.A O no hydrogen 3.189 N/A ASP 324.A N CYS 321.A O no hydrogen 3.366 N/A ARG 325.A N LEU 320.A O no hydrogen 3.133 N/A ARG 325.A NH1 ASP 240.A OD1 no hydrogen 3.439 N/A ARG 325.A NH1 ASP 240.A OD2 no hydrogen 2.623 N/A ARG 325.A NH2 ASP 240.A OD1 no hydrogen 2.816 N/A ARG 325.A NH2 GLN 242.A OE1 no hydrogen 3.358 N/A LYS 326.A NZ ASP 327.A O no hydrogen 3.371 N/A ASP 329.A N VAL 158.A O no hydrogen 2.996 N/A ASP 332.A N ASP 330.A OD1 no hydrogen 2.799 N/A PHE 334.A N THR 436.A OG1 no hydrogen 2.998 N/A GLY 335.A N HIS 333.A ND1 no hydrogen 3.044 N/A LYS 336.A N HIS 333.A O no hydrogen 2.930 N/A LYS 336.A NZ ASP 329.A OD2 no hydrogen 2.889 N/A LYS 337.A N PHE 334.A O no hydrogen 3.281 N/A ARG 338.A N ARG 150.A O no hydrogen 2.884 N/A ARG 338.A NE ASP 548.A OD1 no hydrogen 2.785 N/A ARG 338.A NH1 GLY 335.A O no hydrogen 2.627 N/A ARG 338.A NH1 LYS 337.A O no hydrogen 2.925 N/A ARG 338.A NH2 ASP 548.A OD2 no hydrogen 3.534 N/A LEU 339.A N GLY 550.A O no hydrogen 2.920 N/A ASP 340.A N GLN 148.A O no hydrogen 2.701 N/A GLY 343.A N SER 31.A OG no hydrogen 3.072 N/A LEU 345.A N LEU 341.A O no hydrogen 3.360 N/A LEU 346.A N ALA 342.A O no hydrogen 3.208 N/A ALA 347.A N GLY 343.A O no hydrogen 3.041 N/A GLN 348.A N PRO 344.A O no hydrogen 3.061 N/A LEU 349.A N LEU 345.A O no hydrogen 3.374 N/A PHE 350.A N LEU 346.A O no hydrogen 2.892 N/A LYS 351.A N ALA 347.A O no hydrogen 2.900 N/A THR 352.A N GLN 348.A O no hydrogen 3.262 N/A THR 352.A OG1 GLN 348.A O no hydrogen 3.078 N/A LEU 353.A N LEU 349.A O no hydrogen 2.980 N/A PHE 354.A N PHE 350.A O no hydrogen 2.744 N/A LYS 355.A N LYS 351.A O no hydrogen 3.154 N/A LYS 355.A NZ GLU 46.A OE2 no hydrogen 3.363 N/A LYS 355.A NZ ASP 47.A OD2 no hydrogen 3.244 N/A LYS 356.A N THR 352.A O no hydrogen 3.361 N/A LYS 356.A N LEU 353.A O no hydrogen 2.816 N/A LYS 356.A NZ GLU 393.A OE2 no hydrogen 3.424 N/A LEU 357.A N LEU 353.A O no hydrogen 3.082 N/A THR 358.A N PHE 354.A O no hydrogen 2.687 N/A THR 358.A OG1 PHE 354.A O no hydrogen 2.681 N/A LYS 359.A N LYS 355.A O no hydrogen 2.998 N/A ASP 360.A N LEU 357.A O no hydrogen 2.864 N/A ILE 361.A N LEU 357.A O no hydrogen 2.748 N/A PHE 362.A N THR 358.A O no hydrogen 3.239 N/A MET 365.A N ILE 361.A O no hydrogen 3.085 N/A GLN 366.A N PHE 362.A O no hydrogen 3.153 N/A ARG 367.A N ARG 363.A O no hydrogen 2.849 N/A THR 368.A N TYR 364.A O no hydrogen 2.987 N/A THR 368.A OG1 TYR 364.A O no hydrogen 3.045 N/A THR 377.A OG1 ASN 374.A O no hydrogen 2.624 N/A THR 379.A N ALA 375.A O no hydrogen 3.515 N/A THR 379.A OG1 ALA 375.A O no hydrogen 3.162 N/A SER 380.A N LYS 376.A O no hydrogen 2.744 N/A SER 380.A OG LYS 376.A O no hydrogen 2.659 N/A GLY 381.A N THR 377.A O no hydrogen 2.839 N/A LEU 382.A N ILE 378.A O no hydrogen 3.396 N/A LYS 383.A N THR 379.A O no hydrogen 3.070 N/A LYS 383.A NZ THR 85.A OG1 no hydrogen 3.118 N/A LYS 383.A NZ ASN 139.A OD1 no hydrogen 3.163 N/A TYR 384.A N SER 380.A O no hydrogen 2.825 N/A TYR 384.A OH ASN 390.A OD1 no hydrogen 3.255 N/A ALA 385.A N GLY 381.A O no hydrogen 3.454 N/A LEU 386.A N LEU 382.A O no hydrogen 3.093 N/A ALA 387.A N TYR 384.A O no hydrogen 3.017 N/A THR 388.A N TYR 384.A O no hydrogen 2.965 N/A THR 388.A N ALA 385.A O no hydrogen 2.867 N/A THR 388.A OG1 TYR 384.A O no hydrogen 2.727 N/A THR 388.A OG1 ALA 385.A O no hydrogen 3.504 N/A GLY 389.A N ALA 385.A O no hydrogen 2.658 N/A TRP 391.A N ARG 401.A O no hydrogen 3.066 N/A TRP 391.A NE1 LEU 345.A O no hydrogen 2.921 N/A GLY 392.A N ASN 390.A O no hydrogen 2.735 N/A SER 400.A OG SER 399.A O no hydrogen 2.878 N/A ARG 401.A NH1 GLN 348.A OE1 no hydrogen 3.242 N/A ARG 401.A NH2 GLN 348.A OE1 no hydrogen 2.825 N/A GLY 403.A N GLY 389.A O no hydrogen 2.995 N/A SER 405.A OG LEU 386.A O no hydrogen 2.752 N/A GLN 406.A N VAL 144.A O no hydrogen 3.037 N/A LEU 408.A N GLU 142.A O no hydrogen 3.197 N/A ASN 409.A N HIS 419.A ND1 no hydrogen 3.365 N/A ARG 410.A NE GLU 142.A OE1 no hydrogen 2.809 N/A ARG 410.A NE GLU 142.A OE2 no hydrogen 3.071 N/A ARG 410.A NH1 ASP 131.A OD1 no hydrogen 3.382 N/A ARG 410.A NH2 ASP 131.A OD1 no hydrogen 2.781 N/A ARG 410.A NH2 GLU 142.A OE2 no hydrogen 2.773 N/A THR 412.A N SER 415.A OG no hydrogen 2.841 N/A TYR 413.A OH PHE 130.A O no hydrogen 2.460 N/A SER 415.A OG THR 412.A O no hydrogen 2.506 N/A THR 416.A N THR 412.A O no hydrogen 3.243 N/A THR 416.A N TYR 413.A O no hydrogen 3.019 N/A THR 416.A OG1 ASN 409.A O no hydrogen 3.160 N/A THR 416.A OG1 THR 412.A O no hydrogen 2.921 N/A LEU 417.A N TYR 413.A O no hydrogen 3.141 N/A SER 418.A N SER 414.A O no hydrogen 2.995 N/A SER 418.A OG SER 414.A O no hydrogen 2.977 N/A SER 418.A OG SER 415.A O no hydrogen 3.207 N/A HIS 419.A N THR 416.A O no hydrogen 3.320 N/A HIS 419.A NE2 GLN 406.A OE1 no hydrogen 2.700 N/A LEU 420.A N LEU 417.A O no hydrogen 2.764 N/A ARG 421.A N LEU 417.A O no hydrogen 3.122 N/A ARG 421.A NH2 SER 462.A O no hydrogen 3.345 N/A ARG 422.A NE SER 418.A O no hydrogen 3.362 N/A THR 423.A N LYS 456.A O no hydrogen 2.738 N/A THR 423.A OG1 ALA 147.A O no hydrogen 3.285 N/A ASN 424.A N ALA 147.A O no hydrogen 3.010 N/A THR 425.A N LEU 454.A O no hydrogen 2.860 N/A THR 425.A OG1 LEU 454.A O no hydrogen 2.731 N/A ARG 431.A NH1 GLN 450.A O no hydrogen 2.980 N/A HIS 434.A N HIS 437.A ND1 no hydrogen 2.898 N/A HIS 434.A NE2 ASP 330.A OD2 no hydrogen 2.808 N/A THR 436.A N HIS 434.A ND1 no hydrogen 2.867 N/A THR 436.A OG1 HIS 434.A ND1 no hydrogen 2.748 N/A HIS 437.A N HIS 434.A O no hydrogen 2.889 N/A TRP 438.A N ASN 435.A O no hydrogen 3.101 N/A LEU 440.A N HIS 437.A O no hydrogen 3.157 N/A VAL 441.A N HIS 437.A O no hydrogen 3.178 N/A CYS 442.A N ASN 457.A O no hydrogen 2.632 N/A THR 446.A OG1 VAL 455.A O no hydrogen 3.220 N/A GLN 450.A N GLN 450.A OE1 no hydrogen 3.103 N/A CYS 452.A N GLY 449.A O no hydrogen 2.756 N/A GLY 453.A N THR 446.A OG1 no hydrogen 2.827 N/A LEU 454.A N ALA 451.A O no hydrogen 2.685 N/A VAL 455.A N ALA 451.A O no hydrogen 3.215 N/A LYS 456.A N THR 423.A O no hydrogen 2.831 N/A LYS 456.A NZ THR 425.A OG1 no hydrogen 3.065 N/A LYS 456.A NZ PRO 430.A O no hydrogen 3.563 N/A LYS 456.A NZ GLY 453.A O no hydrogen 2.944 N/A ASN 457.A ND2 GLU 445.A O no hydrogen 3.362 N/A LEU 458.A N ARG 421.A O no hydrogen 3.103 N/A SER 459.A N LEU 440.A O no hydrogen 3.087 N/A SER 459.A OG ILE 652.A O no hydrogen 2.631 N/A LEU 460.A N LEU 653.A O no hydrogen 3.027 N/A SER 462.A N SER 459.A O no hydrogen 3.346 N/A SER 462.A OG GLY 439.A O no hydrogen 3.446 N/A SER 462.A OG LEU 440.A O no hydrogen 2.540 N/A SER 462.A OG SER 459.A O no hydrogen 3.449 N/A CYS 463.A N TYR 553.A O no hydrogen 2.916 N/A CYS 463.A SG SER 462.A O no hydrogen 3.438 N/A SER 465.A N ARG 551.A O no hydrogen 2.836 N/A SER 465.A OG ASP 548.A O no hydrogen 2.756 N/A VAL 466.A N GLU 531.A OE1 no hydrogen 2.681 N/A GLY 467.A N GLU 531.A OE2 no hydrogen 2.911 N/A THR 468.A N THR 547.A O no hydrogen 3.021 N/A THR 468.A OG1 GLU 531.A OE2 no hydrogen 3.082 N/A THR 468.A OG1 THR 547.A O no hydrogen 3.368 N/A ILE 473.A N PRO 470.A O no hydrogen 2.829 N/A ILE 474.A N PRO 470.A O no hydrogen 2.863 N/A THR 475.A N MET 471.A O no hydrogen 2.732 N/A THR 475.A OG1 MET 471.A O no hydrogen 2.624 N/A PHE 476.A N PRO 472.A O no hydrogen 3.208 N/A LEU 477.A N ILE 473.A O no hydrogen 3.018 N/A SER 478.A N ILE 474.A O no hydrogen 3.279 N/A SER 478.A OG ILE 474.A O no hydrogen 3.222 N/A SER 478.A OG THR 475.A O no hydrogen 3.369 N/A GLU 479.A N PHE 476.A O no hydrogen 3.190 N/A TRP 480.A N LEU 477.A O no hydrogen 2.807 N/A GLU 483.A N VAL 508.A O no hydrogen 3.099 N/A LEU 485.A N HIS 506.A O no hydrogen 3.217 N/A ASP 487.A N PRO 484.A O no hydrogen 3.086 N/A TYR 488.A N LEU 485.A O no hydrogen 3.349 N/A TYR 488.A OH SER 493.A O no hydrogen 3.259 N/A HIS 491.A N GLU 232.A OE2 no hydrogen 3.530 N/A GLN 492.A N VAL 489.A O no hydrogen 2.919 N/A SER 493.A N VAL 489.A O no hydrogen 3.017 N/A THR 497.A N HIS 509.A O no hydrogen 2.855 N/A ARG 498.A N LYS 541.A O no hydrogen 3.219 N/A ARG 498.A NH1 GLU 540.A O no hydrogen 3.376 N/A VAL 499.A N GLY 507.A O no hydrogen 3.137 N/A PHE 500.A N LEU 543.A O no hydrogen 2.729 N/A VAL 501.A N VAL 504.A O no hydrogen 3.168 N/A ASN 502.A N ILE 545.A O no hydrogen 2.850 N/A VAL 504.A N VAL 501.A O no hydrogen 3.305 N/A TRP 505.A NE1 GLY 507.A O no hydrogen 2.768 N/A HIS 506.A N VAL 499.A O no hydrogen 3.170 N/A VAL 508.A N GLU 483.A O no hydrogen 2.905 N/A HIS 509.A N THR 497.A O no hydrogen 2.866 N/A HIS 509.A ND1 GLY 481.A O no hydrogen 2.599 N/A ARG 510.A NH2 SER 493.A OG no hydrogen 2.710 N/A ARG 514.A N ASN 511.A OD1 no hydrogen 2.950 N/A LEU 515.A N ASN 511.A O no hydrogen 3.495 N/A MET 516.A N PRO 512.A O no hydrogen 2.670 N/A GLU 517.A N ALA 513.A O no hydrogen 3.474 N/A THR 518.A N ARG 514.A O no hydrogen 3.119 N/A LEU 519.A N LEU 515.A O no hydrogen 3.099 N/A ARG 520.A N MET 516.A O no hydrogen 2.804 N/A THR 521.A N GLU 517.A O no hydrogen 2.922 N/A THR 521.A OG1 GLU 517.A O no hydrogen 3.173 N/A LEU 522.A N THR 518.A O no hydrogen 3.079 N/A ARG 523.A N LEU 519.A O no hydrogen 2.954 N/A ARG 523.A NE VAL 532.A O no hydrogen 3.335 N/A ARG 523.A NH1 GLU 607.A OE2 no hydrogen 3.411 N/A ARG 523.A NH2 VAL 532.A O no hydrogen 3.022 N/A ARG 523.A NH2 GLU 607.A OE1 no hydrogen 2.644 N/A ARG 523.A NH2 GLU 607.A OE2 no hydrogen 3.116 N/A ARG 524.A N ARG 520.A O no hydrogen 3.054 N/A ARG 524.A NE GLU 601.A OE2 no hydrogen 2.696 N/A LYS 525.A N THR 521.A O no hydrogen 3.026 N/A LYS 525.A NZ ASP 527.A OD2 no hydrogen 3.555 N/A GLY 526.A N ARG 523.A O no hydrogen 2.924 N/A ILE 528.A N LEU 522.A O no hydrogen 3.282 N/A GLU 531.A N ASN 529.A OD1 no hydrogen 3.234 N/A VAL 532.A N ASN 529.A O no hydrogen 3.140 N/A SER 533.A N PHE 546.A O no hydrogen 3.257 N/A SER 533.A OG ASP 604.A OD2 no hydrogen 3.393 N/A MET 534.A N GLU 607.A OE1 no hydrogen 3.240 N/A ILE 535.A N LYS 544.A O no hydrogen 2.767 N/A ASP 537.A N GLU 542.A O no hydrogen 2.780 N/A GLU 540.A N ASP 537.A OD1 no hydrogen 3.310 N/A LYS 541.A N ILE 538.A O no hydrogen 2.942 N/A LYS 541.A NZ PRO 494.A O no hydrogen 2.797 N/A GLU 542.A N ASP 537.A O no hydrogen 3.061 N/A LEU 543.A N ARG 498.A O no hydrogen 2.843 N/A LYS 544.A N ILE 535.A O no hydrogen 2.935 N/A ILE 545.A N PHE 500.A O no hydrogen 2.904 N/A PHE 546.A N SER 533.A O no hydrogen 2.745 N/A THR 547.A N ASN 502.A OD1 no hydrogen 2.793 N/A ASP 548.A N ASN 502.A OD1 no hydrogen 3.399 N/A GLY 550.A N SER 465.A O no hydrogen 3.024 N/A GLY 550.A N SER 465.A OG no hydrogen 2.644 N/A ARG 551.A N SER 465.A OG no hydrogen 2.721 N/A ARG 551.A NE ASP 548.A O no hydrogen 3.251 N/A ARG 551.A NH1 GLU 531.A O no hydrogen 2.824 N/A ARG 551.A NH2 GLU 531.A O no hydrogen 3.151 N/A ARG 551.A NH2 ASP 548.A O no hydrogen 2.992 N/A TYR 553.A N CYS 463.A O no hydrogen 2.761 N/A ARG 554.A N ILE 603.A O no hydrogen 3.105 N/A ARG 554.A NE GLU 608.A OE1 no hydrogen 3.335 N/A ARG 554.A NH1 GLU 646.A OE1 no hydrogen 3.417 N/A ARG 554.A NH1 GLU 646.A OE2 no hydrogen 2.610 N/A ARG 554.A NH2 GLU 646.A OE1 no hydrogen 2.803 N/A LEU 556.A N GLU 601.A O no hydrogen 2.941 N/A PHE 557.A N CYS 645.A O no hydrogen 2.879 N/A ILE 558.A N LEU 599.A O no hydrogen 3.119 N/A VAL 559.A N THR 643.A O no hydrogen 2.807 N/A GLU 560.A N GLU 569.A O no hydrogen 3.486 N/A GLY 566.A N SER 564.A O no hydrogen 2.802 N/A LYS 568.A NZ ASP 561.A OD1 no hydrogen 3.339 N/A LYS 568.A NZ THR 641.A O no hydrogen 3.338 N/A GLU 569.A N GLU 560.A O no hydrogen 3.155 N/A LYS 571.A N ILE 558.A O no hydrogen 2.885 N/A LYS 571.A NZ GLY 598.A O no hydrogen 3.526 N/A ARG 573.A N HIS 576.A ND1 no hydrogen 3.030 N/A ARG 573.A NE LEU 570.A O no hydrogen 2.739 N/A LYS 574.A N ALA 4.A O no hydrogen 2.787 N/A LYS 574.A NZ ASP 10.A OD1 no hydrogen 3.282 N/A LYS 574.A NZ ASP 10.A OD2 no hydrogen 3.083 N/A HIS 576.A N ARG 573.A O no hydrogen 2.895 N/A ALA 578.A N LYS 574.A O no hydrogen 3.189 N/A LYS 579.A N GLY 575.A O no hydrogen 2.958 N/A LEU 580.A N HIS 576.A O no hydrogen 2.913 N/A MET 581.A N ILE 577.A O no hydrogen 3.150 N/A ALA 582.A N ALA 578.A O no hydrogen 2.898 N/A THR 583.A OG1 LYS 579.A O no hydrogen 3.162 N/A GLU 584.A N LEU 580.A O no hydrogen 2.941 N/A TYR 585.A N MET 581.A O no hydrogen 3.045 N/A TYR 589.A N THR 583.A OG1 no hydrogen 3.115 N/A TYR 589.A OH GLU 597.A OE1 no hydrogen 3.022 N/A THR 590.A OG1 SER 593.A OG no hydrogen 3.358 N/A TRP 591.A NE1 TYR 602.A OH no hydrogen 2.723 N/A SER 592.A N GLU 21.A OE2 no hydrogen 2.846 N/A SER 592.A OG GLU 21.A OE1 no hydrogen 3.237 N/A SER 592.A OG GLU 21.A OE2 no hydrogen 2.986 N/A SER 593.A N THR 590.A OG1 no hydrogen 3.146 N/A SER 593.A OG THR 590.A OG1 no hydrogen 3.358 N/A LEU 594.A N TRP 591.A O no hydrogen 2.897 N/A LEU 595.A N TRP 591.A O no hydrogen 3.249 N/A ASN 596.A N SER 592.A O no hydrogen 2.892 N/A GLU 597.A N SER 593.A O no hydrogen 2.759 N/A LEU 599.A N LEU 594.A O no hydrogen 2.899 N/A GLU 601.A N LEU 556.A O no hydrogen 3.136 N/A ILE 603.A N ARG 554.A O no hydrogen 2.868 N/A GLU 607.A N ASP 604.A OD1 no hydrogen 3.192 N/A GLU 608.A N ASP 604.A O no hydrogen 2.942 N/A GLU 609.A N GLU 606.A O no hydrogen 3.345 N/A SER 610.A N GLU 607.A O no hydrogen 3.140 N/A SER 610.A OG GLU 607.A O no hydrogen 2.916 N/A ILE 611.A N GLU 608.A O no hydrogen 3.289 N/A LEU 612.A N THR 643.A OG1 no hydrogen 3.067 N/A ALA 614.A N HIS 644.A O no hydrogen 2.994 N/A ASP 619.A N ASP 619.A OD1 no hydrogen 2.597 N/A LEU 620.A N PRO 617.A O no hydrogen 2.784 N/A SER 636.A OG VAL 635.A O no hydrogen 2.759 N/A HIS 637.A ND1 ASP 619.A O no hydrogen 3.022 N/A THR 643.A N LEU 612.A O no hydrogen 2.913 N/A THR 643.A OG1 HIS 644.A ND1 no hydrogen 3.031 N/A HIS 644.A N LEU 612.A O no hydrogen 3.375 N/A HIS 644.A ND1 THR 643.A OG1 no hydrogen 3.031 N/A HIS 644.A NE2 GLU 601.A OE1 no hydrogen 3.071 N/A CYS 645.A N PHE 557.A O no hydrogen 2.821 N/A CYS 645.A SG ALA 614.A O no hydrogen 3.357 N/A CYS 645.A SG GLU 646.A O no hydrogen 3.416 N/A GLU 646.A N ALA 614.A O no hydrogen 2.827 N/A HIS 648.A ND1 SER 650.A OG no hydrogen 2.431 N/A SER 650.A N HIS 648.A ND1 no hydrogen 3.249 N/A SER 650.A OG HIS 648.A ND1 no hydrogen 2.431 N/A MET 651.A N HIS 648.A O no hydrogen 3.358 N/A ILE 652.A N PRO 649.A O no hydrogen 3.217 N/A LEU 653.A N SER 650.A O no hydrogen 3.333 N/A ALA 656.A N GLU 445.A OE1 no hydrogen 2.754 N/A SER 658.A N GLY 654.A O no hydrogen 3.043 N/A SER 658.A OG GLY 654.A O no hydrogen 3.181 N/A ILE 659.A N ALA 656.A O no hydrogen 2.794 N/A ILE 660.A N ALA 657.A O no hydrogen 3.065 N/A PHE 662.A N ALA 935.A O no hydrogen 3.006 N/A HIS 665.A N PHE 662.A O no hydrogen 2.925 N/A ASN 666.A N PRO 663.A O no hydrogen 3.309 N/A ASN 666.A ND2 ASN 671.A OD1 no hydrogen 3.398 N/A ASN 666.A ND2 HIS 875.A ND1 no hydrogen 3.039 N/A ARG 670.A N GLN 667.A O no hydrogen 2.806 N/A ASN 671.A ND2 PRO 663.A O no hydrogen 3.144 N/A THR 672.A OG1 ALA 444.A O no hydrogen 3.135 N/A THR 672.A OG1 SER 668.A O no hydrogen 3.520 N/A TYR 673.A N PRO 669.A O no hydrogen 2.865 N/A GLN 674.A N ARG 670.A O no hydrogen 3.205 N/A GLN 674.A NE2 GLN 984.A OE1 no hydrogen 3.240 N/A SER 675.A N ASN 671.A O no hydrogen 3.022 N/A SER 675.A OG ASN 671.A O no hydrogen 3.065 N/A SER 675.A OG THR 672.A O no hydrogen 2.714 N/A MET 677.A N TYR 673.A O no hydrogen 3.436 N/A GLY 678.A N GLN 674.A O no hydrogen 3.187 N/A LYS 679.A NZ GLU 445.A OE2 no hydrogen 3.183 N/A GLN 680.A N MET 677.A O no hydrogen 2.691 N/A MET 682.A N ARG 985.A O no hydrogen 2.957 N/A ASN 688.A ND2 LYS 126.A O no hydrogen 3.663 N/A ASN 690.A ND2 ASN 690.A O no hydrogen 2.990 N/A VAL 691.A N ASN 688.A O no hydrogen 2.804 N/A ARG 692.A N TYR 689.A O no hydrogen 3.401 N/A ARG 692.A NE ASP 694.A OD2 no hydrogen 3.018 N/A ARG 692.A NH1 GLU 142.A OE2 no hydrogen 3.173 N/A ARG 692.A NH2 GLU 142.A OE1 no hydrogen 3.534 N/A ARG 692.A NH2 ASP 694.A OD2 no hydrogen 2.841 N/A ALA 697.A N PHE 760.A O no hydrogen 3.334 N/A ILE 699.A N LEU 758.A O no hydrogen 3.299 N/A TYR 701.A N ARG 756.A O no hydrogen 2.882 N/A TYR 701.A OH THR 862.A OG1 no hydrogen 2.856 N/A GLN 704.A N GLY 724.A O no hydrogen 3.183 N/A LYS 705.A NZ GLU 932.A OE1 no hydrogen 3.186 N/A LEU 707.A N ASN 726.A OD1 no hydrogen 2.961 N/A THR 709.A N GLY 933.A O no hydrogen 2.992 N/A THR 709.A OG1 GLU 932.A OE2 no hydrogen 2.753 N/A THR 709.A OG1 GLY 933.A O no hydrogen 3.515 N/A THR 710.A OG1 SER 658.A O no hydrogen 2.764 N/A ARG 711.A N SER 936.A OG no hydrogen 2.619 N/A ARG 711.A NE GLU 9.A OE1 no hydrogen 2.983 N/A ARG 711.A NH2 GLU 9.A OE1 no hydrogen 3.488 N/A MET 713.A N THR 710.A O no hydrogen 3.066 N/A TYR 715.A N ALA 712.A O no hydrogen 3.283 N/A LYS 717.A NZ GLU 714.A O no hydrogen 3.520 N/A PHE 718.A N MET 713.A O no hydrogen 3.154 N/A GLU 720.A N LYS 717.A O no hydrogen 3.162 N/A LEU 721.A N LYS 717.A O no hydrogen 3.186 N/A ALA 723.A N TYR 982.A OH no hydrogen 3.156 N/A GLY 724.A N TYR 982.A OH no hydrogen 2.788 N/A GLN 725.A N TYR 983.A O no hydrogen 3.200 N/A GLN 725.A NE2 TYR 702.A O no hydrogen 2.728 N/A ASN 726.A N GLN 704.A OE1 no hydrogen 2.927 N/A ASN 726.A ND2 GLN 704.A OE1 no hydrogen 3.210 N/A ASN 726.A ND2 LYS 705.A O no hydrogen 2.671 N/A ALA 727.A N THR 981.A O no hydrogen 2.921 N/A ILE 728.A N ASP 900.A OD2 no hydrogen 3.271 N/A VAL 729.A N GLY 979.A O no hydrogen 2.772 N/A ALA 730.A N LEU 901.A O no hydrogen 2.986 N/A ILE 731.A N PHE 977.A O no hydrogen 3.185 N/A TYR 734.A OH ASP 889.A O no hydrogen 3.103 N/A SER 735.A OG TYR 885.A OH no hydrogen 2.708 N/A ASN 738.A ND2 ALA 732.A O no hydrogen 2.714 N/A ASN 738.A ND2 ILE 902.A O no hydrogen 3.597 N/A GLN 739.A NE2 GLY 736.A O no hydrogen 2.869 N/A SER 742.A OG TYR 737.A O no hydrogen 3.027 N/A SER 742.A OG GLN 739.A O no hydrogen 2.548 N/A MET 743.A N THR 880.A O no hydrogen 2.713 N/A ILE 744.A N ILE 902.A O no hydrogen 3.218 N/A MET 745.A N ILE 883.A O no hydrogen 3.084 N/A ASN 746.A N ASP 900.A O no hydrogen 2.931 N/A ASN 746.A ND2 TYR 885.A O no hydrogen 3.268 N/A GLN 747.A N TYR 885.A O no hydrogen 2.696 N/A GLN 747.A NE2 ASP 751.A OD1 no hydrogen 2.742 N/A SER 749.A N ASN 746.A OD1 no hydrogen 2.992 N/A SER 749.A OG ASN 746.A OD1 no hydrogen 2.380 N/A SER 749.A OG ASP 900.A OD1 no hydrogen 2.812 N/A ILE 750.A N ASN 746.A O no hydrogen 3.169 N/A ASP 751.A N GLN 747.A O no hydrogen 3.018 N/A ARG 752.A N SER 748.A O no hydrogen 3.245 N/A GLY 753.A N ILE 750.A O no hydrogen 3.047 N/A LEU 754.A N SER 749.A O no hydrogen 3.186 N/A PHE 755.A N GLN 725.A OE1 no hydrogen 2.845 N/A SER 757.A N LYS 863.A O no hydrogen 3.116 N/A LEU 758.A N ILE 699.A O no hydrogen 2.598 N/A PHE 760.A N ALA 697.A O no hydrogen 2.842 N/A ARG 761.A N VAL 859.A O no hydrogen 3.100 N/A SER 762.A OG ASP 694.A O no hydrogen 2.984 N/A TYR 763.A N VAL 857.A O no hydrogen 2.787 N/A ASP 765.A N VAL 855.A O no hydrogen 2.967 N/A GLN 766.A N ASP 765.A OD1 no hydrogen 2.790 N/A GLU 767.A N LYS 853.A O no hydrogen 2.972 N/A LYS 768.A N GLU 776.A OE1 no hydrogen 2.715 N/A TYR 770.A N ILE 774.A O no hydrogen 2.651 N/A TYR 770.A OH GLU 776.A OE2 no hydrogen 3.355 N/A SER 773.A N GLY 771.A O no hydrogen 2.873 N/A GLU 776.A N LYS 768.A O no hydrogen 3.355 N/A THR 777.A N THR 819.A O no hydrogen 2.740 N/A PHE 778.A N GLU 767.A OE2 no hydrogen 3.038 N/A LEU 787.A N ARG 783.A O no hydrogen 3.163 N/A LYS 790.A N TYR 794.A OH no hydrogen 3.140 N/A LYS 790.A NZ ASP 827.A OD2 no hydrogen 2.727 N/A LYS 790.A NZ SER 829.A O no hydrogen 2.750 N/A TYR 794.A OH ASP 827.A OD1 no hydrogen 2.845 N/A LYS 796.A NZ ARG 808.A O no hydrogen 3.009 N/A LYS 796.A NZ ASP 813.A OD2 no hydrogen 2.823 N/A LEU 797.A N TYR 794.A O no hydrogen 3.046 N/A ASP 798.A N LEU 802.A O no hydrogen 3.144 N/A GLY 801.A N ASP 798.A O no hydrogen 2.896 N/A GLY 806.A N ALA 804.A O no hydrogen 2.627 N/A VAL 807.A N ALA 804.A O no hydrogen 3.430 N/A VAL 809.A N GLY 838.A O no hydrogen 2.771 N/A SER 810.A N ASP 813.A OD1 no hydrogen 2.796 N/A SER 810.A OG ASP 813.A OD1 no hydrogen 3.399 N/A VAL 814.A N THR 793.A O no hydrogen 3.262 N/A ILE 815.A N THR 830.A O no hydrogen 2.787 N/A ILE 816.A N THR 830.A O no hydrogen 3.246 N/A GLY 817.A N GLY 801.A O no hydrogen 2.663 N/A LYS 818.A N SER 829.A OG no hydrogen 3.155 N/A LYS 818.A NZ ASP 765.A OD1 no hydrogen 2.669 N/A LYS 818.A NZ GLN 766.A O no hydrogen 2.820 N/A LYS 818.A NZ GLU 776.A OE1 no hydrogen 2.778 N/A LYS 818.A NZ GLU 776.A OE2 no hydrogen 3.450 N/A THR 819.A N THR 777.A O no hydrogen 2.843 N/A THR 819.A OG1 THR 777.A O no hydrogen 3.336 N/A THR 820.A N ARG 826.A O no hydrogen 2.899 N/A THR 820.A OG1 GLU 776.A OE2 no hydrogen 2.895 N/A ILE 822.A N SER 824.A OG no hydrogen 3.001 N/A SER 824.A OG THR 820.A O no hydrogen 3.074 N/A SER 824.A OG SER 824.A O no hydrogen 2.664 N/A LYS 825.A NZ GLN 782.A OE1 no hydrogen 2.811 N/A ARG 826.A N THR 820.A O no hydrogen 2.605 N/A ALA 828.A N LYS 818.A O no hydrogen 2.908 N/A SER 829.A OG LYS 818.A O no hydrogen 3.457 N/A SER 829.A OG ASP 827.A OD1 no hydrogen 2.754 N/A THR 830.A N ILE 816.A O no hydrogen 2.843 N/A THR 830.A OG1 ASP 765.A OD2 no hydrogen 3.350 N/A LEU 832.A N ASP 813.A O no hydrogen 2.880 N/A ARG 833.A N TYR 763.A OH no hydrogen 3.021 N/A SER 834.A OG SER 1014.A O no hydrogen 3.178 N/A GLU 836.A N ARG 833.A O no hydrogen 2.756 N/A GLY 838.A N VAL 809.A O no hydrogen 2.997 N/A ILE 839.A N ARG 860.A O no hydrogen 2.849 N/A VAL 840.A N VAL 807.A O no hydrogen 3.155 N/A ASP 841.A N ARG 858.A O no hydrogen 2.845 N/A GLN 842.A N ARG 858.A O no hydrogen 3.472 N/A GLN 842.A NE2 ASN 690.A O no hydrogen 3.374 N/A LEU 844.A N LYS 856.A O no hydrogen 2.853 N/A THR 846.A N PHE 854.A O no hydrogen 2.990 N/A THR 847.A N THR 846.A OG1 no hydrogen 2.776 N/A ASN 848.A N LEU 852.A O no hydrogen 2.773 N/A GLN 849.A N ASN 848.A OD1 no hydrogen 2.863 N/A PHE 854.A N THR 846.A O no hydrogen 2.865 N/A VAL 855.A N ASP 765.A O no hydrogen 2.821 N/A LYS 856.A N LEU 844.A O no hydrogen 3.128 N/A LYS 856.A NZ LEU 81.A O no hydrogen 2.930 N/A LYS 856.A NZ ASN 83.A OD1 no hydrogen 2.816 N/A VAL 857.A N TYR 763.A O no hydrogen 2.728 N/A ARG 858.A N GLN 842.A O no hydrogen 2.905 N/A ARG 858.A NE ASP 841.A OD2 no hydrogen 2.715 N/A ARG 858.A NH1 ASN 690.A O no hydrogen 3.454 N/A ARG 858.A NH2 ASN 690.A O no hydrogen 2.681 N/A ARG 858.A NH2 ASP 841.A OD2 no hydrogen 2.847 N/A VAL 859.A N ARG 761.A O no hydrogen 2.920 N/A ARG 860.A N ILE 839.A O no hydrogen 2.806 N/A ARG 860.A NE ASP 841.A OD1 no hydrogen 3.183 N/A THR 861.A N PHE 759.A O no hydrogen 2.889 N/A THR 861.A OG1 ASN 837.A O no hydrogen 3.121 N/A THR 862.A OG1 TYR 701.A OH no hydrogen 2.856 N/A LYS 863.A NZ ASP 992.A OD1 no hydrogen 3.106 N/A LYS 863.A NZ ASP 992.A OD2 no hydrogen 2.739 N/A ASP 869.A N GLN 866.A O no hydrogen 3.485 N/A LYS 870.A N HIS 988.A O no hydrogen 3.177 N/A PHE 871.A N GLY 879.A O no hydrogen 2.865 N/A ALA 872.A N GLN 984.A O no hydrogen 3.042 N/A ARG 874.A NH1 GLY 708.A O no hydrogen 3.417 N/A ARG 874.A NH2 ILE 659.A O no hydrogen 3.292 N/A ARG 874.A NH2 GLY 708.A O no hydrogen 2.951 N/A GLN 877.A NE2 HIS 875.A O no hydrogen 3.359 N/A GLY 879.A N PHE 871.A O no hydrogen 2.964 N/A THR 880.A OG1 ILE 881.A O no hydrogen 3.412 N/A ILE 881.A N ASP 869.A O no hydrogen 3.247 N/A GLY 882.A N MET 743.A O no hydrogen 2.953 N/A TYR 885.A N MET 745.A O no hydrogen 3.185 N/A TYR 885.A OH SER 735.A OG no hydrogen 2.708 N/A GLU 888.A N GLU 888.A OE2 no hydrogen 2.758 N/A ASP 889.A N ARG 886.A O no hydrogen 2.999 N/A MET 890.A N ARG 886.A O no hydrogen 3.230 N/A PHE 892.A N TYR 964.A O no hydrogen 3.206 N/A THR 893.A N ILE 897.A O no hydrogen 2.909 N/A GLY 896.A N THR 893.A O no hydrogen 2.811 N/A ASP 900.A N ILE 728.A O no hydrogen 2.654 N/A LEU 901.A N ILE 728.A O no hydrogen 3.336 N/A ILE 902.A N ILE 744.A O no hydrogen 2.805 N/A ILE 903.A N ALA 730.A O no hydrogen 3.052 N/A HIS 906.A N ASN 904.A OD1 no hydrogen 3.225 N/A HIS 906.A ND1 ASN 904.A OD1 no hydrogen 2.753 N/A ALA 907.A N ASN 904.A O no hydrogen 3.237 N/A ILE 908.A N PRO 905.A O no hydrogen 3.012 N/A ARG 911.A NE ALA 907.A O no hydrogen 2.946 N/A MET 912.A N ILE 908.A O no hydrogen 2.941 N/A THR 913.A OG1 ASN 666.A OD1 no hydrogen 3.133 N/A HIS 916.A N THR 913.A O no hydrogen 3.269 N/A HIS 916.A NE2 TYR 983.A OH no hydrogen 3.287 N/A LEU 917.A N VAL 914.A O no hydrogen 2.832 N/A ILE 918.A N VAL 914.A O no hydrogen 3.017 N/A GLU 919.A N ALA 915.A O no hydrogen 2.810 N/A CYS 920.A N HIS 916.A O no hydrogen 3.171 N/A CYS 920.A SG PRO 980.A O no hydrogen 3.725 N/A CYS 920.A SG THR 981.A OG1 no hydrogen 3.446 N/A LEU 921.A N LEU 917.A O no hydrogen 2.980 N/A LEU 922.A N ILE 918.A O no hydrogen 2.961 N/A SER 923.A N GLU 919.A O no hydrogen 2.746 N/A SER 923.A OG GLU 919.A O no hydrogen 2.944 N/A SER 923.A OG GLU 919.A OE2 no hydrogen 3.520 N/A LYS 924.A N CYS 920.A O no hydrogen 2.957 N/A LYS 924.A NZ GLY 959.A O no hydrogen 2.818 N/A LYS 924.A NZ GLU 961.A OE1 no hydrogen 2.762 N/A LYS 924.A NZ PHE 978.A O no hydrogen 3.311 N/A VAL 925.A N LEU 921.A O no hydrogen 3.021 N/A ALA 926.A N LEU 922.A O no hydrogen 2.787 N/A ALA 927.A N SER 923.A O no hydrogen 3.098 N/A LEU 928.A N LYS 924.A O no hydrogen 3.017 N/A SER 929.A N VAL 925.A O no hydrogen 2.803 N/A SER 929.A OG VAL 925.A O no hydrogen 3.201 N/A ASN 931.A N ALA 926.A O no hydrogen 3.173 N/A ASN 931.A ND2 SER 929.A O no hydrogen 3.388 N/A GLY 933.A N LEU 707.A O no hydrogen 3.155 N/A ALA 935.A N THR 709.A O no hydrogen 2.983 N/A SER 936.A N ASP 934.A OD2 no hydrogen 3.228 N/A THR 939.A OG1 SER 936.A O no hydrogen 3.375 N/A THR 939.A OG1 PRO 937.A O no hydrogen 3.525 N/A GLY 945.A N THR 942.A O no hydrogen 3.222 N/A GLY 945.A N THR 942.A OG1 no hydrogen 2.783 N/A ILE 946.A N THR 942.A O no hydrogen 3.250 N/A SER 947.A N VAL 943.A O no hydrogen 2.966 N/A SER 947.A OG VAL 943.A O no hydrogen 2.887 N/A SER 947.A OG SER 957.A O no hydrogen 3.145 N/A LYS 948.A N GLU 944.A O no hydrogen 3.155 N/A LEU 949.A N GLY 945.A O no hydrogen 3.272 N/A LEU 950.A N ILE 946.A O no hydrogen 3.043 N/A ARG 951.A N SER 947.A O no hydrogen 3.200 N/A GLU 952.A N LYS 948.A O no hydrogen 3.298 N/A HIS 953.A N LEU 950.A O no hydrogen 3.328 N/A HIS 953.A ND1 LEU 949.A O no hydrogen 3.036 N/A GLY 954.A N LEU 950.A O no hydrogen 3.240 N/A TYR 955.A N LEU 950.A O no hydrogen 3.145 N/A TYR 955.A OH GLU 895.A OE1 no hydrogen 2.678 N/A TYR 955.A OH GLU 895.A OE2 no hydrogen 3.040 N/A ARG 958.A NH1 GLU 944.A OE2 no hydrogen 3.029 N/A ARG 958.A NH2 GLU 944.A OE1 no hydrogen 3.505 N/A ARG 958.A NH2 GLU 944.A OE2 no hydrogen 2.669 N/A GLY 959.A N GLN 956.A O no hydrogen 2.735 N/A GLU 961.A N ILE 976.A O no hydrogen 2.823 N/A TYR 964.A N PHE 892.A O no hydrogen 2.857 N/A ASN 965.A N LYS 970.A O no hydrogen 2.787 N/A GLY 966.A N TYR 734.A OH no hydrogen 2.833 N/A HIS 967.A N ASN 965.A OD1 no hydrogen 3.099 N/A THR 968.A N ASN 965.A OD1 no hydrogen 3.103 N/A THR 968.A OG1 ASN 965.A OD1 no hydrogen 2.985 N/A GLY 969.A N ASN 965.A O no hydrogen 2.756 N/A LYS 970.A N THR 968.A OG1 no hydrogen 3.372 N/A LEU 972.A N MET 963.A O no hydrogen 2.754 N/A ILE 976.A N GLU 961.A O no hydrogen 2.791 N/A GLY 979.A N VAL 729.A O no hydrogen 3.260 N/A THR 981.A N ALA 727.A O no hydrogen 2.931 N/A TYR 982.A N GLU 919.A OE2 no hydrogen 3.188 N/A TYR 982.A OH GLN 704.A O no hydrogen 3.000 N/A TYR 983.A N GLN 725.A O no hydrogen 3.002 N/A TYR 983.A OH HIS 916.A NE2 no hydrogen 3.287 N/A GLN 984.A N ALA 872.A O no hydrogen 2.748 N/A ARG 985.A NH1 PHE 755.A O no hydrogen 2.905 N/A ARG 985.A NH1 LYS 863.A O no hydrogen 3.243 N/A LEU 986.A N LYS 870.A O no hydrogen 3.253 N/A ARG 987.A N GLN 680.A O no hydrogen 2.993 N/A ARG 987.A NH2 LYS 679.A O no hydrogen 3.388 N/A HIS 988.A N LEU 986.A O no hydrogen 3.021 N/A VAL 990.A N ASP 869.A OD1 no hydrogen 3.296 N/A ASP 992.A N MET 989.A O no hydrogen 2.903 N/A LYS 993.A N VAL 990.A O no hydrogen 2.799 N/A ILE 994.A N VAL 990.A O no hydrogen 2.866 N/A ARG 997.A NH1 PRO 1001.A O no hydrogen 2.965 N/A ARG 997.A NH1 ASP 1016.A O no hydrogen 2.951 N/A ARG 997.A NH2 PRO 1001.A O no hydrogen 3.135 N/A GLN 1003.A N GLN 1008.A O no hydrogen 2.680 N/A THR 1006.A OG1 GLN 1003.A OE1 no hydrogen 3.271 N/A ARG 1007.A N GLN 1003.A O no hydrogen 3.073 N/A VAL 1010.A N PRO 1001.A O no hydrogen 3.151 N/A ARG 1013.A NH1 ILE 994.A O no hydrogen 2.675 N/A ARG 1015.A N GLY 1012.A O no hydrogen 2.899 N/A ASP 1016.A N ARG 1013.A O no hydrogen 3.282 N/A GLY 1017.A N GLY 1012.A O no hydrogen 2.811 N/A GLY 1018.A N VAL 1010.A O no hydrogen 2.908 N/A GLU 1025.A N GLY 1022.A O no hydrogen 3.023 N/A ARG 1026.A N GLY 1022.A O no hydrogen 3.122 N/A ARG 1026.A NE ASP 1027.A OD1 no hydrogen 3.068 N/A ARG 1026.A NH2 ASP 1027.A OD1 no hydrogen 2.577 N/A ASP 1027.A N GLU 1023.A O no hydrogen 3.226 N/A CYS 1028.A SG MET 1024.A O no hydrogen 3.029 N/A CYS 1028.A SG GLU 1025.A O no hydrogen 3.940 N/A MET 1029.A N GLU 1025.A O no hydrogen 3.026 N/A ILE 1030.A N ARG 1026.A O no hydrogen 2.846 N/A ALA 1031.A N ASP 1027.A O no hydrogen 2.885 N/A HIS 1032.A N CYS 1028.A O no hydrogen 2.885 N/A GLY 1033.A N ILE 1030.A O no hydrogen 2.726 N/A ALA 1034.A N MET 1029.A O no hydrogen 3.284 N/A ALA 1035.A N GLY 1033.A O no hydrogen 3.012 N/A LEU 1038.A N ALA 1034.A O no hydrogen 3.037 N/A LYS 1039.A N ALA 1035.A O no hydrogen 3.112 N/A GLU 1040.A N SER 1036.A O no hydrogen 2.876 N/A ARG 1041.A N PHE 1037.A O no hydrogen 2.973 N/A ARG 1041.A NH2 GLU 1040.A OE1 no hydrogen 3.296 N/A LEU 1042.A N LEU 1038.A O no hydrogen 2.833 N/A MET 1043.A N LYS 1039.A O no hydrogen 2.728 N/A ALA 1045.A N GLU 1040.A O no hydrogen 2.947 N/A ALA 1048.A N MET 1043.A O no hydrogen 3.422 N/A PHE 1049.A N ILE 1087.A O no hydrogen 2.997 N/A ARG 1050.A NH1 ARG 1050.A O no hydrogen 3.265 N/A VAL 1051.A N ILE 1085.A O no hydrogen 3.220 N/A ILE 1053.A N TYR 1083.A O no hydrogen 2.993 N/A CYS 1054.A N LEU 1059.A O no hydrogen 3.361 N/A GLY 1055.A N ASP 1081.A O no hydrogen 2.682 N/A CYS 1057.A SG CYS 1057.A O no hydrogen 2.853 N/A LEU 1059.A N CYS 1057.A O no hydrogen 2.704 N/A ILE 1063.A N GLU 1072.A O no hydrogen 2.737 N/A LYS 1065.A N ILE 1063.A O no hydrogen 3.096 N/A LYS 1065.A N GLN 1070.A O no hydrogen 2.906 N/A HIS 1068.A N LYS 1065.A O no hydrogen 3.035 N/A CYS 1073.A N ASN 1078.A O no hydrogen 3.045 N/A LYS 1074.A NZ THR 1061.A O no hydrogen 3.243 N/A CYS 1076.A N CYS 1073.A O no hydrogen 2.914 N/A ASN 1078.A ND2 ASP 1081.A O no hydrogen 2.870 N/A LYS 1079.A NZ PHE 1071.A O no hydrogen 2.775 N/A ILE 1080.A N ASN 1078.A OD1 no hydrogen 2.798 N/A ASP 1081.A N ASN 1078.A OD1 no hydrogen 2.619 N/A ILE 1082.A N ILE 1080.A O no hydrogen 2.989 N/A TYR 1083.A N ILE 1053.A O no hydrogen 3.188 N/A ILE 1085.A N VAL 1051.A O no hydrogen 2.984 N/A ILE 1087.A N PHE 1049.A O no hydrogen 2.984 N/A TYR 1089.A N ASP 1047.A O no hydrogen 3.071 N/A ALA 1090.A N ASP 1047.A OD1 no hydrogen 3.026 N/A ALA 1091.A N PRO 1088.A O no hydrogen 2.794 N/A LYS 1092.A N PRO 1088.A O no hydrogen 3.218 N/A LYS 1092.A NZ TYR 1089.A OH no hydrogen 3.331 N/A LYS 1092.A NZ GLN 1096.A OE1 no hydrogen 3.267 N/A LEU 1093.A N TYR 1089.A O no hydrogen 2.936 N/A LEU 1094.A N ALA 1090.A O no hydrogen 2.808 N/A PHE 1095.A N ALA 1091.A O no hydrogen 2.724 N/A GLN 1096.A N LYS 1092.A O no hydrogen 2.897 N/A GLU 1097.A N LEU 1093.A O no hydrogen 2.658 N/A LEU 1098.A N LEU 1094.A O no hydrogen 2.943 N/A MET 1099.A N PHE 1095.A O no hydrogen 2.946 N/A ALA 1100.A N GLN 1096.A O no hydrogen 2.833 N/A MET 1101.A N LEU 1098.A O no hydrogen 3.066 N/A ASN 1102.A N MET 1099.A O no hydrogen 2.850 N/A ILE 1103.A N LEU 1098.A O no hydrogen 3.005 N/A LEU 1107.A N GLY 1058.A O no hydrogen 2.572 N/A TYR 1108.A OH ILE 1056.A O no hydrogen 2.529 N/A