Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2p6u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N GLU 4.A OE2 no hydrogen 2.489 N/A ALA 7.A N VAL 3.A O no hydrogen 2.981 N/A GLU 8.A N GLU 4.A O no hydrogen 3.050 N/A SER 9.A N GLU 5.A O no hydrogen 2.997 N/A SER 9.A OG GLU 5.A O no hydrogen 3.341 N/A SER 9.A OG LEU 6.A O no hydrogen 2.466 N/A ILE 10.A N LEU 6.A O no hydrogen 2.763 N/A SER 11.A N ALA 7.A O no hydrogen 2.874 N/A SER 11.A OG ALA 7.A O no hydrogen 3.464 N/A SER 11.A OG GLU 8.A O no hydrogen 2.640 N/A SER 12.A N GLU 8.A O no hydrogen 3.031 N/A SER 12.A OG SER 9.A O no hydrogen 2.699 N/A TYR 13.A N SER 9.A O no hydrogen 3.232 N/A VAL 15.A N SER 11.A O no hydrogen 2.764 N/A ILE 17.A N VAL 15.A O no hydrogen 2.774 N/A GLU 27.A N ALA 23.A O no hydrogen 2.670 N/A LYS 28.A N GLU 24.A O no hydrogen 2.769 N/A LYS 28.A NZ TYR 188.A O no hydrogen 2.967 N/A VAL 29.A N ALA 25.A O no hydrogen 2.815 N/A PHE 30.A N VAL 26.A O no hydrogen 3.011 N/A SER 31.A N LYS 28.A O no hydrogen 2.615 N/A SER 31.A OG LYS 28.A O no hydrogen 2.762 N/A LYS 33.A N SER 31.A OG no hydrogen 2.962 N/A LYS 33.A NZ ASP 187.A OD2 no hydrogen 2.926 N/A ASN 34.A ND2 LEU 184.A O no hydrogen 2.685 N/A LEU 35.A N VAL 167.A O no hydrogen 3.066 N/A LEU 36.A N ASP 187.A O no hydrogen 3.096 N/A LEU 37.A N GLY 169.A O no hydrogen 2.848 N/A ALA 38.A N TYR 189.A O no hydrogen 2.967 N/A MET 39.A N SER 171.A O no hydrogen 3.011 N/A LYS 45.A NZ MET 39.A O no hydrogen 3.178 N/A LYS 45.A NZ PRO 40.A O no hydrogen 3.551 N/A LYS 45.A NZ THR 41.A O no hydrogen 3.432 N/A THR 46.A N ALA 42.A O no hydrogen 2.959 N/A THR 46.A N ALA 43.A O no hydrogen 3.220 N/A THR 46.A OG1 ALA 42.A O no hydrogen 3.460 N/A LEU 48.A N GLY 44.A O no hydrogen 3.294 N/A ALA 49.A N LYS 45.A O no hydrogen 3.284 N/A GLU 50.A N THR 46.A O no hydrogen 2.759 N/A MET 51.A N LEU 47.A O no hydrogen 2.853 N/A ALA 52.A N LEU 48.A O no hydrogen 2.865 N/A MET 53.A N ALA 49.A O no hydrogen 2.823 N/A VAL 54.A N GLU 50.A O no hydrogen 2.727 N/A ARG 55.A N MET 51.A O no hydrogen 2.766 N/A GLU 56.A N ALA 52.A O no hydrogen 3.021 N/A ALA 57.A N MET 53.A O no hydrogen 2.730 N/A ILE 58.A N VAL 54.A O no hydrogen 3.081 N/A LYS 59.A N ARG 55.A O no hydrogen 2.943 N/A GLY 60.A N ALA 57.A O no hydrogen 2.560 N/A GLY 61.A N GLU 56.A O no hydrogen 2.736 N/A LYS 62.A N SER 132.A OG no hydrogen 2.931 N/A LYS 62.A NZ GLY 105.A O no hydrogen 3.493 N/A LYS 62.A NZ CYS 107.A O no hydrogen 2.599 N/A SER 63.A N ASP 108.A O no hydrogen 2.887 N/A LEU 64.A N CYS 133.A O no hydrogen 2.962 N/A VAL 66.A N VAL 135.A O no hydrogen 2.865 N/A VAL 67.A N THR 112.A O no hydrogen 3.005 N/A ARG 70.A NH1 GLU 115.A OE2 no hydrogen 2.676 N/A ALA 73.A N LEU 69.A O no hydrogen 3.421 N/A GLY 74.A N ALA 71.A O no hydrogen 3.013 N/A GLU 75.A N ALA 71.A O no hydrogen 3.516 N/A LYS 76.A N LEU 72.A O no hydrogen 2.687 N/A LYS 76.A NZ TYR 65.A OH no hydrogen 2.920 N/A TYR 77.A N ALA 73.A O no hydrogen 2.829 N/A GLU 78.A N GLY 74.A O no hydrogen 2.922 N/A SER 79.A N GLU 75.A O no hydrogen 3.095 N/A PHE 80.A N LYS 76.A O no hydrogen 2.934 N/A PHE 80.A N TYR 77.A O no hydrogen 3.032 N/A LYS 81.A N GLU 78.A O no hydrogen 2.687 N/A LYS 81.A NZ GLU 78.A OE2 no hydrogen 2.540 N/A TRP 83.A N PHE 80.A O no hydrogen 2.959 N/A TRP 83.A NE1 GLU 50.A OE1 no hydrogen 2.697 N/A GLU 84.A N LYS 81.A O no hydrogen 2.919 N/A LYS 85.A NZ ALA 14.A O no hydrogen 2.701 N/A ILE 86.A N TRP 83.A O no hydrogen 3.383 N/A GLY 87.A N GLU 84.A O no hydrogen 2.695 N/A LEU 88.A N TRP 83.A O no hydrogen 3.127 N/A ARG 89.A N ASP 108.A OD1 no hydrogen 2.756 N/A GLY 91.A N ILE 109.A O no hydrogen 2.955 N/A SER 93.A N VAL 111.A O no hydrogen 3.198 N/A SER 93.A OG ASP 101.A OD1 no hydrogen 2.949 N/A SER 99.A N TYR 97.A O no hydrogen 2.643 N/A SER 99.A OG ASP 101.A OD2 no hydrogen 2.597 N/A ARG 100.A NE ASN 123.A O no hydrogen 2.956 N/A LEU 104.A N ASP 101.A O no hydrogen 3.102 N/A ASP 108.A N ARG 89.A O no hydrogen 2.687 N/A ILE 110.A N SER 63.A O no hydrogen 3.065 N/A VAL 111.A N GLY 91.A O no hydrogen 2.968 N/A THR 112.A N TYR 65.A O no hydrogen 3.221 N/A THR 112.A OG1 THR 113.A O no hydrogen 2.833 N/A SER 114.A N VAL 67.A O no hydrogen 2.891 N/A SER 114.A OG VAL 67.A O no hydrogen 3.283 N/A LYS 116.A N THR 113.A OG1 no hydrogen 3.234 N/A LYS 116.A NZ ASP 96.A O no hydrogen 2.340 N/A LYS 116.A NZ ASP 101.A OD2 no hydrogen 3.337 N/A ALA 117.A N THR 113.A O no hydrogen 2.825 N/A ASP 118.A N SER 114.A O no hydrogen 2.897 N/A SER 119.A N GLU 115.A O no hydrogen 2.730 N/A SER 119.A OG TYR 97.A O no hydrogen 3.454 N/A LEU 120.A N LYS 116.A O no hydrogen 2.772 N/A ILE 121.A N ALA 117.A O no hydrogen 2.916 N/A ARG 122.A N ASP 118.A O no hydrogen 2.907 N/A ARG 122.A NE SER 469.A O no hydrogen 3.278 N/A ASN 123.A N SER 119.A O no hydrogen 2.695 N/A ASN 123.A ND2 SER 119.A O no hydrogen 2.839 N/A ARG 124.A N ILE 121.A O no hydrogen 2.834 N/A ALA 125.A N LEU 120.A O no hydrogen 2.923 N/A SER 126.A N GLU 102.A OE1 no hydrogen 3.379 N/A SER 126.A N GLU 102.A OE2 no hydrogen 3.376 N/A SER 126.A OG GLU 102.A OE1 no hydrogen 3.510 N/A SER 126.A OG GLU 102.A OE2 no hydrogen 2.547 N/A TRP 127.A NE1 ARG 100.A O no hydrogen 3.156 N/A ALA 130.A N TRP 127.A O no hydrogen 2.530 N/A VAL 131.A N ILE 128.A O no hydrogen 2.734 N/A SER 132.A N LYS 62.A O no hydrogen 2.905 N/A SER 132.A OG GLU 56.A OE1 no hydrogen 2.428 N/A SER 132.A OG LYS 62.A O no hydrogen 3.127 N/A CYS 133.A N LYS 62.A O no hydrogen 3.028 N/A CYS 133.A SG ARG 166.A O no hydrogen 3.655 N/A LEU 134.A N ARG 166.A O no hydrogen 3.008 N/A VAL 135.A N LEU 64.A O no hydrogen 3.404 N/A VAL 136.A N ILE 168.A O no hydrogen 2.861 N/A ASP 137.A N VAL 66.A O no hydrogen 3.153 N/A GLU 138.A N ASP 137.A OD1 no hydrogen 2.545 N/A ILE 139.A N LEU 170.A O no hydrogen 2.848 N/A LEU 141.A N GLU 138.A O no hydrogen 2.968 N/A LEU 142.A N ILE 139.A O no hydrogen 3.002 N/A ASP 143.A N HIS 140.A O no hydrogen 3.145 N/A SER 144.A N LEU 141.A O no hydrogen 2.768 N/A LYS 146.A N SER 144.A OG no hydrogen 3.320 N/A ARG 147.A N SER 144.A OG no hydrogen 2.969 N/A GLY 148.A N SER 144.A O no hydrogen 2.658 N/A THR 150.A N ARG 147.A O no hydrogen 3.066 N/A THR 150.A OG1 ARG 147.A O no hydrogen 3.301 N/A GLU 152.A N GLY 148.A O no hydrogen 3.056 N/A ILE 153.A N ALA 149.A O no hydrogen 2.991 N/A LEU 154.A N THR 150.A O no hydrogen 2.650 N/A VAL 155.A N LEU 151.A O no hydrogen 3.030 N/A THR 156.A N GLU 152.A O no hydrogen 3.034 N/A THR 156.A OG1 GLU 152.A O no hydrogen 2.715 N/A LYS 157.A N ILE 153.A O no hydrogen 2.758 N/A LYS 157.A NZ ASP 118.A OD1 no hydrogen 2.664 N/A LYS 157.A NZ SER 406.A OG no hydrogen 2.836 N/A LYS 157.A NZ ASP 410.A OD1 no hydrogen 3.436 N/A MET 158.A N LEU 154.A O no hydrogen 2.857 N/A ARG 159.A N VAL 155.A O no hydrogen 2.783 N/A ARG 159.A NH1 ASP 185.A OD2 no hydrogen 3.265 N/A ARG 159.A NH2 ASP 185.A OD2 no hydrogen 3.528 N/A ARG 160.A N THR 156.A O no hydrogen 2.760 N/A ARG 160.A NE ASP 425.A OD1 no hydrogen 3.021 N/A ARG 160.A NH1 ASP 425.A OD1 no hydrogen 3.089 N/A MET 161.A N LYS 157.A O no hydrogen 3.036 N/A MET 161.A N MET 158.A O no hydrogen 3.158 N/A ASN 162.A N MET 158.A O no hydrogen 3.023 N/A LEU 165.A N ASN 162.A O no hydrogen 2.972 N/A ARG 166.A N SER 132.A O no hydrogen 2.907 N/A ARG 166.A NE LYS 33.A O no hydrogen 2.737 N/A ARG 166.A NH1 VAL 29.A O no hydrogen 2.884 N/A ARG 166.A NH2 VAL 29.A O no hydrogen 2.821 N/A ARG 166.A NH2 LYS 33.A O no hydrogen 3.119 N/A VAL 167.A N ASN 34.A OD1 no hydrogen 3.121 N/A ILE 168.A N LEU 134.A O no hydrogen 2.911 N/A GLY 169.A N LEU 35.A O no hydrogen 2.940 N/A LEU 170.A N VAL 136.A O no hydrogen 3.002 N/A SER 171.A N LEU 37.A O no hydrogen 2.747 N/A SER 171.A OG ALA 172.A O no hydrogen 2.720 N/A ALA 172.A N HIS 140.A ND1 no hydrogen 3.197 N/A ASN 176.A N ASN 176.A OD1 no hydrogen 2.574 N/A ASN 176.A ND2 GLU 179.A OE2 no hydrogen 2.840 N/A ASN 176.A ND2 ILE 390.A O no hydrogen 2.501 N/A GLU 179.A N ASN 176.A O no hydrogen 2.717 N/A ILE 180.A N ASN 176.A O no hydrogen 3.462 N/A ALA 181.A N VAL 177.A O no hydrogen 3.166 N/A GLU 182.A N THR 178.A O no hydrogen 2.894 N/A TRP 183.A N GLU 179.A O no hydrogen 2.793 N/A TRP 183.A NE1 ASP 425.A O no hydrogen 3.023 N/A LEU 184.A N ILE 180.A O no hydrogen 2.800 N/A ASP 185.A N GLU 182.A O no hydrogen 2.755 N/A ALA 186.A N ALA 181.A O no hydrogen 2.732 N/A ASP 187.A N ASN 34.A O no hydrogen 2.952 N/A TYR 189.A N LEU 36.A O no hydrogen 2.985 N/A SER 191.A N ALA 38.A O no hydrogen 3.148 N/A TRP 193.A N SER 191.A OG no hydrogen 2.883 N/A VAL 199.A N GLY 364.A O no hydrogen 2.686 N/A GLY 201.A N ALA 366.A O no hydrogen 2.878 N/A LEU 203.A N ILE 368.A O no hydrogen 3.167 N/A CYS 204.A N THR 207.A O no hydrogen 2.680 N/A CYS 204.A SG VAL 370.A O no hydrogen 3.827 N/A CYS 204.A SG GLY 371.A O no hydrogen 2.701 N/A THR 207.A N CYS 204.A O no hydrogen 2.373 N/A THR 207.A OG1 GLU 205.A O no hydrogen 3.401 N/A LEU 208.A N ARG 219.A O no hydrogen 2.854 N/A GLU 209.A N VAL 202.A O no hydrogen 3.005 N/A PHE 211.A N GLU 200.A O no hydrogen 3.233 N/A ASP 212.A N PHE 215.A O no hydrogen 3.306 N/A PHE 215.A N ASP 212.A O no hydrogen 3.305 N/A THR 217.A N LEU 210.A O no hydrogen 3.108 N/A VAL 221.A N GLY 206.A O no hydrogen 2.654 N/A GLU 225.A N LYS 222.A O no hydrogen 2.635 N/A LEU 226.A N LYS 222.A O no hydrogen 3.035 N/A VAL 227.A N PHE 223.A O no hydrogen 3.107 N/A GLU 228.A N GLU 224.A O no hydrogen 3.308 N/A GLU 229.A N GLU 225.A O no hydrogen 2.608 N/A CYS 230.A N LEU 226.A O no hydrogen 3.523 N/A VAL 231.A N VAL 227.A O no hydrogen 2.794 N/A ALA 232.A N GLU 228.A O no hydrogen 2.373 N/A GLU 233.A N GLU 229.A O no hydrogen 3.200 N/A ASN 234.A N VAL 231.A O no hydrogen 2.755 N/A GLY 235.A N CYS 230.A O no hydrogen 3.134 N/A VAL 237.A N LYS 316.A O no hydrogen 3.322 N/A LEU 238.A N ARG 331.A O no hydrogen 3.043 N/A VAL 239.A N VAL 318.A O no hydrogen 3.120 N/A PHE 240.A N ILE 333.A O no hydrogen 2.983 N/A GLU 241.A N ALA 320.A O no hydrogen 2.868 N/A SER 242.A OG SER 242.A O no hydrogen 2.660 N/A ARG 244.A NH1 ASP 574.A OD2 no hydrogen 2.834 N/A ARG 244.A NH2 ASP 574.A OD1 no hydrogen 2.823 N/A ARG 244.A NH2 ASP 574.A OD2 no hydrogen 3.241 N/A ALA 247.A N THR 243.A O no hydrogen 3.395 N/A GLU 248.A N ARG 244.A O no hydrogen 3.130 N/A LYS 249.A N ARG 245.A O no hydrogen 2.866 N/A THR 250.A N GLY 246.A O no hydrogen 3.097 N/A THR 250.A OG1 GLU 241.A OE1 no hydrogen 2.592 N/A THR 250.A OG1 GLY 246.A O no hydrogen 3.446 N/A ALA 251.A N ALA 247.A O no hydrogen 2.758 N/A VAL 252.A N GLU 248.A O no hydrogen 3.072 N/A VAL 252.A N LYS 249.A O no hydrogen 3.272 N/A LYS 253.A N LYS 249.A O no hydrogen 3.394 N/A LEU 254.A N THR 250.A O no hydrogen 3.166 N/A SER 255.A N VAL 252.A O no hydrogen 2.605 N/A SER 255.A OG VAL 252.A O no hydrogen 2.150 N/A ALA 256.A N LYS 253.A O no hydrogen 2.889 N/A THR 258.A N LEU 254.A O no hydrogen 2.829 N/A THR 258.A OG1 LEU 254.A O no hydrogen 2.984 N/A THR 258.A OG1 LYS 289.A O no hydrogen 2.538 N/A ALA 259.A N SER 255.A O no hydrogen 2.685 N/A LYS 260.A NZ GLU 228.A OE1 no hydrogen 3.345 N/A TYR 261.A N THR 258.A O no hydrogen 3.441 N/A TYR 261.A OH GLU 228.A OE1 no hydrogen 2.954 N/A VAL 262.A N THR 258.A O no hydrogen 3.257 N/A ASN 264.A ND2 ASN 314.A O no hydrogen 2.587 N/A ILE 271.A N LEU 267.A O no hydrogen 3.178 N/A ASN 275.A ND2 SER 280.A OG no hydrogen 2.730 N/A ARG 281.A N GLY 277.A O no hydrogen 2.977 N/A LYS 282.A N GLU 278.A O no hydrogen 3.165 N/A LEU 283.A N MET 279.A O no hydrogen 3.112 N/A ALA 284.A N SER 280.A O no hydrogen 2.920 N/A GLU 285.A N ARG 281.A O no hydrogen 3.275 N/A CYS 286.A N LYS 282.A O no hydrogen 2.860 N/A CYS 286.A SG ALA 251.A O no hydrogen 3.342 N/A VAL 287.A N LEU 283.A O no hydrogen 2.890 N/A ARG 288.A N ALA 284.A O no hydrogen 3.107 N/A LYS 289.A N GLU 285.A O no hydrogen 3.163 N/A LYS 289.A N CYS 286.A O no hydrogen 3.061 N/A GLY 290.A N VAL 287.A O no hydrogen 2.906 N/A ALA 291.A N LYS 289.A O no hydrogen 2.941 N/A HIS 294.A N VAL 319.A O no hydrogen 2.970 N/A LEU 298.A N HIS 295.A O no hydrogen 3.137 N/A LEU 299.A N GLN 302.A OE1 no hydrogen 3.401 N/A GLN 302.A NE2 SER 280.A OG no hydrogen 2.986 N/A ARG 303.A N LEU 299.A O no hydrogen 2.864 N/A ARG 303.A NH2 HIS 295.A O no hydrogen 3.100 N/A ARG 303.A NH2 LEU 298.A O no hydrogen 2.653 N/A ARG 304.A N ASN 300.A O no hydrogen 3.214 N/A VAL 305.A N GLY 301.A O no hydrogen 2.945 N/A VAL 306.A N GLN 302.A O no hydrogen 3.132 N/A GLU 307.A N ARG 303.A O no hydrogen 2.791 N/A ASP 308.A N ARG 304.A O no hydrogen 3.099 N/A ALA 309.A N VAL 305.A O no hydrogen 3.163 N/A PHE 310.A N VAL 306.A O no hydrogen 3.034 N/A ARG 311.A N GLU 307.A O no hydrogen 3.034 N/A ARG 311.A NE ASN 326.A O no hydrogen 3.306 N/A ARG 311.A NH1 GLU 75.A OE2 no hydrogen 2.995 N/A ARG 311.A NH1 ASN 326.A O no hydrogen 3.238 N/A ARG 312.A N ASP 308.A O no hydrogen 3.147 N/A GLY 313.A N ALA 309.A O no hydrogen 2.942 N/A ILE 315.A N ALA 309.A O no hydrogen 3.151 N/A LYS 316.A N GLY 290.A O no hydrogen 3.133 N/A LYS 316.A NZ VAL 231.A O no hydrogen 2.780 N/A VAL 318.A N VAL 237.A O no hydrogen 3.398 N/A VAL 319.A N ALA 292.A O no hydrogen 2.872 N/A ALA 320.A N VAL 239.A O no hydrogen 2.948 N/A THR 321.A OG1 THR 323.A OG1 no hydrogen 2.848 N/A THR 323.A OG1 THR 321.A OG1 no hydrogen 2.848 N/A LEU 324.A N THR 321.A O no hydrogen 2.853 N/A ARG 330.A N GLY 235.A O no hydrogen 2.680 N/A ARG 330.A NE ASP 361.A OD1 no hydrogen 3.017 N/A ARG 330.A NE ASP 361.A OD2 no hydrogen 2.965 N/A ARG 330.A NH1 ASP 361.A OD2 no hydrogen 2.775 N/A ARG 331.A N GLY 236.A O no hydrogen 3.034 N/A VAL 332.A N GLU 365.A O no hydrogen 3.052 N/A ILE 333.A N LEU 238.A O no hydrogen 2.837 N/A VAL 334.A N ILE 367.A O no hydrogen 2.826 N/A ARG 335.A N PHE 240.A O no hydrogen 3.055 N/A ARG 335.A NE GLU 241.A OE1 no hydrogen 3.382 N/A ILE 343.A N LEU 337.A O no hydrogen 2.942 N/A LYS 344.A N GLU 347.A OE1 no hydrogen 3.156 N/A SER 346.A N GLU 388.A OE2 no hydrogen 2.807 N/A SER 346.A OG GLU 388.A OE2 no hydrogen 3.241 N/A TYR 348.A N LYS 344.A O no hydrogen 3.111 N/A TYR 348.A OH GLU 200.A OE1 no hydrogen 2.548 N/A LYS 349.A N VAL 345.A O no hydrogen 2.735 N/A LYS 349.A NZ GLU 200.A OE1 no hydrogen 3.107 N/A LYS 349.A NZ GLU 200.A OE2 no hydrogen 3.101 N/A LYS 349.A NZ TYR 382.A O no hydrogen 3.237 N/A LYS 349.A NZ ILE 383.A O no hydrogen 3.021 N/A GLN 350.A N SER 346.A O no hydrogen 2.734 N/A MET 351.A N GLU 347.A O no hydrogen 2.814 N/A ALA 352.A N TYR 348.A O no hydrogen 2.664 N/A GLY 353.A N LYS 349.A O no hydrogen 2.668 N/A ARG 354.A N MET 351.A O no hydrogen 3.225 N/A ARG 354.A NH1 LEU 324.A O no hydrogen 2.997 N/A ARG 354.A NH1 VAL 325.A O no hydrogen 3.068 N/A ARG 354.A NH2 GLN 350.A OE1 no hydrogen 3.236 N/A ALA 355.A N ALA 352.A O no hydrogen 2.878 N/A ARG 357.A NE GLY 235.A O no hydrogen 2.398 N/A ASP 361.A N ARG 357.A O no hydrogen 3.105 N/A ALA 366.A N VAL 199.A O no hydrogen 3.080 N/A ILE 367.A N VAL 332.A O no hydrogen 3.009 N/A ILE 368.A N GLY 201.A O no hydrogen 2.924 N/A ILE 369.A N VAL 334.A O no hydrogen 2.992 N/A VAL 370.A N LEU 203.A O no hydrogen 3.231 N/A ILE 377.A N ASP 374.A O no hydrogen 3.173 N/A ALA 378.A N ARG 375.A O no hydrogen 2.990 N/A VAL 379.A N GLU 376.A O no hydrogen 2.946 N/A LYS 380.A N GLU 376.A O no hydrogen 2.390 N/A ARG 381.A N ILE 377.A O no hydrogen 2.885 N/A TYR 382.A N ILE 377.A O no hydrogen 3.354 N/A TYR 382.A OH ILE 343.A O no hydrogen 2.626 N/A ILE 383.A N ALA 378.A O no hydrogen 3.003 N/A PHE 384.A N VAL 379.A O no hydrogen 2.879 N/A ARG 389.A NH2 GLU 179.A OE1 no hydrogen 3.415 N/A ILE 390.A N ASN 176.A OD1 no hydrogen 2.775 N/A THR 391.A N ASP 143.A OD2 no hydrogen 2.921 N/A THR 391.A OG1 ASP 143.A OD2 no hydrogen 3.171 N/A SER 392.A N GLN 431.A OE1 no hydrogen 2.609 N/A SER 392.A OG GLU 152.A OE1 no hydrogen 2.756 N/A SER 392.A OG GLU 152.A OE2 no hydrogen 3.262 N/A LYS 393.A NZ ASP 143.A O no hydrogen 3.143 N/A LYS 393.A NZ ASP 143.A OD2 no hydrogen 3.130 N/A LYS 393.A NZ THR 391.A O no hydrogen 3.185 N/A LYS 393.A NZ THR 391.A OG1 no hydrogen 2.731 N/A LEU 400.A N VAL 396.A O no hydrogen 3.293 N/A ARG 401.A N GLU 397.A O no hydrogen 2.777 N/A ARG 401.A NH2 ASP 474.A OD2 no hydrogen 3.409 N/A PHE 402.A N THR 398.A O no hydrogen 2.837 N/A HIS 403.A N HIS 399.A O no hydrogen 2.791 N/A SER 404.A N LEU 400.A O no hydrogen 2.767 N/A SER 404.A OG LEU 400.A O no hydrogen 2.218 N/A LEU 405.A N ARG 401.A O no hydrogen 3.247 N/A ILE 407.A N HIS 403.A O no hydrogen 2.780 N/A ILE 408.A N SER 404.A O no hydrogen 2.710 N/A CYS 409.A N LEU 405.A O no hydrogen 3.060 N/A CYS 409.A N SER 406.A O no hydrogen 3.208 N/A CYS 409.A SG LEU 405.A O no hydrogen 2.910 N/A ASP 410.A N SER 406.A O no hydrogen 2.807 N/A TYR 412.A N ILE 407.A O no hydrogen 3.163 N/A LYS 414.A N GLU 418.A OE2 no hydrogen 2.874 N/A THR 415.A OG1 GLU 418.A OE1 no hydrogen 2.891 N/A GLU 418.A N THR 415.A OG1 no hydrogen 3.136 N/A LEU 419.A N LEU 416.A O no hydrogen 3.094 N/A GLU 420.A N LEU 416.A O no hydrogen 2.903 N/A ASP 421.A N GLU 417.A O no hydrogen 2.784 N/A PHE 422.A N GLU 418.A O no hydrogen 3.210 N/A PHE 423.A N LEU 419.A O no hydrogen 3.155 N/A ALA 424.A N ASP 421.A O no hydrogen 2.822 N/A ASP 425.A N ASP 421.A O no hydrogen 3.364 N/A ASP 425.A N PHE 422.A O no hydrogen 2.828 N/A THR 426.A N PHE 423.A O no hydrogen 3.301 N/A THR 426.A OG1 PHE 423.A O no hydrogen 2.728 N/A LYS 430.A N THR 426.A O no hydrogen 3.171 N/A GLN 431.A N PHE 427.A O no hydrogen 3.004 N/A GLN 431.A NE2 GLU 179.A OE2 no hydrogen 3.202 N/A GLN 431.A NE2 ILE 390.A O no hydrogen 2.714 N/A ASN 432.A N PHE 428.A O no hydrogen 2.959 N/A GLU 433.A N PHE 429.A O no hydrogen 2.560 N/A SER 437.A N SER 435.A OG no hydrogen 3.281 N/A SER 437.A OG GLU 420.A OE2 no hydrogen 2.686 N/A SER 437.A OG SER 435.A OG no hydrogen 2.564 N/A LEU 440.A N LEU 436.A O no hydrogen 2.648 N/A GLU 441.A N TYR 438.A O no hydrogen 2.772 N/A ARG 442.A N TYR 438.A O no hydrogen 3.127 N/A ARG 442.A NH1 TYR 438.A OH no hydrogen 3.349 N/A VAL 443.A N GLU 439.A O no hydrogen 2.779 N/A VAL 444.A N LEU 440.A O no hydrogen 3.326 N/A ARG 445.A N GLU 441.A O no hydrogen 3.154 N/A ARG 445.A N ARG 442.A O no hydrogen 3.211 N/A GLN 446.A N ARG 442.A O no hydrogen 3.045 N/A LEU 447.A N VAL 443.A O no hydrogen 2.784 N/A GLU 448.A N VAL 444.A O no hydrogen 3.114 N/A ASN 449.A N ARG 445.A O no hydrogen 2.641 N/A TRP 450.A N GLN 446.A O no hydrogen 2.969 N/A GLY 451.A N GLU 448.A O no hydrogen 2.740 N/A MET 452.A N LEU 447.A O no hydrogen 2.944 N/A VAL 453.A N LEU 447.A O no hydrogen 3.092 N/A VAL 454.A N ALA 460.A O no hydrogen 2.834 N/A ALA 456.A N HIS 458.A O no hydrogen 2.975 N/A LEU 459.A N LYS 414.A O no hydrogen 2.751 N/A ALA 460.A N VAL 454.A O no hydrogen 3.113 N/A THR 462.A N MET 452.A O no hydrogen 2.830 N/A THR 462.A OG1 GLY 451.A O no hydrogen 2.732 N/A THR 462.A OG1 MET 452.A O no hydrogen 3.461 N/A GLY 465.A N THR 462.A OG1 no hydrogen 3.070 N/A SER 466.A N THR 462.A O no hydrogen 2.954 N/A SER 466.A OG THR 462.A O no hydrogen 3.010 N/A LEU 467.A N LYS 463.A O no hydrogen 3.075 N/A VAL 468.A N LEU 464.A O no hydrogen 2.723 N/A SER 469.A N GLY 465.A O no hydrogen 2.730 N/A ARG 470.A N SER 466.A O no hydrogen 2.916 N/A ARG 470.A NH2 GLU 98.A OE1 no hydrogen 3.562 N/A ARG 470.A NH2 GLU 98.A OE2 no hydrogen 3.416 N/A LEU 471.A N LEU 467.A O no hydrogen 2.806 N/A TYR 472.A N SER 469.A O no hydrogen 3.003 N/A TYR 472.A OH ASP 118.A OD2 no hydrogen 3.117 N/A ASP 474.A N ASP 504.A OD1 no hydrogen 2.609 N/A LEU 476.A N ASP 474.A OD1 no hydrogen 3.014 N/A THR 477.A OG1 THR 502.A OG1 no hydrogen 2.786 N/A GLY 478.A N ASP 474.A O no hydrogen 2.990 N/A PHE 479.A N PRO 475.A O no hydrogen 2.888 N/A ILE 480.A N LEU 476.A O no hydrogen 2.862 N/A PHE 481.A N THR 477.A O no hydrogen 2.999 N/A HIS 482.A N GLY 478.A O no hydrogen 2.979 N/A ASP 483.A N PHE 479.A O no hydrogen 2.648 N/A VAL 484.A N ILE 480.A O no hydrogen 3.213 N/A LEU 485.A N PHE 481.A O no hydrogen 2.884 N/A SER 486.A N HIS 482.A O no hydrogen 3.223 N/A SER 486.A OG HIS 482.A O no hydrogen 2.709 N/A SER 486.A OG ASP 483.A O no hydrogen 2.897 N/A ARG 487.A N ASP 483.A O no hydrogen 3.189 N/A ARG 487.A N VAL 484.A O no hydrogen 3.169 N/A ARG 487.A NH2 ASP 483.A OD2 no hydrogen 3.165 N/A MET 488.A N VAL 484.A O no hydrogen 2.839 N/A SER 491.A OG GLU 527.A OE2 no hydrogen 3.390 N/A GLY 494.A N SER 491.A OG no hydrogen 3.376 N/A ALA 495.A N SER 491.A O no hydrogen 2.547 N/A ALA 495.A N ASP 492.A O no hydrogen 2.729 N/A LEU 496.A N ASP 492.A O no hydrogen 2.687 N/A HIS 497.A N ILE 493.A O no hydrogen 2.714 N/A LEU 498.A N GLY 494.A O no hydrogen 3.137 N/A ILE 499.A N ALA 495.A O no hydrogen 3.134 N/A CYS 500.A N LEU 496.A O no hydrogen 3.182 N/A CYS 500.A SG LEU 496.A O no hydrogen 3.378 N/A ARG 501.A N LEU 498.A O no hydrogen 2.948 N/A ARG 501.A NH2 SER 529.A OG no hydrogen 3.051 N/A THR 502.A N LEU 498.A O no hydrogen 3.397 N/A THR 502.A N ILE 499.A O no hydrogen 2.780 N/A THR 502.A OG1 THR 477.A OG1 no hydrogen 2.786 N/A ARG 507.A NE CYS 500.A O no hydrogen 3.165 N/A ARG 507.A NH1 THR 502.A O no hydrogen 2.918 N/A LEU 508.A N THR 548.A OG1 no hydrogen 2.944 N/A ARG 511.A N ASP 514.A OD1 no hydrogen 3.253 N/A ASP 514.A N ARG 511.A O no hydrogen 3.017 N/A SER 515.A N THR 513.A O no hydrogen 2.576 N/A SER 515.A OG THR 513.A O no hydrogen 3.545 N/A GLU 518.A N SER 515.A O no hydrogen 2.984 N/A GLU 520.A N TRP 516.A O no hydrogen 2.665 N/A ALA 521.A N VAL 517.A O no hydrogen 2.751 N/A PHE 522.A N GLU 518.A O no hydrogen 3.237 N/A PHE 522.A N GLU 519.A O no hydrogen 2.762 N/A ARG 523.A N GLU 519.A O no hydrogen 3.045 N/A LEU 524.A N GLU 520.A O no hydrogen 2.919 N/A ARG 525.A N PHE 522.A O no hydrogen 2.561 N/A ARG 525.A NH1 PHE 522.A O no hydrogen 3.006 N/A GLU 527.A N LEU 524.A O no hydrogen 2.978 N/A TYR 530.A OH GLU 545.A OE2 no hydrogen 2.513 N/A PHE 535.A N SER 533.A OG no hydrogen 3.206 N/A SER 536.A N SER 533.A O no hydrogen 2.976 N/A TYR 539.A N SER 536.A O no hydrogen 3.296 N/A TYR 539.A OH GLU 518.A OE1 no hydrogen 3.173 N/A PHE 542.A N GLU 538.A O no hydrogen 2.814 N/A LEU 543.A N TYR 539.A O no hydrogen 2.972 N/A SER 544.A N ASP 540.A O no hydrogen 3.217 N/A SER 544.A OG LEU 508.A O no hydrogen 2.495 N/A GLU 545.A N TRP 541.A O no hydrogen 3.270 N/A VAL 546.A N PHE 542.A O no hydrogen 3.022 N/A LYS 547.A N LEU 543.A O no hydrogen 2.849 N/A LYS 547.A NZ THR 509.A O no hydrogen 3.405 N/A LYS 547.A NZ ASP 514.A OD1 no hydrogen 2.181 N/A LYS 547.A NZ TYR 568.A O no hydrogen 3.114 N/A THR 548.A N SER 544.A O no hydrogen 2.787 N/A THR 548.A OG1 SER 544.A O no hydrogen 2.792 N/A ALA 549.A N GLU 545.A O no hydrogen 2.919 N/A LEU 550.A N VAL 546.A O no hydrogen 2.641 N/A CYS 551.A N LYS 547.A O no hydrogen 3.020 N/A LEU 552.A N THR 548.A O no hydrogen 3.051 N/A LYS 553.A N ALA 549.A O no hydrogen 2.859 N/A LYS 553.A NZ GLU 557.A OE2 no hydrogen 3.120 N/A ASP 554.A N LEU 550.A O no hydrogen 2.990 N/A TRP 555.A N CYS 551.A O no hydrogen 2.972 N/A TRP 555.A NE1 ILE 608.A O no hydrogen 2.368 N/A ILE 556.A N LEU 552.A O no hydrogen 2.728 N/A GLU 557.A N LYS 553.A O no hydrogen 2.599 N/A GLU 557.A N ASP 554.A O no hydrogen 2.993 N/A GLU 558.A N TRP 555.A O no hydrogen 3.232 N/A LYS 559.A N ASP 554.A O no hydrogen 2.955 N/A LYS 559.A NZ GLU 563.A OE2 no hydrogen 3.072 N/A ILE 564.A N ASP 560.A O no hydrogen 2.725 N/A CYS 565.A N GLU 561.A O no hydrogen 2.744 N/A CYS 565.A SG GLU 561.A O no hydrogen 3.664 N/A ALA 566.A N ASP 562.A O no hydrogen 2.892 N/A LYS 567.A N GLU 563.A O no hydrogen 2.832 N/A LYS 567.A NZ ASP 554.A OD1 no hydrogen 2.603 N/A LYS 567.A NZ ASP 554.A OD2 no hydrogen 3.497 N/A LYS 567.A NZ TYR 568.A OH no hydrogen 3.328 N/A TYR 568.A N ILE 564.A O no hydrogen 2.995 N/A TYR 568.A OH ASP 554.A OD1 no hydrogen 3.134 N/A GLY 569.A N CYS 565.A O no hydrogen 2.690 N/A GLY 569.A N ALA 566.A O no hydrogen 3.261 N/A ILE 570.A N CYS 565.A O no hydrogen 3.176 N/A ALA 571.A N ASP 574.A OD1 no hydrogen 3.167 N/A GLY 573.A N GLY 297.A O no hydrogen 2.704 N/A LEU 575.A N ALA 571.A O no hydrogen 3.052 N/A ARG 576.A N PRO 572.A O no hydrogen 2.912 N/A ARG 576.A NH1 GLU 561.A OE1 no hydrogen 2.971 N/A ARG 576.A NH2 GLU 561.A OE1 no hydrogen 2.849 N/A ARG 577.A N GLY 573.A O no hydrogen 2.783 N/A ARG 577.A NE GLU 506.A OE1 no hydrogen 3.172 N/A ARG 577.A NH1 ASP 574.A OD2 no hydrogen 2.580 N/A ARG 577.A NH2 ALA 296.A O no hydrogen 3.446 N/A ARG 577.A NH2 ASP 574.A OD2 no hydrogen 3.015 N/A ILE 578.A N ASP 574.A O no hydrogen 2.684 N/A VAL 579.A N LEU 575.A O no hydrogen 2.889 N/A GLU 580.A N ARG 576.A O no hydrogen 2.849 N/A THR 581.A N ARG 577.A O no hydrogen 2.982 N/A THR 581.A OG1 ARG 577.A O no hydrogen 2.973 N/A ALA 582.A N ILE 578.A O no hydrogen 2.706 N/A GLU 583.A N VAL 579.A O no hydrogen 2.863 N/A TRP 584.A N GLU 580.A O no hydrogen 3.476 N/A LEU 585.A N THR 581.A O no hydrogen 3.149 N/A SER 586.A N ALA 582.A O no hydrogen 2.807 N/A SER 586.A OG THR 605.A OG1 no hydrogen 3.159 N/A ASN 587.A N GLU 583.A O no hydrogen 2.728 N/A ALA 588.A N TRP 584.A O no hydrogen 3.068 N/A MET 589.A N LEU 585.A O no hydrogen 2.588 N/A ASN 590.A N SER 586.A O no hydrogen 3.021 N/A ARG 591.A N ASN 587.A O no hydrogen 2.912 N/A ILE 592.A N ALA 588.A O no hydrogen 2.990 N/A ALA 593.A N MET 589.A O no hydrogen 2.812 N/A GLU 594.A N ASN 590.A O no hydrogen 2.822 N/A GLU 595.A N ARG 591.A O no hydrogen 3.240 N/A VAL 596.A N ILE 592.A O no hydrogen 3.299 N/A VAL 596.A N ALA 593.A O no hydrogen 2.816 N/A GLY 597.A N ALA 593.A O no hydrogen 2.765 N/A ASN 598.A ND2 LEU 485.A O no hydrogen 3.223 N/A SER 600.A N ASN 598.A OD1 no hydrogen 2.869 N/A SER 600.A OG ASN 598.A OD1 no hydrogen 2.339 N/A SER 602.A N THR 599.A O no hydrogen 2.687 N/A LEU 604.A N VAL 601.A O no hydrogen 2.811 N/A THR 605.A OG1 SER 586.A OG no hydrogen 3.159 N/A ARG 607.A NH1 ILE 556.A O no hydrogen 2.674 N/A ARG 607.A NH1 VAL 612.A O no hydrogen 2.754 N/A ARG 607.A NH2 ASP 492.A OD1 no hydrogen 3.190 N/A ARG 607.A NH2 GLU 557.A OE2 no hydrogen 3.223 N/A ILE 608.A N LEU 604.A O no hydrogen 2.925 N/A LYS 609.A N THR 605.A O no hydrogen 2.814 N/A HIS 610.A N GLU 606.A O no hydrogen 3.202 N/A GLY 611.A N ARG 607.A O no hydrogen 2.502 N/A VAL 612.A N ARG 607.A O no hydrogen 3.392 N/A LEU 617.A N GLU 614.A O no hydrogen 3.461 N/A VAL 620.A N LEU 616.A O no hydrogen 2.926 N/A ARG 621.A N LEU 617.A O no hydrogen 3.337 N/A ARG 621.A NE LEU 617.A O no hydrogen 3.151 N/A ILE 622.A N LEU 619.A O no hydrogen 3.142 N/A ARG 627.A NE GLY 611.A O no hydrogen 2.786 N/A ARG 627.A NH2 TRP 555.A O no hydrogen 3.465 N/A ARG 627.A NH2 LYS 559.A O no hydrogen 2.442 N/A ALA 630.A N GLY 626.A O no hydrogen 2.801 N/A ARG 631.A N ARG 627.A O no hydrogen 2.833 N/A ARG 631.A NH1 GLU 615.A OE1 no hydrogen 2.672 N/A ARG 631.A NH2 GLU 615.A OE1 no hydrogen 3.518 N/A LYS 632.A N VAL 628.A O no hydrogen 3.173 N/A LYS 632.A NZ LEU 654.A O no hydrogen 2.742 N/A LEU 633.A N ARG 629.A O no hydrogen 2.918 N/A TYR 634.A N ALA 630.A O no hydrogen 2.836 N/A TYR 634.A OH GLU 615.A OE2 no hydrogen 3.169 N/A ASN 635.A N ARG 631.A O no hydrogen 2.559 N/A ALA 636.A N LEU 633.A O no hydrogen 3.228 N/A ARG 639.A NE TYR 634.A O no hydrogen 3.021 N/A ASP 643.A N ASN 640.A OD1 no hydrogen 3.010 N/A ILE 644.A N ASN 640.A O no hydrogen 3.352 N/A ILE 644.A N ALA 641.A O no hydrogen 3.060 N/A VAL 645.A N ALA 641.A O no hydrogen 3.373 N/A VAL 645.A N GLU 642.A O no hydrogen 2.926 N/A ARG 646.A N GLU 642.A O no hydrogen 3.181 N/A HIS 647.A N ASP 643.A O no hydrogen 3.265 N/A ARG 648.A N VAL 645.A O no hydrogen 3.103 N/A VAL 651.A N HIS 647.A O no hydrogen 3.069 N/A ALA 652.A N ARG 648.A O no hydrogen 3.111 N/A SER 653.A N GLU 649.A O no hydrogen 3.235 N/A SER 653.A N LYS 650.A O no hydrogen 2.717 N/A SER 653.A OG GLU 649.A O no hydrogen 2.597 N/A SER 653.A OG LYS 650.A O no hydrogen 3.009 N/A LEU 654.A N LYS 650.A O no hydrogen 3.134 N/A LEU 654.A N VAL 651.A O no hydrogen 2.679 N/A ILE 655.A N VAL 651.A O no hydrogen 2.932 N/A ALA 660.A N GLY 656.A O no hydrogen 2.670 N/A GLU 661.A N ARG 657.A O no hydrogen 2.867 N/A ARG 662.A N GLY 658.A O no hydrogen 3.048 N/A VAL 663.A N ILE 659.A O no hydrogen 2.913 N/A VAL 664.A N ALA 660.A O no hydrogen 3.197 N/A GLU 665.A N GLU 661.A O no hydrogen 3.086 N/A GLY 666.A N VAL 663.A O no hydrogen 3.275 N/A SER 668.A OG VAL 664.A O no hydrogen 3.287 N/A LYS 670.A N ILE 667.A O no hydrogen 2.956 N/A SER 671.A N ILE 667.A O no hydrogen 2.987 N/A