Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kik_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG SER 6.A OG no hydrogen 3.250 N/A SER 6.A OG SER 4.A OG no hydrogen 3.250 N/A THR 9.A OG1 MET 17.A O no hydrogen 2.959 N/A CYS 12.A N TRP 15.A O no hydrogen 2.864 N/A CYS 12.A SG GLU 81.A O no hydrogen 4.029 N/A TRP 15.A N CYS 12.A O no hydrogen 3.208 N/A GLU 16.A N HIS 33.A O no hydrogen 2.736 N/A MET 17.A N GLN 10.A O no hydrogen 2.897 N/A LYS 18.A N ARG 31.A O no hydrogen 2.675 N/A LYS 18.A NZ GLU 16.A OE1 no hydrogen 3.093 N/A GLU 19.A N GLU 19.A OE2 no hydrogen 2.860 N/A LEU 21.A N VAL 29.A O no hydrogen 2.708 N/A ILE 30.A N ILE 43.A O no hydrogen 3.225 N/A ARG 31.A N GLU 19.A O no hydrogen 2.776 N/A ARG 31.A NE GLU 19.A OE1 no hydrogen 2.978 N/A ARG 31.A NH2 GLU 19.A OE2 no hydrogen 3.162 N/A TRP 32.A N ILE 41.A O no hydrogen 3.012 N/A HIS 33.A N GLU 16.A O no hydrogen 2.816 N/A ASN 34.A N GLU 39.A O no hydrogen 2.786 N/A GLN 35.A N ALA 14.A O no hydrogen 2.746 N/A GLN 35.A NE2 ALA 14.A O no hydrogen 3.653 N/A GLU 36.A N ASN 34.A OD1 no hydrogen 2.982 N/A THR 37.A N ASN 34.A OD1 no hydrogen 2.817 N/A GLY 38.A N ASN 34.A O no hydrogen 2.778 N/A GLU 39.A N THR 37.A OG1 no hydrogen 3.350 N/A ILE 41.A N TRP 32.A O no hydrogen 3.068 N/A ALA 42.A N MET 96.A O no hydrogen 2.800 N/A ILE 43.A N ILE 30.A O no hydrogen 2.821 N/A LYS 44.A N LEU 94.A O no hydrogen 2.816 N/A LYS 44.A NZ GLU 61.A OE1 no hydrogen 3.160 N/A LYS 44.A NZ GLU 61.A OE2 no hydrogen 3.023 N/A LYS 44.A NZ ASP 166.A OD1 no hydrogen 2.753 N/A GLN 45.A N ASN 28.A O no hydrogen 3.039 N/A CYS 46.A SG ARG 47.A O no hydrogen 3.582 N/A CYS 46.A SG ASN 89.A OD1 no hydrogen 3.132 N/A SER 51.A OG ASN 54.A OD1 no hydrogen 2.941 N/A ARG 55.A N SER 51.A O no hydrogen 2.958 N/A ARG 55.A NH1 ASP 90.A OD1 no hydrogen 2.953 N/A ARG 55.A NH1 ASP 90.A OD2 no hydrogen 3.054 N/A ARG 55.A NH2 ASP 90.A OD2 no hydrogen 2.770 N/A GLU 56.A N PRO 52.A O no hydrogen 3.128 N/A ARG 57.A N ARG 53.A O no hydrogen 2.917 N/A TRP 58.A N ASN 54.A O no hydrogen 3.019 N/A TRP 58.A NE1 PRO 92.A O no hydrogen 2.968 N/A CYS 59.A N ARG 55.A O no hydrogen 3.172 N/A CYS 59.A SG ARG 55.A O no hydrogen 3.359 N/A LEU 60.A N GLU 56.A O no hydrogen 3.042 N/A GLU 61.A N ARG 57.A O no hydrogen 3.357 N/A ILE 62.A N TRP 58.A O no hydrogen 3.215 N/A GLN 63.A N CYS 59.A O no hydrogen 2.965 N/A ILE 64.A N LEU 60.A O no hydrogen 2.982 N/A MET 65.A N GLU 61.A O no hydrogen 2.982 N/A ARG 66.A N ILE 62.A O no hydrogen 3.119 N/A ARG 67.A N GLN 63.A O no hydrogen 3.286 N/A ARG 67.A N ILE 64.A O no hydrogen 3.146 N/A LEU 68.A N ILE 64.A O no hydrogen 3.053 N/A THR 69.A N TYR 135.A OH no hydrogen 2.878 N/A ASN 72.A N HIS 70.A ND1 no hydrogen 2.963 N/A ASN 72.A ND2 HIS 162.A O no hydrogen 3.178 N/A VAL 73.A N HIS 70.A O no hydrogen 3.123 N/A VAL 74.A N ILE 164.A O no hydrogen 3.048 N/A ARG 77.A N ALA 95.A O no hydrogen 2.697 N/A MET 83.A N PRO 80.A O no hydrogen 3.079 N/A GLN 84.A NE2 LEU 91.A O no hydrogen 2.902 N/A ASN 89.A ND2 ARG 47.A O no hydrogen 3.037 N/A ASN 89.A ND2 GLN 48.A O no hydrogen 2.785 N/A LEU 91.A N ASN 89.A OD1 no hydrogen 3.288 N/A LEU 93.A N GLN 84.A OE1 no hydrogen 3.072 N/A LEU 94.A N LYS 44.A O no hydrogen 2.850 N/A MET 96.A N ALA 42.A O no hydrogen 2.797 N/A GLY 102.A N CYS 99.A O no hydrogen 3.212 N/A LEU 104.A N ILE 151.A O no hydrogen 2.893 N/A ARG 105.A NE GLU 149.A OE2 no hydrogen 2.757 N/A ARG 105.A NH1 GLU 209.A OE2 no hydrogen 3.188 N/A ARG 105.A NH2 GLU 149.A OE1 no hydrogen 3.148 N/A ARG 105.A NH2 GLU 149.A OE2 no hydrogen 3.327 N/A ARG 105.A NH2 TYR 183.A OH no hydrogen 2.761 N/A TYR 107.A OH GLY 101.A O no hydrogen 2.743 N/A LEU 108.A N LEU 104.A O no hydrogen 2.923 N/A ASN 109.A N ARG 105.A O no hydrogen 2.923 N/A GLN 110.A N LYS 106.A O no hydrogen 3.246 N/A GLN 110.A N TYR 107.A O no hydrogen 3.136 N/A GLN 110.A NE2 LYS 106.A O no hydrogen 3.108 N/A GLU 112.A N GLU 112.A OE1 no hydrogen 2.797 N/A ASN 113.A N GLN 110.A O no hydrogen 2.792 N/A ASN 113.A ND2 TYR 107.A O no hydrogen 2.792 N/A CYS 114.A SG PHE 111.A O no hydrogen 3.302 N/A CYS 114.A SG GLY 423.A O no hydrogen 3.880 N/A LEU 117.A N CYS 210.A O no hydrogen 2.813 N/A ILE 122.A N ARG 118.A O no hydrogen 3.114 N/A ILE 122.A N GLU 119.A O no hydrogen 3.262 N/A LEU 123.A N GLU 119.A O no hydrogen 3.099 N/A THR 124.A N GLY 120.A O no hydrogen 3.069 N/A THR 124.A OG1 ALA 121.A O no hydrogen 3.410 N/A LEU 125.A N ALA 121.A O no hydrogen 3.201 N/A LEU 126.A N ILE 122.A O no hydrogen 2.939 N/A SER 127.A N LEU 123.A O no hydrogen 3.124 N/A ASP 128.A N THR 124.A O no hydrogen 3.130 N/A ILE 129.A N LEU 125.A O no hydrogen 2.912 N/A ALA 130.A N LEU 126.A O no hydrogen 2.887 N/A SER 131.A N SER 127.A O no hydrogen 3.206 N/A ALA 132.A N ASP 128.A O no hydrogen 3.265 N/A LEU 133.A N ILE 129.A O no hydrogen 2.992 N/A ARG 134.A N ALA 130.A O no hydrogen 2.934 N/A ARG 134.A NH2 PHE 295.A O no hydrogen 3.286 N/A TYR 135.A N SER 131.A O no hydrogen 3.152 N/A LEU 136.A N ALA 132.A O no hydrogen 2.988 N/A HIS 137.A N LEU 133.A O no hydrogen 2.812 N/A HIS 137.A NE2 ASP 199.A OD1 no hydrogen 2.827 N/A GLU 138.A N ARG 134.A O no hydrogen 2.938 N/A ASN 139.A N TYR 135.A O no hydrogen 3.063 N/A ASN 139.A N LEU 136.A O no hydrogen 3.027 N/A ASN 139.A ND2 TYR 135.A O no hydrogen 2.767 N/A ARG 140.A N HIS 137.A O no hydrogen 3.099 N/A ILE 141.A N LEU 136.A O no hydrogen 2.882 N/A ILE 142.A N LYS 171.A O no hydrogen 3.074 N/A HIS 143.A N ASP 199.A OD1 no hydrogen 2.785 N/A HIS 143.A NE2 ILE 165.A O no hydrogen 2.846 N/A ARG 144.A N ASP 199.A OD2 no hydrogen 2.965 N/A ARG 144.A NE TYR 169.A O no hydrogen 2.761 N/A ARG 144.A NH2 TYR 169.A O no hydrogen 2.992 N/A ASP 145.A N HIS 143.A ND1 no hydrogen 3.158 N/A LYS 147.A NZ ASP 145.A OD1 no hydrogen 3.508 N/A LYS 147.A NZ THR 180.A OG1 no hydrogen 2.684 N/A GLU 149.A N GLU 149.A OE1 no hydrogen 2.820 N/A ASN 150.A N LYS 147.A O no hydrogen 2.822 N/A ASN 150.A ND2 ASP 145.A O no hydrogen 2.674 N/A ILE 151.A N PRO 148.A O no hydrogen 3.339 N/A VAL 152.A N LYS 163.A O no hydrogen 3.031 N/A LEU 153.A N GLY 102.A O no hydrogen 2.725 N/A GLN 154.A N ILE 161.A O no hydrogen 2.731 N/A GLN 154.A NE2 GLU 97.A OE2 no hydrogen 3.165 N/A GLN 154.A NE2 TYR 98.A O no hydrogen 3.040 N/A GLN 155.A N GLN 154.A OE1 no hydrogen 3.011 N/A GLN 155.A NE2 GLY 156.A O no hydrogen 2.767 N/A GLY 156.A N ARG 159.A O no hydrogen 2.917 N/A ARG 159.A NH1 ASP 128.A OD2 no hydrogen 2.810 N/A ARG 159.A NH2 ASP 128.A OD1 no hydrogen 2.779 N/A ARG 159.A NH2 ASP 128.A OD2 no hydrogen 3.510 N/A ILE 161.A N GLN 154.A O no hydrogen 2.806 N/A HIS 162.A N ASP 128.A OD2 no hydrogen 2.939 N/A HIS 162.A ND1 ASP 128.A OD2 no hydrogen 2.813 N/A LYS 163.A N VAL 152.A O no hydrogen 2.779 N/A LYS 163.A NZ PRO 71.A O no hydrogen 2.993 N/A LYS 163.A NZ GLU 97.A OE1 no hydrogen 3.424 N/A ILE 164.A N ASN 72.A O no hydrogen 3.006 N/A ILE 165.A N ASN 150.A O no hydrogen 3.048 N/A LYS 171.A N ILE 142.A O no hydrogen 3.179 N/A LEU 173.A N ARG 140.A O no hydrogen 2.667 N/A CYS 175.A N TYR 194.A O no hydrogen 3.013 N/A THR 180.A OG1 ASP 145.A OD2 no hydrogen 2.845 N/A GLN 182.A N GLN 182.A OE1 no hydrogen 2.817 N/A TYR 183.A N THR 180.A O no hydrogen 3.000 N/A TYR 183.A OH GLU 209.A OE1 no hydrogen 2.563 N/A LEU 184.A N LEU 181.A O no hydrogen 3.346 N/A GLU 187.A N GLU 187.A OE1 no hydrogen 3.007 N/A LEU 188.A N ALA 185.A O no hydrogen 3.028 N/A LEU 189.A N PRO 186.A O no hydrogen 2.898 N/A GLU 190.A N PRO 186.A O no hydrogen 3.191 N/A GLN 191.A N LEU 188.A O no hydrogen 3.282 N/A GLN 192.A N GLU 187.A O no hydrogen 3.086 N/A TYR 194.A N CYS 175.A O no hydrogen 2.981 N/A THR 195.A OG1 THR 197.A OG1 no hydrogen 2.900 N/A THR 197.A OG1 THR 195.A OG1 no hydrogen 2.900 N/A THR 197.A OG1 PRO 280.A O no hydrogen 2.907 N/A VAL 198.A N THR 195.A O no hydrogen 3.069 N/A ASP 199.A N VAL 196.A O no hydrogen 2.862 N/A TRP 201.A N THR 197.A O no hydrogen 3.434 N/A SER 202.A N VAL 198.A O no hydrogen 3.498 N/A SER 202.A OG TYR 183.A O no hydrogen 3.089 N/A SER 202.A OG VAL 198.A O no hydrogen 3.425 N/A PHE 203.A N ASP 199.A O no hydrogen 3.094 N/A GLY 204.A N TYR 200.A O no hydrogen 2.802 N/A THR 205.A N TRP 201.A O no hydrogen 2.846 N/A THR 205.A OG1 TRP 201.A O no hydrogen 3.104 N/A THR 205.A OG1 SER 202.A O no hydrogen 2.839 N/A LEU 206.A N SER 202.A O no hydrogen 3.070 N/A ALA 207.A N PHE 203.A O no hydrogen 2.823 N/A PHE 208.A N GLY 204.A O no hydrogen 3.019 N/A GLU 209.A N THR 205.A O no hydrogen 2.965 N/A CYS 210.A N LEU 206.A O no hydrogen 3.064 N/A CYS 210.A SG LEU 206.A O no hydrogen 3.423 N/A ILE 211.A N ALA 207.A O no hydrogen 3.029 N/A ILE 211.A N PHE 208.A O no hydrogen 2.964 N/A THR 212.A N PHE 208.A O no hydrogen 2.888 N/A THR 212.A OG1 PHE 208.A O no hydrogen 2.910 N/A GLY 213.A N GLU 209.A O no hydrogen 2.797 N/A PHE 214.A N THR 212.A OG1 no hydrogen 3.357 N/A LEU 218.A N VAL 240.A O no hydrogen 2.861 N/A TRP 221.A N LEU 218.A O no hydrogen 3.421 N/A TRP 221.A NE1 GLU 242.A OE1 no hydrogen 3.056 N/A GLN 225.A N GLN 225.A OE1 no hydrogen 2.750 N/A TRP 226.A N GLN 222.A O no hydrogen 2.832 N/A TRP 226.A NE1 PHE 217.A O no hydrogen 2.831 N/A HIS 227.A N PRO 223.A O no hydrogen 2.843 N/A HIS 227.A NE2 GLU 190.A OE2 no hydrogen 3.274 N/A SER 228.A N VAL 224.A O no hydrogen 3.108 N/A SER 228.A OG VAL 224.A O no hydrogen 3.260 N/A LYS 229.A N GLN 225.A O no hydrogen 3.003 N/A LYS 229.A N TRP 226.A O no hydrogen 3.108 N/A VAL 230.A N TRP 226.A O no hydrogen 2.865 N/A ARG 231.A N HIS 227.A O no hydrogen 3.141 N/A GLN 232.A N LYS 229.A O no hydrogen 3.124 N/A GLN 232.A NE2 SER 228.A O no hydrogen 2.782 N/A LYS 233.A N VAL 230.A O no hydrogen 3.087 N/A LYS 233.A NZ SER 234.A O no hydrogen 3.397 N/A LYS 233.A NZ ASP 237.A O no hydrogen 2.782 N/A LYS 233.A NZ LEU 276.A O no hydrogen 2.935 N/A SER 234.A N ASP 237.A OD1 no hydrogen 2.822 N/A SER 234.A OG ASP 237.A OD1 no hydrogen 3.033 N/A GLU 235.A N GLU 235.A OE1 no hydrogen 2.907 N/A ASP 237.A N SER 234.A O no hydrogen 3.224 N/A ILE 238.A N SER 251.A O no hydrogen 3.016 N/A VAL 239.A N SER 251.A O no hydrogen 3.297 N/A VAL 240.A N PRO 216.A O no hydrogen 3.067 N/A SER 241.A N LYS 249.A O no hydrogen 3.055 N/A ASP 243.A N THR 247.A O no hydrogen 2.908 N/A ASN 245.A N ASP 243.A OD2 no hydrogen 2.900 N/A GLY 246.A N ASP 243.A O no hydrogen 2.816 N/A THR 247.A N ASP 243.A OD2 no hydrogen 2.904 N/A LYS 249.A N SER 241.A O no hydrogen 2.828 N/A SER 251.A N VAL 239.A O no hydrogen 2.823 N/A SER 253.A N SER 251.A OG no hydrogen 3.423 N/A LEU 254.A N GLU 269.A OE1 no hydrogen 3.200 N/A ASN 258.A ND2 PRO 255.A O no hydrogen 2.797 N/A ASN 259.A ND2 GLY 116.A O no hydrogen 3.180 N/A LEU 260.A N ASN 258.A OD1 no hydrogen 3.364 N/A ASN 261.A ND2 GLU 119.A OE1 no hydrogen 3.100 N/A ASN 261.A ND2 GLU 119.A OE2 no hydrogen 2.964 N/A LEU 264.A N ASN 261.A OD1 no hydrogen 2.947 N/A ALA 265.A N ASN 261.A O no hydrogen 2.893 N/A GLU 266.A N SER 262.A O no hydrogen 3.210 N/A ARG 267.A N VAL 263.A O no hydrogen 2.828 N/A LEU 268.A N LEU 264.A O no hydrogen 2.756 N/A GLU 269.A N ALA 265.A O no hydrogen 3.005 N/A LYS 270.A N GLU 266.A O no hydrogen 3.468 N/A TRP 271.A N ARG 267.A O no hydrogen 3.268 N/A TRP 271.A NE1 CYS 294.A O no hydrogen 2.755 N/A LEU 272.A N LEU 268.A O no hydrogen 2.813 N/A GLN 273.A N GLU 269.A O no hydrogen 3.352 N/A GLN 273.A N LYS 270.A O no hydrogen 3.244 N/A GLN 273.A NE2 SER 252.A O no hydrogen 3.483 N/A MET 275.A N LEU 272.A O no hydrogen 3.033 N/A LEU 276.A N LEU 272.A O no hydrogen 2.798 N/A GLN 282.A N HIS 279.A ND1 no hydrogen 2.987 N/A ARG 283.A N HIS 279.A O no hydrogen 3.095 N/A ARG 283.A NE MET 277.A O no hydrogen 2.783 N/A ARG 283.A NH1 GLU 187.A OE1 no hydrogen 3.135 N/A ARG 283.A NH1 GLU 187.A OE2 no hydrogen 2.874 N/A ARG 283.A NH1 THR 197.A O no hydrogen 2.872 N/A ARG 283.A NH2 GLU 187.A OE1 no hydrogen 2.865 N/A ARG 283.A NH2 MET 277.A O no hydrogen 3.012 N/A GLY 284.A N LEU 274.A O no hydrogen 2.793 N/A THR 285.A N GLN 282.A O no hydrogen 3.189 N/A THR 285.A OG1 GLN 282.A O no hydrogen 3.394 N/A ASP 286.A N GLY 290.A O no hydrogen 2.918 N/A THR 288.A N ASP 286.A OD2 no hydrogen 2.841 N/A TYR 289.A N ASP 286.A OD2 no hydrogen 3.003 N/A TYR 289.A OH ASP 300.A OD1 no hydrogen 3.286 N/A TYR 289.A OH ASP 300.A OD2 no hydrogen 2.704 N/A GLY 290.A N ASP 286.A O no hydrogen 2.919 N/A ASN 292.A ND2 TYR 200.A OH no hydrogen 2.942 N/A GLY 293.A N GLY 290.A O no hydrogen 3.166 N/A ALA 297.A N GLY 293.A O no hydrogen 3.056 N/A LEU 298.A N CYS 294.A O no hydrogen 3.238 N/A ASP 299.A N PHE 295.A O no hydrogen 3.060 N/A ASP 300.A N LYS 296.A O no hydrogen 3.213 N/A ILE 301.A N ALA 297.A O no hydrogen 3.445 N/A LEU 302.A N LEU 298.A O no hydrogen 2.798 N/A ASN 303.A N ASP 299.A O no hydrogen 2.898 N/A LEU 304.A N ILE 301.A O no hydrogen 3.284 N/A VAL 307.A N TYR 320.A O no hydrogen 3.167 N/A HIS 308.A ND1 THR 319.A OG1 no hydrogen 2.935 N/A ILE 309.A N HIS 318.A O no hydrogen 2.806 N/A LEU 310.A N VAL 379.A O no hydrogen 2.721 N/A ASN 311.A N THR 316.A O no hydrogen 2.991 N/A MET 312.A N LEU 381.A O no hydrogen 2.914 N/A THR 314.A N ASN 311.A OD1 no hydrogen 3.086 N/A THR 314.A OG1 ASN 311.A OD1 no hydrogen 2.680 N/A GLY 315.A N ASN 311.A O no hydrogen 2.700 N/A HIS 318.A N ILE 309.A O no hydrogen 2.765 N/A THR 319.A OG1 HIS 308.A ND1 no hydrogen 2.935 N/A TYR 320.A N VAL 307.A O no hydrogen 2.867 N/A TYR 320.A OH ASP 338.A OD1 no hydrogen 2.728 N/A VAL 322.A N LYS 305.A O no hydrogen 2.868 N/A THR 323.A N GLU 326.A OE1 no hydrogen 3.419 N/A GLU 326.A N THR 323.A O no hydrogen 2.949 N/A SER 330.A N SER 327.A O no hydrogen 3.004 N/A SER 330.A OG SER 327.A O no hydrogen 2.658 N/A LEU 331.A N SER 327.A O no hydrogen 3.326 N/A LYS 332.A N LEU 328.A O no hydrogen 2.835 N/A LYS 332.A NZ GLU 343.A O no hydrogen 3.162 N/A LYS 332.A NZ GLN 346.A O no hydrogen 3.394 N/A ALA 333.A N GLN 329.A O no hydrogen 3.056 N/A ARG 334.A N SER 330.A O no hydrogen 3.160 N/A ARG 334.A NH1 PRO 321.A O no hydrogen 2.822 N/A ARG 334.A NH1 GLU 326.A OE2 no hydrogen 3.019 N/A ARG 334.A NH2 PRO 321.A O no hydrogen 3.470 N/A ILE 335.A N LEU 331.A O no hydrogen 2.836 N/A GLN 336.A N LYS 332.A O no hydrogen 3.022 N/A ASP 338.A N ILE 335.A O no hydrogen 3.136 N/A THR 339.A N ILE 335.A O no hydrogen 2.927 N/A THR 339.A OG1 ILE 335.A O no hydrogen 2.716 N/A GLY 340.A N GLN 336.A O no hydrogen 2.833 N/A GLU 343.A N GLN 336.A OE1 no hydrogen 3.282 N/A GLU 344.A N GLU 344.A OE2 no hydrogen 2.766 N/A ASP 345.A N PRO 342.A O no hydrogen 2.835 N/A GLN 346.A N PRO 342.A O no hydrogen 3.187 N/A GLN 346.A N GLU 343.A O no hydrogen 3.250 N/A GLN 346.A NE2 LYS 332.A O no hydrogen 2.872 N/A GLN 346.A NE2 ILE 341.A O no hydrogen 2.936 N/A GLU 347.A N PHE 382.A O no hydrogen 3.088 N/A LEU 349.A N PHE 380.A O no hydrogen 2.966 N/A GLN 350.A N LEU 354.A O no hydrogen 3.161 N/A GLY 353.A N GLN 350.A O no hydrogen 2.746 N/A LEU 356.A N LEU 348.A O no hydrogen 3.026 N/A ILE 357.A N GLN 364.A OE1 no hydrogen 2.965 N/A LYS 360.A N ILE 357.A O no hydrogen 3.043 N/A ALA 362.A N GLU 326.A O no hydrogen 2.863 N/A GLN 364.A N PRO 361.A O no hydrogen 3.020 N/A GLN 364.A NE2 ILE 357.A O no hydrogen 2.851 N/A GLN 364.A NE2 LYS 360.A O no hydrogen 3.418 N/A GLN 364.A NE2 PRO 361.A O no hydrogen 3.370 N/A CYS 365.A N ALA 362.A O no hydrogen 3.472 N/A CYS 365.A SG ALA 362.A O no hydrogen 3.260 N/A ILE 366.A N THR 363.A O no hydrogen 3.195 N/A ASN 369.A ND2 GLN 158.A O no hydrogen 3.264 N/A GLU 370.A N GLU 370.A OE1 no hydrogen 2.756 N/A HIS 372.A N ASN 369.A O no hydrogen 3.286 N/A VAL 379.A N HIS 308.A O no hydrogen 2.974 N/A PHE 380.A N LEU 349.A O no hydrogen 2.786 N/A LEU 381.A N LEU 310.A O no hydrogen 2.754 N/A PHE 382.A N GLU 347.A O no hydrogen 3.050 N/A ASP 383.A N TYR 389.A OH no hydrogen 3.002 N/A ASN 384.A N ASP 345.A O no hydrogen 3.061 N/A SER 385.A N ASP 383.A OD1 no hydrogen 3.314 N/A LYS 386.A N ASP 383.A O no hydrogen 3.082 N/A LYS 386.A NZ THR 388.A O no hydrogen 2.864 N/A SER 394.A OG ILE 393.A O no hydrogen 2.677 N/A VAL 402.A N PRO 399.A O no hydrogen 3.160 N/A SER 403.A N PRO 399.A O no hydrogen 3.112 N/A SER 403.A OG PRO 399.A O no hydrogen 3.378 N/A SER 403.A OG GLU 400.A O no hydrogen 3.119 N/A CYS 404.A N GLU 400.A O no hydrogen 3.113 N/A ILE 405.A N SER 401.A O no hydrogen 3.159 N/A LEU 406.A N VAL 402.A O no hydrogen 2.899 N/A GLN 407.A N SER 403.A O no hydrogen 3.361 N/A ARG 411.A NH1 GLU 408.A OE2 no hydrogen 3.190 N/A ARG 411.A NH2 ASN 245.A OD1 no hydrogen 2.792 N/A LEU 413.A N GLY 570.A O no hydrogen 2.856 N/A ALA 414.A N GLN 417.A OE1 no hydrogen 3.160 N/A GLN 417.A NE2 ASP 243.A O no hydrogen 3.687 N/A GLN 417.A NE2 LEU 244.A O no hydrogen 3.345 N/A LEU 418.A N ALA 414.A O no hydrogen 2.843 N/A ARG 419.A N PHE 415.A O no hydrogen 2.870 N/A LYS 420.A N PHE 416.A O no hydrogen 3.275 N/A LYS 420.A NZ GLN 424.A OE1 no hydrogen 3.386 N/A VAL 421.A N GLN 417.A O no hydrogen 3.071 N/A TRP 422.A N LEU 418.A O no hydrogen 2.898 N/A TRP 422.A NE1 SER 572.A OG no hydrogen 3.068 N/A GLY 423.A N ARG 419.A O no hydrogen 3.310 N/A GLN 424.A N LYS 420.A O no hydrogen 3.131 N/A VAL 425.A N VAL 421.A O no hydrogen 2.744 N/A TRP 426.A N TRP 422.A O no hydrogen 2.875 N/A TRP 426.A NE1 GLU 549.A OE2 no hydrogen 3.017 N/A HIS 427.A N GLY 423.A O no hydrogen 2.894 N/A HIS 427.A NE2 ASN 259.A OD1 no hydrogen 2.691 N/A SER 428.A N GLN 424.A O no hydrogen 2.871 N/A SER 428.A OG GLN 424.A O no hydrogen 3.267 N/A ILE 429.A N VAL 425.A O no hydrogen 3.132 N/A GLN 430.A N TRP 426.A O no hydrogen 3.048 N/A THR 431.A N HIS 427.A O no hydrogen 3.012 N/A THR 431.A OG1 HIS 427.A O no hydrogen 2.760 N/A LEU 432.A N SER 428.A O no hydrogen 2.928 N/A LYS 433.A N ILE 429.A O no hydrogen 2.975 N/A LYS 433.A NZ GLU 549.A OE1 no hydrogen 3.212 N/A GLU 434.A N GLN 430.A O no hydrogen 2.849 N/A ASP 435.A N THR 431.A O no hydrogen 2.727 N/A CYS 436.A N LEU 432.A O no hydrogen 2.924 N/A ASN 437.A N LYS 433.A O no hydrogen 3.156 N/A ARG 438.A N GLU 434.A O no hydrogen 3.154 N/A ARG 438.A NH1 ASP 375.A OD2 no hydrogen 3.086 N/A ARG 438.A NH2 ASP 435.A OD1 no hydrogen 2.805 N/A LEU 439.A N ASP 435.A O no hydrogen 3.289 N/A GLN 440.A N CYS 436.A O no hydrogen 3.258 N/A GLN 441.A N ASN 437.A O no hydrogen 3.025 N/A GLY 442.A N ARG 438.A O no hydrogen 3.080 N/A GLN 443.A N LEU 439.A O no hydrogen 2.992 N/A ARG 444.A N GLN 440.A O no hydrogen 2.846 N/A ALA 445.A N GLN 441.A O no hydrogen 2.838 N/A ALA 446.A N GLY 442.A O no hydrogen 3.168 N/A MET 447.A N GLN 443.A O no hydrogen 3.025 N/A MET 448.A N ARG 444.A O no hydrogen 2.829 N/A ASN 449.A N ALA 445.A O no hydrogen 3.028 N/A ASN 449.A ND2 GLY 353.A O no hydrogen 3.102 N/A LEU 450.A N ALA 446.A O no hydrogen 2.991 N/A LEU 451.A N MET 447.A O no hydrogen 2.923 N/A ARG 452.A N MET 448.A O no hydrogen 3.101 N/A ARG 452.A NH1 ALA 352.A O no hydrogen 3.061 N/A ARG 452.A NH2 ALA 352.A O no hydrogen 3.146 N/A ASN 453.A N ASN 449.A O no hydrogen 3.043 N/A ASN 453.A ND2 ASN 449.A O no hydrogen 3.086 N/A ASN 454.A N LEU 450.A O no hydrogen 2.801 N/A SER 455.A N LEU 451.A O no hydrogen 3.026 N/A CYS 456.A SG ARG 452.A O no hydrogen 3.500 N/A LEU 457.A N ASN 453.A O no hydrogen 3.001 N/A SER 458.A N ASN 454.A O no hydrogen 2.902 N/A SER 458.A OG ASN 454.A O no hydrogen 2.897 N/A SER 458.A OG GLN 533.A OE1 no hydrogen 3.229 N/A LYS 459.A N SER 455.A O no hydrogen 3.096 N/A LYS 459.A NZ SER 455.A OG no hydrogen 3.329 N/A MET 460.A N CYS 456.A O no hydrogen 2.886 N/A LYS 461.A N LEU 457.A O no hydrogen 2.977 N/A ASN 462.A N SER 458.A O no hydrogen 3.164 N/A SER 463.A N LYS 459.A O no hydrogen 3.325 N/A SER 463.A OG LYS 459.A O no hydrogen 3.069 N/A MET 464.A N MET 460.A O no hydrogen 2.840 N/A ALA 465.A N LYS 461.A O no hydrogen 2.819 N/A SER 466.A N ASN 462.A O no hydrogen 2.874 N/A SER 466.A OG GLN 470.A OE1 no hydrogen 3.435 N/A MET 467.A N SER 463.A O no hydrogen 2.785 N/A SER 468.A N MET 464.A O no hydrogen 2.929 N/A GLN 469.A N ALA 465.A O no hydrogen 3.111 N/A GLN 470.A N SER 466.A O no hydrogen 3.081 N/A LEU 471.A N MET 467.A O no hydrogen 2.830 N/A LYS 472.A N SER 468.A O no hydrogen 2.957 N/A ALA 473.A N GLN 469.A O no hydrogen 3.177 N/A LYS 474.A N GLN 470.A O no hydrogen 3.050 N/A LEU 475.A N LEU 471.A O no hydrogen 2.912 N/A ASP 476.A N LYS 472.A O no hydrogen 3.034 N/A PHE 477.A N ALA 473.A O no hydrogen 3.071 N/A PHE 478.A N LYS 474.A O no hydrogen 2.869 N/A LYS 479.A N LEU 475.A O no hydrogen 2.851 N/A LYS 479.A NZ GLU 514.A OE2 no hydrogen 3.355 N/A THR 480.A N ASP 476.A O no hydrogen 3.003 N/A THR 480.A OG1 ASP 476.A O no hydrogen 3.027 N/A SER 481.A N PHE 477.A O no hydrogen 2.799 N/A ILE 482.A N PHE 478.A O no hydrogen 2.851 N/A GLN 483.A N LYS 479.A O no hydrogen 3.145 N/A ILE 484.A N THR 480.A O no hydrogen 3.202 N/A ASP 485.A N SER 481.A O no hydrogen 3.092 N/A LEU 486.A N ILE 482.A O no hydrogen 2.875 N/A GLU 487.A N GLN 483.A O no hydrogen 3.003 N/A LYS 488.A N ILE 484.A O no hydrogen 2.905 N/A TYR 489.A N ASP 485.A O no hydrogen 3.210 N/A SER 490.A N LEU 486.A O no hydrogen 3.356 N/A SER 490.A OG LEU 486.A O no hydrogen 3.236 N/A SER 490.A OG GLU 487.A O no hydrogen 2.855 N/A GLU 491.A N GLU 487.A O no hydrogen 3.118 N/A GLN 492.A N TYR 489.A O no hydrogen 2.889 N/A GLN 492.A NE2 TYR 489.A O no hydrogen 3.425 N/A GLN 492.A NE2 ILE 497.A O no hydrogen 2.777 N/A THR 493.A OG1 SER 490.A O no hydrogen 2.676 N/A GLY 496.A N GLN 492.A O no hydrogen 3.253 N/A ILE 497.A N GLN 492.A OE1 no hydrogen 3.159 N/A THR 498.A OG1 THR 493.A O no hydrogen 3.009 N/A SER 499.A N TYR 489.A OH no hydrogen 2.784 N/A LEU 502.A N SER 499.A O no hydrogen 2.875 N/A LEU 502.A N SER 499.A OG no hydrogen 3.208 N/A LEU 503.A N SER 499.A O no hydrogen 3.180 N/A LEU 504.A N ASP 500.A O no hydrogen 3.323 N/A ALA 505.A N LYS 501.A O no hydrogen 3.154 N/A TRP 506.A N LEU 502.A O no hydrogen 2.803 N/A TRP 506.A NE1 GLU 638.A OE1 no hydrogen 2.775 N/A ARG 507.A N LEU 503.A O no hydrogen 2.869 N/A GLU 508.A N LEU 504.A O no hydrogen 3.048 N/A MET 509.A N ALA 505.A O no hydrogen 3.133 N/A GLU 510.A N TRP 506.A O no hydrogen 3.146 N/A GLN 511.A N ARG 507.A O no hydrogen 3.186 N/A GLN 511.A NE2 GLU 508.A O no hydrogen 3.081 N/A ALA 512.A N GLU 508.A O no hydrogen 2.823 N/A VAL 513.A N MET 509.A O no hydrogen 3.131 N/A CYS 516.A SG VAL 513.A O no hydrogen 3.500 N/A GLY 517.A N ASP 624.A OD2 no hydrogen 3.091 N/A ARG 518.A NE ASP 624.A OD2 no hydrogen 2.814 N/A ARG 518.A NH2 ASP 624.A OD1 no hydrogen 2.874 N/A GLU 521.A N GLU 521.A OE2 no hydrogen 2.945 N/A VAL 522.A N ARG 518.A O no hydrogen 2.814 N/A LYS 523.A N GLU 519.A O no hydrogen 2.835 N/A LEU 524.A N ASN 520.A O no hydrogen 3.475 N/A LEU 525.A N GLU 521.A O no hydrogen 3.309 N/A VAL 526.A N VAL 522.A O no hydrogen 2.918 N/A VAL 526.A N LYS 523.A O no hydrogen 3.264 N/A GLU 527.A N LYS 523.A O no hydrogen 3.145 N/A ARG 528.A N LEU 524.A O no hydrogen 3.099 N/A MET 529.A N LEU 525.A O no hydrogen 2.965 N/A MET 530.A N VAL 526.A O no hydrogen 2.851 N/A ALA 531.A N GLU 527.A O no hydrogen 2.862 N/A LEU 532.A N ARG 528.A O no hydrogen 2.850 N/A GLN 533.A N MET 529.A O no hydrogen 3.177 N/A THR 534.A N MET 530.A O no hydrogen 3.344 N/A THR 534.A OG1 MET 530.A O no hydrogen 3.433 N/A ILE 536.A N LEU 532.A O no hydrogen 3.088 N/A VAL 537.A N GLN 533.A O no hydrogen 3.016 N/A ASP 538.A N THR 534.A O no hydrogen 2.966 N/A LEU 539.A N ASP 535.A O no hydrogen 2.968 N/A LEU 539.A N ILE 536.A O no hydrogen 3.129 N/A GLN 540.A N ILE 536.A O no hydrogen 3.046 N/A ARG 541.A N VAL 537.A O no hydrogen 3.025 N/A SER 542.A OG ASP 538.A O no hydrogen 3.240 N/A SER 542.A OG LEU 539.A O no hydrogen 2.892 N/A GLY 543.A N ASP 546.A OD2 no hydrogen 3.414 N/A THR 544.A OG1 SER 585.A OG no hydrogen 3.342 N/A ASP 547.A N GLY 543.A O no hydrogen 3.334 N/A LEU 548.A N THR 544.A O no hydrogen 2.887 N/A GLU 550.A N ASP 546.A O no hydrogen 3.146 N/A GLN 551.A N ASP 547.A O no hydrogen 2.829 N/A ALA 552.A N LEU 548.A O no hydrogen 3.020 N/A ARG 553.A N GLU 549.A O no hydrogen 2.926 N/A ARG 553.A NH2 GLU 549.A OE2 no hydrogen 3.328 N/A GLU 554.A N GLU 550.A O no hydrogen 3.075 N/A LEU 555.A N GLN 551.A O no hydrogen 3.060 N/A TYR 556.A N ALA 552.A O no hydrogen 2.945 N/A ARG 557.A N ARG 553.A O no hydrogen 2.762 N/A ARG 558.A N GLU 554.A O no hydrogen 2.881 N/A LEU 559.A N LEU 555.A O no hydrogen 3.161 N/A ARG 560.A N TYR 556.A O no hydrogen 2.973 N/A ARG 560.A NH1 TYR 556.A OH no hydrogen 3.406 N/A ARG 560.A NH2 ASN 109.A O no hydrogen 2.932 N/A GLU 561.A N ARG 557.A O no hydrogen 2.939 N/A LYS 562.A N LEU 559.A O no hydrogen 3.333 N/A LYS 562.A NZ GLN 566.A OE1 no hydrogen 3.390 N/A GLN 566.A N PRO 563.A O no hydrogen 3.016 N/A ARG 567.A N ARG 564.A O no hydrogen 3.483 N/A ARG 567.A NE LYS 562.A O no hydrogen 3.133 N/A ARG 567.A NH2 ARG 560.A O no hydrogen 3.397 N/A GLY 570.A N LEU 413.A O no hydrogen 3.112 N/A SER 572.A N PRO 409.A O no hydrogen 3.227 N/A GLN 573.A NE2 ASP 571.A OD1 no hydrogen 2.855 N/A VAL 576.A N SER 572.A O no hydrogen 2.733 N/A ARG 577.A N GLN 573.A O no hydrogen 2.971 N/A LEU 578.A N GLU 574.A O no hydrogen 3.445 N/A LEU 579.A N MET 575.A O no hydrogen 3.142 N/A LEU 580.A N VAL 576.A O no hydrogen 2.990 N/A GLN 581.A N ARG 577.A O no hydrogen 3.077 N/A ALA 582.A N LEU 578.A O no hydrogen 2.816 N/A ILE 583.A N LEU 579.A O no hydrogen 2.744 N/A GLN 584.A N LEU 580.A O no hydrogen 3.019 N/A SER 585.A N GLN 581.A O no hydrogen 2.812 N/A SER 585.A OG THR 544.A OG1 no hydrogen 3.342 N/A PHE 586.A N ALA 582.A O no hydrogen 2.803 N/A GLU 587.A N ILE 583.A O no hydrogen 3.037 N/A LYS 588.A N GLN 584.A O no hydrogen 3.149 N/A LYS 589.A N SER 585.A O no hydrogen 2.939 N/A VAL 590.A N PHE 586.A O no hydrogen 2.798 N/A ARG 591.A N GLU 587.A O no hydrogen 3.009 N/A VAL 592.A N LYS 588.A O no hydrogen 3.435 N/A ILE 593.A N LYS 589.A O no hydrogen 3.139 N/A TYR 594.A N VAL 590.A O no hydrogen 3.082 N/A TYR 594.A OH MET 312.A O no hydrogen 2.536 N/A THR 595.A N ARG 591.A O no hydrogen 3.042 N/A THR 595.A OG1 ARG 591.A O no hydrogen 3.019 N/A GLN 596.A N VAL 592.A O no hydrogen 3.131 N/A GLN 596.A NE2 LEU 539.A O no hydrogen 3.102 N/A LEU 597.A N ILE 593.A O no hydrogen 2.931 N/A SER 598.A N TYR 594.A O no hydrogen 2.967 N/A SER 598.A OG TYR 594.A O no hydrogen 2.676 N/A SER 598.A OG THR 595.A O no hydrogen 3.329 N/A LYS 599.A N THR 595.A O no hydrogen 3.229 N/A THR 600.A N GLN 596.A O no hydrogen 2.820 N/A THR 600.A OG1 GLN 596.A O no hydrogen 2.717 N/A VAL 601.A N LEU 597.A O no hydrogen 2.913 N/A VAL 602.A N SER 598.A O no hydrogen 3.340 N/A CYS 603.A N LYS 599.A O no hydrogen 3.412 N/A CYS 603.A SG LYS 599.A O no hydrogen 3.473 N/A LYS 604.A N THR 600.A O no hydrogen 2.971 N/A LYS 604.A NZ GLU 347.A OE1 no hydrogen 3.178 N/A LYS 604.A NZ GLU 347.A OE2 no hydrogen 3.530 N/A GLN 605.A N VAL 601.A O no hydrogen 3.041 N/A LYS 606.A N VAL 602.A O no hydrogen 3.186 N/A ALA 607.A N CYS 603.A O no hydrogen 2.995 N/A LEU 608.A N LYS 604.A O no hydrogen 3.042 N/A GLU 609.A N GLN 605.A O no hydrogen 2.803 N/A LEU 610.A N LYS 606.A O no hydrogen 2.841 N/A LEU 610.A N ALA 607.A O no hydrogen 3.094 N/A LEU 611.A N ALA 607.A O no hydrogen 3.041 N/A VAL 614.A N LEU 610.A O no hydrogen 3.079 N/A GLU 615.A N LEU 611.A O no hydrogen 3.076 N/A GLU 616.A N PRO 612.A O no hydrogen 2.773 N/A VAL 617.A N LYS 613.A O no hydrogen 3.134 N/A VAL 618.A N VAL 614.A O no hydrogen 2.960 N/A SER 619.A N GLU 615.A O no hydrogen 3.068 N/A LEU 620.A N GLU 616.A O no hydrogen 3.078 N/A MET 621.A N VAL 617.A O no hydrogen 2.918 N/A ASN 622.A N VAL 618.A O no hydrogen 2.995 N/A GLU 623.A N SER 619.A O no hydrogen 3.095 N/A ASP 624.A N LEU 620.A O no hydrogen 2.976 N/A GLU 625.A N MET 621.A O no hydrogen 3.008 N/A LYS 626.A N ASN 622.A O no hydrogen 2.951 N/A LYS 626.A NZ ASN 622.A OD1 no hydrogen 3.340 N/A LYS 626.A NZ GLU 623.A OE2 no hydrogen 2.984 N/A THR 627.A N GLU 623.A O no hydrogen 2.884 N/A THR 627.A OG1 GLU 623.A O no hydrogen 3.513 N/A THR 627.A OG1 ASP 624.A O no hydrogen 2.833 N/A VAL 628.A N ASP 624.A O no hydrogen 3.026 N/A VAL 629.A N GLU 625.A O no hydrogen 3.004 N/A ARG 630.A N LYS 626.A O no hydrogen 3.091 N/A LEU 631.A N THR 627.A O no hydrogen 2.942 N/A GLN 632.A N VAL 628.A O no hydrogen 3.020 N/A GLN 632.A NE2 SER 481.A OG no hydrogen 2.888 N/A GLN 632.A NE2 GLN 636.A OE1 no hydrogen 3.345 N/A GLU 633.A N VAL 629.A O no hydrogen 3.142 N/A LYS 634.A N ARG 630.A O no hydrogen 2.913 N/A ARG 635.A N LEU 631.A O no hydrogen 3.171 N/A ARG 635.A NE ASP 485.A OD2 no hydrogen 2.838 N/A ARG 635.A NH1 GLN 632.A OE1 no hydrogen 3.325 N/A ARG 635.A NH2 ASP 485.A OD2 no hydrogen 3.448 N/A ARG 635.A NH2 GLN 632.A OE1 no hydrogen 2.811 N/A GLN 636.A N GLN 632.A O no hydrogen 3.130 N/A LYS 637.A N GLU 633.A O no hydrogen 2.989 N/A LYS 637.A NZ GLU 633.A OE1 no hydrogen 3.218 N/A GLU 638.A N LYS 634.A O no hydrogen 2.870 N/A LEU 639.A N ARG 635.A O no hydrogen 2.962 N/A LEU 639.A N GLN 636.A O no hydrogen 3.239 N/A TRP 640.A N GLN 636.A O no hydrogen 3.176 N/A ASN 641.A N LYS 637.A O no hydrogen 3.113 N/A LEU 642.A N GLU 638.A O no hydrogen 3.224 N/A LEU 642.A N LEU 639.A O no hydrogen 3.031 N/A LEU 643.A N LEU 639.A O no hydrogen 3.321 N/A LYS 644.A N TRP 640.A O no hydrogen 3.241 N/A LYS 644.A N ASN 641.A O no hydrogen 3.232 N/A ILE 645.A N ASN 641.A O no hydrogen 3.317 N/A ALA 646.A N LEU 642.A O no hydrogen 2.976 N/A CYS 647.A N LEU 643.A O no hydrogen 3.167 N/A CYS 647.A N LYS 644.A O no hydrogen 2.867 N/A SER 648.A N ILE 645.A O no hydrogen 3.314 N/A SER 648.A OG ILE 645.A O no hydrogen 2.801 N/A