Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1mwr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A N ASP 1.A O no hydrogen 3.073 N/A ASN 6.A N LYS 2.A O no hydrogen 2.855 N/A THR 7.A N GLU 3.A O no hydrogen 3.144 N/A THR 7.A OG1 GLU 3.A O no hydrogen 2.945 N/A THR 7.A OG1 ASP 22.A OD2 no hydrogen 3.223 N/A ILE 8.A N ILE 4.A O no hydrogen 2.903 N/A ASP 9.A N ASN 5.A O no hydrogen 2.793 N/A ALA 10.A N ASN 6.A O no hydrogen 2.963 N/A ILE 11.A N THR 7.A O no hydrogen 3.128 N/A GLU 12.A N ILE 8.A O no hydrogen 2.980 N/A ASP 13.A N ASP 9.A O no hydrogen 2.638 N/A LYS 14.A N ALA 10.A O no hydrogen 2.949 N/A LYS 14.A N ILE 11.A O no hydrogen 2.725 N/A LYS 14.A NZ LYS 49.A O no hydrogen 2.818 N/A ASN 15.A N ALA 10.A O no hydrogen 2.890 N/A GLN 18.A N ASN 15.A OD1 no hydrogen 3.142 N/A GLN 18.A NE2 GLN 18.A O no hydrogen 3.447 N/A GLN 18.A NE2 ASP 22.A OD1 no hydrogen 3.198 N/A GLN 18.A NE2 ASP 22.A OD2 no hydrogen 3.369 N/A VAL 19.A N ASN 15.A O no hydrogen 2.986 N/A TYR 20.A N PHE 16.A O no hydrogen 2.926 N/A LYS 21.A N LYS 17.A O no hydrogen 3.068 N/A LYS 21.A N GLN 18.A O no hydrogen 2.723 N/A ASP 22.A N GLN 18.A O no hydrogen 3.217 N/A SER 23.A N TYR 20.A O no hydrogen 3.296 N/A SER 23.A OG VAL 19.A O no hydrogen 2.709 N/A SER 24.A N LEU 91.A O no hydrogen 2.803 N/A SER 24.A OG SER 27.A OG no hydrogen 2.733 N/A TYR 25.A N GLU 86.A OE2 no hydrogen 3.262 N/A SER 27.A N SER 24.A OG no hydrogen 3.046 N/A SER 27.A OG SER 24.A O no hydrogen 3.080 N/A SER 27.A OG SER 24.A OG no hydrogen 2.733 N/A LYS 28.A N SER 24.A O no hydrogen 3.262 N/A SER 29.A N TYR 25.A O no hydrogen 3.227 N/A SER 29.A N ILE 26.A O no hydrogen 3.029 N/A ASP 30.A N ILE 26.A O no hydrogen 3.296 N/A ASN 31.A N SER 27.A O no hydrogen 3.293 N/A ASN 31.A ND2 SER 27.A O no hydrogen 3.012 N/A GLY 32.A N LYS 28.A O no hydrogen 2.941 N/A THR 36.A OG1 GLU 33.A O no hydrogen 2.517 N/A GLU 37.A N VAL 34.A O no hydrogen 2.713 N/A ARG 38.A N VAL 34.A O no hydrogen 3.425 N/A ARG 38.A NH1 GLU 35.A OE1 no hydrogen 2.835 N/A ARG 38.A NH2 GLN 105.A O no hydrogen 2.631 N/A ILE 40.A N GLU 37.A O no hydrogen 3.156 N/A LYS 41.A N GLU 37.A O no hydrogen 3.434 N/A ILE 42.A N ARG 38.A O no hydrogen 2.874 N/A TYR 43.A N PRO 39.A O no hydrogen 2.873 N/A TYR 43.A OH ILE 98.A O no hydrogen 2.836 N/A ASN 44.A N ILE 40.A O no hydrogen 3.060 N/A ASN 44.A ND2 ILE 40.A O no hydrogen 3.177 N/A SER 45.A N LYS 41.A O no hydrogen 3.161 N/A SER 45.A OG ILE 42.A O no hydrogen 2.906 N/A LEU 46.A N ILE 42.A O no hydrogen 3.164 N/A VAL 48.A N TYR 43.A O no hydrogen 2.969 N/A LYS 49.A N LYS 69.A O no hydrogen 2.983 N/A ASN 52.A N LYS 67.A O no hydrogen 2.947 N/A ILE 53.A N GLU 12.A OE1 no hydrogen 2.837 N/A GLN 54.A N GLN 65.A O no hydrogen 3.140 N/A ARG 56.A NE ILE 53.A O no hydrogen 3.060 N/A ARG 56.A NH1 ASN 5.A O no hydrogen 3.364 N/A ARG 56.A NH1 ASN 5.A OD1 no hydrogen 3.046 N/A ARG 56.A NH1 ASP 9.A OD1 no hydrogen 3.438 N/A ARG 56.A NH2 ASP 9.A OD1 no hydrogen 2.904 N/A ARG 56.A NH2 GLU 12.A OE1 no hydrogen 2.679 N/A LYS 57.A N ASP 63.A O no hydrogen 2.997 N/A LYS 59.A N ARG 61.A O no hydrogen 2.725 N/A VAL 62.A N PHE 81.A O no hydrogen 2.856 N/A ASP 63.A N LYS 57.A O no hydrogen 3.301 N/A ALA 64.A N VAL 79.A O no hydrogen 3.031 N/A GLN 65.A N GLN 54.A O no hydrogen 3.209 N/A TYR 66.A N ARG 77.A O no hydrogen 2.829 N/A TYR 66.A OH TYR 43.A OH no hydrogen 3.147 N/A TYR 66.A OH VAL 97.A O no hydrogen 2.837 N/A LYS 67.A N ASN 52.A O no hydrogen 3.001 N/A ILE 68.A N ILE 75.A O no hydrogen 2.856 N/A LYS 69.A N ASP 50.A O no hydrogen 2.913 N/A THR 70.A N GLY 73.A O no hydrogen 2.767 N/A THR 70.A OG1 GLY 73.A O no hydrogen 2.658 N/A ASN 71.A N LEU 46.A O no hydrogen 3.117 N/A TYR 72.A N THR 70.A OG1 no hydrogen 3.070 N/A GLY 73.A N THR 70.A O no hydrogen 3.006 N/A ILE 75.A N ILE 68.A O no hydrogen 2.720 N/A ARG 77.A N TYR 66.A O no hydrogen 3.234 N/A ARG 77.A NE PRO 100.A O no hydrogen 3.005 N/A ASN 78.A ND2 ALA 64.A O no hydrogen 3.558 N/A VAL 79.A N ALA 64.A O no hydrogen 2.829 N/A GLN 80.A NE2 ASP 63.A OD1 no hydrogen 3.377 N/A PHE 81.A N VAL 62.A O no hydrogen 3.026 N/A VAL 84.A N LYS 90.A O no hydrogen 2.836 N/A TRP 89.A N GLU 3.A OE1 no hydrogen 2.606 N/A LYS 90.A N VAL 84.A O no hydrogen 2.511 N/A LEU 91.A N ASP 22.A O no hydrogen 2.759 N/A ASP 92.A N ASN 82.A O no hydrogen 2.873 N/A TRP 93.A N LEU 91.A O no hydrogen 2.794 N/A HIS 95.A NE2 GLU 35.A OE1 no hydrogen 2.528 N/A SER 96.A OG ASP 94.A OD2 no hydrogen 2.895 N/A VAL 97.A N ASP 94.A O no hydrogen 2.957 N/A ILE 98.A N HIS 95.A O no hydrogen 2.595 N/A ILE 99.A N HIS 95.A O no hydrogen 3.301 N/A SER 106.A N VAL 265.A O no hydrogen 3.193 N/A SER 106.A OG HIS 108.A NE2 no hydrogen 3.401 N/A SER 106.A OG ASP 267.A OD1 no hydrogen 3.560 N/A HIS 108.A N THR 263.A O no hydrogen 2.869 N/A GLU 110.A N ARG 261.A O no hydrogen 3.270 N/A ASN 111.A ND2 GLY 259.A O no hydrogen 2.440 N/A LEU 112.A N GLY 259.A O no hydrogen 2.816 N/A LYS 113.A NZ SER 114.A O no hydrogen 2.578 N/A SER 114.A N ASP 258.A OD1 no hydrogen 2.856 N/A SER 114.A OG HIS 256.A ND1 no hydrogen 2.858 N/A SER 114.A OG ASP 258.A OD1 no hydrogen 2.806 N/A GLU 115.A N ASP 282.A OD1 no hydrogen 2.650 N/A ARG 116.A NE GLU 247.A OE1 no hydrogen 3.058 N/A ARG 116.A NH1 ASP 251.A OD1 no hydrogen 3.046 N/A ARG 116.A NH2 GLU 247.A OE1 no hydrogen 3.084 N/A ARG 116.A NH2 ASP 251.A OD1 no hydrogen 2.730 N/A GLY 117.A N LEU 254.A O no hydrogen 2.920 N/A LYS 118.A N ASP 285.A OD1 no hydrogen 3.033 N/A LYS 118.A NZ GLU 126.A OE1 no hydrogen 3.217 N/A ILE 119.A N ALA 128.A O no hydrogen 3.073 N/A LEU 120.A N ILE 286.A O no hydrogen 2.784 N/A ASP 121.A N VAL 125.A O no hydrogen 3.022 N/A ARG 122.A N ILE 290.A O no hydrogen 2.817 N/A ARG 122.A NE ASP 608.A OD2 no hydrogen 3.172 N/A ARG 122.A NH1 THR 289.A O no hydrogen 2.608 N/A ARG 122.A NH1 GLU 317.A OE1 no hydrogen 2.963 N/A ARG 122.A NH2 GLU 317.A OE1 no hydrogen 2.692 N/A ASN 123.A N ASP 121.A OD2 no hydrogen 2.693 N/A ASN 123.A ND2 ILE 607.A O no hydrogen 2.975 N/A ASN 124.A N ASP 121.A O no hydrogen 2.899 N/A VAL 125.A N ASP 121.A OD2 no hydrogen 2.997 N/A LEU 127.A N ILE 119.A O no hydrogen 2.845 N/A ALA 128.A N ILE 119.A O no hydrogen 3.198 N/A ASN 129.A N ASN 205.A O no hydrogen 2.973 N/A ASN 129.A ND2 GLU 126.A OE2 no hydrogen 2.352 N/A THR 130.A OG1 GLU 115.A OE1 no hydrogen 3.021 N/A GLY 131.A N SER 203.A O no hydrogen 2.832 N/A ALA 133.A N THR 201.A O no hydrogen 2.986 N/A TYR 134.A N VAL 181.A O no hydrogen 2.704 N/A GLU 135.A N ASN 199.A O no hydrogen 2.908 N/A ILE 136.A N LYS 179.A O no hydrogen 2.926 N/A GLY 137.A N THR 197.A O no hydrogen 2.666 N/A ILE 138.A N VAL 176.A O no hydrogen 3.054 N/A LYS 141.A N ASP 172.A O no hydrogen 3.214 N/A VAL 143.A N PRO 140.A O no hydrogen 2.993 N/A TYR 148.A N LYS 145.A O no hydrogen 3.136 N/A ILE 151.A N ASP 147.A O no hydrogen 3.155 N/A ALA 152.A N TYR 148.A O no hydrogen 2.738 N/A LYS 153.A N LYS 149.A O no hydrogen 2.573 N/A GLU 154.A N ILE 151.A O no hydrogen 3.036 N/A LEU 155.A N ILE 151.A O no hydrogen 2.996 N/A SER 156.A OG GLU 154.A O no hydrogen 3.046 N/A ILE 157.A N ALA 152.A O no hydrogen 3.199 N/A ILE 162.A N SER 158.A O no hydrogen 3.370 N/A LYS 163.A N GLU 159.A O no hydrogen 3.242 N/A GLN 164.A N ASP 160.A O no hydrogen 2.756 N/A GLN 165.A N TYR 161.A O no hydrogen 2.976 N/A GLN 167.A N GLN 165.A O no hydrogen 3.355 N/A VAL 170.A N GLN 167.A O no hydrogen 3.105 N/A GLN 171.A N THR 174.A OG1 no hydrogen 2.689 N/A THR 174.A N GLN 171.A O no hydrogen 3.196 N/A VAL 176.A N ILE 138.A O no hydrogen 2.845 N/A LEU 178.A N ILE 136.A O no hydrogen 2.888 N/A LYS 179.A N ILE 136.A O no hydrogen 3.398 N/A LYS 179.A NZ GLY 334.A O no hydrogen 3.176 N/A VAL 181.A N TYR 134.A O no hydrogen 2.688 N/A LYS 182.A NZ THR 132.A O no hydrogen 2.626 N/A LYS 182.A NZ ASN 205.A OD1 no hydrogen 3.042 N/A TYR 186.A N ASP 184.A O no hydrogen 2.440 N/A LEU 187.A N ASP 184.A O no hydrogen 2.957 N/A SER 188.A N ASP 184.A O no hydrogen 3.056 N/A ALA 191.A N LEU 187.A O no hydrogen 2.752 N/A LYS 192.A N ASP 189.A O no hydrogen 2.626 N/A LYS 193.A N ASP 189.A O no hydrogen 2.801 N/A HIS 195.A N LYS 192.A O no hydrogen 3.419 N/A THR 197.A N GLY 137.A O no hydrogen 2.645 N/A ASN 199.A ND2 GLU 135.A OE2 no hydrogen 2.907 N/A THR 201.A N ALA 133.A O no hydrogen 3.123 N/A SER 203.A N GLY 131.A O no hydrogen 3.145 N/A SER 203.A OG TYR 333.A OH no hydrogen 2.591 N/A ARG 204.A NE GLU 247.A OE2 no hydrogen 2.526 N/A ARG 204.A NH1 GLY 117.A O no hydrogen 2.870 N/A ARG 204.A NH2 GLY 117.A O no hydrogen 3.117 N/A ARG 204.A NH2 GLU 247.A OE1 no hydrogen 3.088 N/A ARG 204.A NH2 GLU 247.A OE2 no hydrogen 2.880 N/A ASN 205.A N ASN 129.A O no hydrogen 2.657 N/A ASN 205.A ND2 ASN 129.A OD1 no hydrogen 2.735 N/A TYR 206.A N TYR 330.A OH no hydrogen 2.818 N/A TYR 206.A OH GLU 247.A OE2 no hydrogen 2.636 N/A GLU 209.A N TYR 206.A O no hydrogen 2.775 N/A ALA 211.A N LEU 208.A O no hydrogen 3.034 N/A THR 212.A N GLU 209.A O no hydrogen 3.397 N/A THR 212.A OG1 GLU 209.A O no hydrogen 3.458 N/A SER 213.A OG GLU 209.A O no hydrogen 3.339 N/A SER 213.A OG SER 326.A OG no hydrogen 3.259 N/A SER 213.A OG TYR 327.A O no hydrogen 2.951 N/A LEU 216.A N THR 212.A O no hydrogen 3.006 N/A GLY 217.A N SER 213.A O no hydrogen 3.047 N/A GLY 220.A N ILE 241.A O no hydrogen 2.821 N/A ILE 222.A N ALA 239.A O no hydrogen 3.270 N/A ASN 223.A N GLU 226.A OE2 no hydrogen 3.221 N/A GLU 226.A N ASN 223.A OD1 no hydrogen 2.609 N/A LEU 227.A N ASN 223.A O no hydrogen 2.861 N/A LYS 228.A N GLU 225.A O no hydrogen 3.273 N/A TYR 235.A N TYR 232.A O no hydrogen 3.180 N/A TYR 235.A OH ASP 251.A OD2 no hydrogen 2.952 N/A ILE 241.A N GLY 220.A O no hydrogen 2.749 N/A GLY 242.A N ASP 251.A OD1 no hydrogen 2.970 N/A LYS 243.A N TYR 218.A O no hydrogen 2.923 N/A LYS 243.A NZ PRO 221.A O no hydrogen 2.873 N/A LYS 243.A NZ GLU 226.A OE2 no hydrogen 2.591 N/A LYS 244.A NZ TYR 327.A OH no hydrogen 3.541 N/A LEU 246.A N LEU 215.A O no hydrogen 2.786 N/A GLU 247.A N LEU 216.A O no hydrogen 2.913 N/A LYS 248.A N LYS 244.A O no hydrogen 3.211 N/A LYS 248.A N GLY 245.A O no hydrogen 3.082 N/A LEU 249.A N GLY 245.A O no hydrogen 2.928 N/A TYR 250.A N LEU 246.A O no hydrogen 2.907 N/A TYR 250.A OH ASP 452.A O no hydrogen 2.821 N/A ASP 251.A N LYS 248.A O no hydrogen 3.163 N/A LEU 254.A N TYR 250.A O no hydrogen 3.367 N/A LEU 254.A N ASP 251.A O no hydrogen 2.825 N/A GLN 255.A N ASP 251.A O no hydrogen 2.680 N/A GLN 255.A N LYS 252.A O no hydrogen 3.000 N/A GLN 255.A NE2 VAL 240.A O no hydrogen 2.593 N/A GLN 255.A NE2 ASP 251.A OD2 no hydrogen 2.937 N/A HIS 256.A N GLN 255.A OE1 no hydrogen 3.123 N/A HIS 256.A ND1 SER 114.A OG no hydrogen 2.858 N/A GLU 257.A N LYS 281.A O no hydrogen 2.928 N/A GLY 259.A N LEU 112.A O no hydrogen 2.961 N/A TYR 260.A N LYS 278.A O no hydrogen 2.817 N/A TYR 260.A OH TYR 72.A O no hydrogen 2.484 N/A ARG 261.A NE GLU 277.A OE1 no hydrogen 2.430 N/A VAL 262.A N ILE 276.A O no hydrogen 2.757 N/A THR 263.A N HIS 108.A O no hydrogen 2.894 N/A ILE 264.A N HIS 273.A O no hydrogen 2.871 N/A VAL 265.A N SER 106.A O no hydrogen 3.127 N/A ASP 266.A N THR 270.A O no hydrogen 3.202 N/A ASP 267.A N ASP 104.A O no hydrogen 2.904 N/A ALA 272.A N ILE 264.A O no hydrogen 2.753 N/A HIS 273.A N ILE 264.A O no hydrogen 3.365 N/A LEU 275.A N VAL 262.A O no hydrogen 2.789 N/A ILE 276.A N VAL 262.A O no hydrogen 3.237 N/A LYS 278.A N TYR 260.A O no hydrogen 2.763 N/A LYS 278.A NZ ASP 258.A O no hydrogen 3.280 N/A LYS 279.A NZ GLU 277.A OE2 no hydrogen 3.180 N/A LYS 280.A NZ ASP 282.A OD2 no hydrogen 2.847 N/A LYS 281.A N GLU 257.A O no hydrogen 2.853 N/A GLY 283.A N GLU 115.A O no hydrogen 3.078 N/A LYS 284.A N LYS 253.A O no hydrogen 3.161 N/A ILE 286.A N LYS 118.A O no hydrogen 2.732 N/A GLN 287.A NE2 ASN 124.A OD1 no hydrogen 3.133 N/A LEU 288.A N LEU 120.A O no hydrogen 2.585 N/A THR 289.A N LEU 502.A O no hydrogen 2.741 N/A THR 289.A OG1 LEU 318.A O no hydrogen 2.706 N/A THR 289.A OG1 HIS 501.A O no hydrogen 3.279 N/A ASP 291.A N LEU 319.A O no hydrogen 2.755 N/A ALA 292.A N ASP 121.A OD1 no hydrogen 2.684 N/A LYS 293.A N ASP 291.A OD1 no hydrogen 3.112 N/A LYS 293.A NZ ASP 291.A OD1 no hydrogen 3.501 N/A LYS 293.A NZ ASP 291.A OD2 no hydrogen 3.076 N/A LYS 293.A NZ ASP 606.A O no hydrogen 2.796 N/A LYS 293.A NZ GLU 609.A OXT no hydrogen 3.145 N/A VAL 294.A N ASP 291.A O no hydrogen 2.937 N/A GLN 295.A N ASP 291.A O no hydrogen 3.001 N/A LYS 296.A N ALA 292.A O no hydrogen 2.928 N/A SER 297.A N LYS 293.A O no hydrogen 3.128 N/A ILE 298.A N VAL 294.A O no hydrogen 2.933 N/A TYR 299.A N GLN 295.A O no hydrogen 3.022 N/A ASN 300.A N LYS 296.A O no hydrogen 2.723 N/A ASN 301.A N SER 297.A O no hydrogen 3.197 N/A ASN 301.A ND2 SER 297.A O no hydrogen 3.273 N/A ASN 301.A ND2 GLU 596.A OE1 no hydrogen 2.891 N/A LYS 302.A NZ ASN 300.A O no hydrogen 3.386 N/A TYR 305.A OH GLU 348.A OE1 no hydrogen 3.095 N/A GLY 306.A N THR 324.A O no hydrogen 3.068 N/A SER 307.A N ASN 574.A O no hydrogen 3.025 N/A GLY 308.A N VAL 322.A O no hydrogen 2.940 N/A THR 309.A N ALA 572.A O no hydrogen 3.050 N/A ALA 310.A N ALA 320.A O no hydrogen 3.119 N/A HIS 312.A N GLU 317.A O no hydrogen 2.762 N/A HIS 312.A ND1 ASN 571.A O no hydrogen 2.723 N/A GLN 314.A N GLN 314.A OE1 no hydrogen 2.643 N/A GLN 314.A NE2 PRO 570.A O no hydrogen 2.784 N/A THR 315.A N HIS 312.A O no hydrogen 3.088 N/A THR 315.A OG1 GLU 317.A OE2 no hydrogen 2.672 N/A GLY 316.A N HIS 312.A O no hydrogen 2.936 N/A GLU 317.A N THR 315.A OG1 no hydrogen 3.289 N/A LEU 318.A N HIS 501.A O no hydrogen 3.147 N/A LEU 319.A N ALA 310.A O no hydrogen 2.890 N/A ALA 320.A N ALA 310.A O no hydrogen 3.378 N/A VAL 322.A N GLY 308.A O no hydrogen 2.815 N/A SER 323.A OG LEU 351.A O no hydrogen 3.196 N/A THR 324.A N GLY 306.A O no hydrogen 3.089 N/A THR 324.A OG1 ASP 304.A O no hydrogen 2.696 N/A THR 324.A OG1 GLY 306.A O no hydrogen 3.564 N/A SER 326.A OG LYS 210.A O no hydrogen 2.474 N/A SER 326.A OG SER 213.A OG no hydrogen 3.259 N/A PHE 332.A N VAL 329.A O no hydrogen 2.749 N/A TYR 333.A OH SER 203.A OG no hydrogen 2.591 N/A GLY 334.A N PRO 331.A O no hydrogen 2.697 N/A SER 335.A OG GLU 338.A OE2 no hydrogen 2.810 N/A GLU 338.A N SER 335.A OG no hydrogen 3.337 N/A TYR 339.A N SER 335.A O no hydrogen 3.142 N/A ASN 340.A N ASN 336.A O no hydrogen 2.835 N/A LYS 341.A N GLU 337.A O no hydrogen 2.967 N/A LYS 341.A NZ GLU 337.A OE2 no hydrogen 3.559 N/A LEU 342.A N TYR 339.A O no hydrogen 3.325 N/A THR 343.A N TYR 339.A O no hydrogen 3.121 N/A GLU 344.A N ASN 340.A O no hydrogen 2.825 N/A LYS 346.A NZ GLU 344.A O no hydrogen 3.074 N/A LYS 347.A N ASP 345.A OD1 no hydrogen 3.481 N/A LYS 347.A NZ ASN 303.A O no hydrogen 3.182 N/A GLU 348.A N ASP 345.A O no hydrogen 3.082 N/A LEU 351.A N GLU 348.A O no hydrogen 2.935 N/A LYS 353.A N SER 323.A OG no hydrogen 3.136 N/A LYS 353.A NZ THR 324.A O no hydrogen 3.037 N/A LYS 353.A NZ LYS 347.A O no hydrogen 2.907 N/A LYS 353.A NZ GLU 348.A O no hydrogen 2.954 N/A GLN 355.A N ASN 352.A O no hydrogen 3.261 N/A ILE 356.A N ASN 352.A O no hydrogen 3.355 N/A THR 357.A OG1 GLN 459.A OE1 no hydrogen 3.403 N/A THR 358.A N ILE 479.A O no hydrogen 2.848 N/A GLY 361.A N SER 359.A OG no hydrogen 3.351 N/A SER 362.A OG SER 550.A O no hydrogen 2.384 N/A THR 363.A N PRO 360.A O no hydrogen 2.994 N/A THR 363.A OG1 PRO 360.A O no hydrogen 2.344 N/A GLN 364.A N GLY 361.A O no hydrogen 3.102 N/A GLN 364.A NE2 THR 368.A OG1 no hydrogen 3.119 N/A LYS 365.A N SER 362.A O no hydrogen 3.309 N/A LYS 365.A NZ SER 420.A O no hydrogen 2.619 N/A LYS 365.A NZ SER 420.A OG no hydrogen 2.654 N/A LYS 365.A NZ ASN 422.A OD1 no hydrogen 2.775 N/A ILE 366.A N THR 363.A O no hydrogen 3.188 N/A THR 368.A N GLN 364.A O no hydrogen 2.790 N/A THR 368.A OG1 GLN 364.A O no hydrogen 3.175 N/A THR 368.A OG1 GLY 471.A O no hydrogen 2.700 N/A ALA 369.A N LYS 365.A O no hydrogen 2.831 N/A GLY 371.A N THR 368.A O no hydrogen 3.028 N/A LEU 372.A N ALA 369.A O no hydrogen 2.749 N/A ASN 374.A N ILE 370.A O no hydrogen 3.107 N/A ASN 374.A ND2 ILE 370.A O no hydrogen 2.836 N/A LYS 375.A N LEU 372.A O no hydrogen 2.967 N/A THR 376.A N GLY 371.A O no hydrogen 2.940 N/A THR 376.A OG1 GLY 371.A O no hydrogen 3.502 N/A LEU 377.A N GLY 371.A O no hydrogen 3.041 N/A ASP 378.A N THR 381.A OG1 no hydrogen 2.932 N/A LYS 380.A N ASP 378.A OD1 no hydrogen 2.872 N/A LYS 380.A NZ ASP 379.A OD2 no hydrogen 3.477 N/A THR 381.A N ASP 378.A O no hydrogen 2.896 N/A THR 381.A N ASP 378.A OD1 no hydrogen 3.080 N/A THR 381.A OG1 ASP 378.A O no hydrogen 3.196 N/A TYR 383.A N ILE 411.A O no hydrogen 3.460 N/A TYR 383.A OH GLU 431.A OE1 no hydrogen 2.882 N/A ILE 385.A N GLY 409.A O no hydrogen 3.077 N/A GLY 387.A N ASN 408.A OD1 no hydrogen 2.993 N/A LYS 388.A NZ ARG 403.A O no hydrogen 3.278 N/A LYS 388.A NZ TYR 404.A O no hydrogen 2.868 N/A TRP 390.A N VAL 401.A O no hydrogen 2.720 N/A GLN 391.A NE2 GLY 397.A O no hydrogen 3.100 N/A GLN 391.A NE2 TYR 399.A O no hydrogen 3.030 N/A LYS 392.A NZ GLU 464.A OE1 no hydrogen 2.295 N/A SER 395.A N ASP 393.A OD1 no hydrogen 2.484 N/A SER 395.A OG ASP 393.A OD1 no hydrogen 3.148 N/A GLY 397.A N LYS 394.A O no hydrogen 2.650 N/A TYR 399.A N TRP 396.A O no hydrogen 2.993 N/A TYR 399.A OH ASP 469.A OD1 no hydrogen 2.500 N/A TYR 399.A OH TYR 472.A OH no hydrogen 3.376 N/A VAL 401.A N TRP 390.A O no hydrogen 2.779 N/A ARG 403.A N LYS 388.A O no hydrogen 3.054 N/A ARG 403.A NE GLY 387.A O no hydrogen 2.972 N/A ARG 403.A NH1 VAL 407.A O no hydrogen 3.151 N/A ARG 403.A NH1 ASP 421.A OD1 no hydrogen 2.791 N/A ARG 403.A NH2 ILE 385.A O no hydrogen 3.382 N/A ARG 403.A NH2 GLY 387.A O no hydrogen 2.983 N/A ARG 403.A NH2 VAL 407.A O no hydrogen 3.251 N/A ILE 411.A N TYR 383.A O no hydrogen 3.053 N/A GLN 415.A N ASP 412.A OD1 no hydrogen 2.381 N/A GLN 415.A NE2 SER 419.A OG no hydrogen 2.785 N/A ALA 416.A N ASP 412.A O no hydrogen 3.024 N/A ILE 417.A N LEU 413.A O no hydrogen 2.836 N/A GLU 418.A N LYS 414.A O no hydrogen 3.015 N/A SER 419.A N GLN 415.A O no hydrogen 2.967 N/A SER 419.A OG GLN 415.A O no hydrogen 3.139 N/A SER 420.A N ILE 417.A O no hydrogen 3.123 N/A ASP 421.A N ALA 416.A O no hydrogen 2.994 N/A ASN 422.A ND2 THR 402.A O no hydrogen 3.105 N/A PHE 424.A N ASP 421.A OD2 no hydrogen 2.941 N/A PHE 425.A N ASP 421.A O no hydrogen 3.500 N/A ALA 426.A N ASN 422.A O no hydrogen 2.996 N/A ARG 427.A N ILE 423.A O no hydrogen 2.842 N/A VAL 428.A N PHE 424.A O no hydrogen 3.084 N/A ALA 429.A N PHE 425.A O no hydrogen 2.875 N/A LEU 430.A N ALA 426.A O no hydrogen 3.126 N/A GLU 431.A N ARG 427.A O no hydrogen 2.683 N/A LEU 432.A N VAL 428.A O no hydrogen 3.040 N/A GLY 433.A N ALA 429.A O no hydrogen 3.191 N/A SER 434.A OG ASP 462.A OD1 no hydrogen 3.163 N/A PHE 437.A N GLY 433.A O no hydrogen 3.034 N/A GLU 438.A N SER 434.A O no hydrogen 2.872 N/A LYS 439.A N LYS 435.A O no hydrogen 2.757 N/A GLY 440.A N LYS 436.A O no hydrogen 2.621 N/A LYS 442.A N LYS 439.A O no hydrogen 2.783 N/A LYS 442.A N GLY 440.A O no hydrogen 2.939 N/A LYS 442.A NZ ASN 514.A O no hydrogen 3.306 N/A LEU 443.A N GLY 440.A O no hydrogen 3.166 N/A GLY 444.A N LYS 441.A O no hydrogen 3.039 N/A GLU 447.A N GLY 444.A O no hydrogen 3.236 N/A SER 451.A N ILE 449.A O no hydrogen 2.862 N/A SER 451.A OG ASP 452.A OD2 no hydrogen 3.513 N/A SER 451.A OG PRO 500.A O no hydrogen 2.600 N/A TYR 456.A N GLN 355.A O no hydrogen 3.116 N/A GLN 459.A N LEU 478.A O no hydrogen 2.892 N/A LEU 466.A N ASN 463.A OD1 no hydrogen 2.571 N/A LEU 467.A N ASN 463.A O no hydrogen 2.946 N/A ALA 468.A N GLU 464.A O no hydrogen 2.869 N/A ASP 469.A N ILE 465.A O no hydrogen 3.173 N/A SER 470.A N LEU 466.A O no hydrogen 3.257 N/A SER 470.A OG LEU 466.A O no hydrogen 2.791 N/A GLY 471.A N LEU 467.A O no hydrogen 2.768 N/A TYR 472.A N ASP 469.A O no hydrogen 3.388 N/A TYR 472.A OH ASP 469.A OD1 no hydrogen 2.725 N/A GLY 473.A N SER 470.A O no hydrogen 2.986 N/A GLN 474.A N ASP 469.A O no hydrogen 2.651 N/A LEU 478.A N GLN 459.A O no hydrogen 3.286 N/A ILE 479.A N THR 358.A O no hydrogen 2.562 N/A ASN 480.A ND2 PHE 354.A O no hydrogen 2.552 N/A ASN 480.A ND2 GLN 355.A O no hydrogen 2.984 N/A GLN 483.A N ASN 480.A OD1 no hydrogen 3.138 N/A GLN 483.A NE2 GLY 444.A O no hydrogen 2.899 N/A ILE 484.A N ASN 480.A O no hydrogen 3.067 N/A LEU 485.A N PRO 481.A O no hydrogen 2.750 N/A SER 486.A N VAL 482.A O no hydrogen 2.567 N/A SER 486.A OG VAL 482.A O no hydrogen 2.683 N/A ILE 487.A N GLN 483.A O no hydrogen 2.913 N/A TYR 488.A N ILE 484.A O no hydrogen 3.048 N/A TYR 488.A OH THR 363.A O no hydrogen 2.710 N/A SER 489.A N LEU 485.A O no hydrogen 2.789 N/A SER 489.A OG SER 486.A O no hydrogen 2.626 N/A ALA 490.A N ILE 487.A O no hydrogen 3.221 N/A LEU 491.A N TYR 488.A O no hydrogen 2.856 N/A GLU 492.A N SER 489.A O no hydrogen 2.810 N/A ASN 493.A N ALA 490.A O no hydrogen 3.345 N/A GLY 495.A N ALA 490.A O no hydrogen 2.832 N/A ASN 496.A N ASN 493.A O no hydrogen 3.006 N/A ASN 496.A ND2 ASN 493.A O no hydrogen 3.377 N/A ILE 497.A N LYS 512.A O no hydrogen 2.677 N/A ASN 498.A ND2 ASN 493.A OD1 no hydrogen 2.731 N/A ALA 499.A N LYS 509.A O no hydrogen 2.960 N/A HIS 501.A N GLY 316.A O no hydrogen 3.171 N/A HIS 501.A ND1 ALA 499.A O no hydrogen 2.999 N/A LEU 502.A N ASP 452.A OD2 no hydrogen 2.740 N/A LEU 503.A N ASP 452.A OD1 no hydrogen 2.953 N/A LYS 504.A N GLN 287.A O no hydrogen 2.919 N/A LYS 504.A NZ ARG 122.A O no hydrogen 3.376 N/A THR 506.A N LEU 503.A O no hydrogen 3.152 N/A THR 506.A OG1 ASP 452.A OD1 no hydrogen 2.583 N/A TRP 511.A N ILE 497.A O no hydrogen 2.870 N/A LYS 512.A N ILE 497.A O no hydrogen 3.119 N/A LYS 512.A NZ GLU 447.A OE1 no hydrogen 2.582 N/A LYS 512.A NZ GLU 447.A OE2 no hydrogen 3.109 N/A ASN 514.A N ASN 496.A OD1 no hydrogen 2.757 N/A ILE 515.A N GLY 495.A O no hydrogen 2.769 N/A ILE 521.A N SER 517.A O no hydrogen 3.178 N/A ASN 522.A N LYS 518.A O no hydrogen 3.404 N/A LEU 523.A N GLU 519.A O no hydrogen 3.317 N/A LEU 524.A N ASN 520.A O no hydrogen 2.949 N/A THR 525.A N ILE 521.A O no hydrogen 2.881 N/A THR 525.A OG1 ILE 521.A O no hydrogen 2.932 N/A THR 525.A OG1 ASN 522.A O no hydrogen 3.163 N/A ASP 526.A N ASN 522.A O no hydrogen 3.255 N/A GLN 529.A N ASP 526.A O no hydrogen 3.260 N/A VAL 531.A N GLN 528.A O no hydrogen 3.236 N/A ASN 532.A N GLN 528.A O no hydrogen 3.024 N/A LYS 533.A N GLN 529.A O no hydrogen 2.770 N/A THR 534.A OG1 GLU 418.A O no hydrogen 2.591 N/A HIS 535.A N VAL 530.A O no hydrogen 2.951 N/A LYS 536.A N LYS 533.A O no hydrogen 3.021 N/A ASP 538.A N HIS 535.A O no hydrogen 2.882 N/A ILE 539.A N HIS 535.A O no hydrogen 3.139 N/A ARG 541.A NE ASP 595.A OD1 no hydrogen 2.686 N/A ARG 541.A NE ASP 595.A OD2 no hydrogen 2.654 N/A ARG 541.A NH1 ASP 538.A O no hydrogen 3.508 N/A ARG 541.A NH1 TYR 540.A O no hydrogen 2.963 N/A ARG 541.A NH2 ASP 595.A OD2 no hydrogen 2.900 N/A TYR 543.A OH ASP 595.A OD1 no hydrogen 2.413 N/A ALA 544.A N ARG 541.A O no hydrogen 3.001 N/A ASN 545.A N ASP 566.A OD2 no hydrogen 3.147 N/A ILE 547.A N TYR 565.A O no hydrogen 3.131 N/A LYS 549.A N ILE 563.A O no hydrogen 2.917 N/A LYS 549.A NZ SER 362.A O no hydrogen 3.535 N/A LYS 549.A NZ SER 420.A OG no hydrogen 2.882 N/A LYS 549.A NZ SER 550.A O no hydrogen 2.543 N/A SER 550.A OG HIS 535.A NE2 no hydrogen 3.372 N/A GLY 551.A N SER 550.A OG no hydrogen 2.499 N/A LEU 555.A N ARG 557.A O no hydrogen 2.725 N/A LYS 556.A NZ GLN 474.A O no hydrogen 2.946 N/A ARG 557.A NE ASP 577.A OD1 no hydrogen 2.872 N/A ARG 557.A NH2 ASP 577.A OD1 no hydrogen 2.681 N/A ARG 557.A NH2 ASP 577.A OD2 no hydrogen 2.520 N/A GLN 558.A NE2 ARG 557.A O no hydrogen 3.644 N/A ILE 559.A N ALA 553.A O no hydrogen 3.312 N/A GLY 560.A N VAL 575.A O no hydrogen 2.835 N/A TRP 561.A N GLY 551.A O no hydrogen 3.388 N/A TRP 561.A NE1 SER 359.A O no hydrogen 3.240 N/A PHE 562.A N ILE 573.A O no hydrogen 2.862 N/A ILE 563.A N LYS 549.A O no hydrogen 3.028 N/A SER 564.A OG TYR 594.A OH no hydrogen 2.787 N/A TYR 565.A N ILE 547.A O no hydrogen 3.322 N/A TYR 565.A OH GLU 492.A OE1 no hydrogen 2.602 N/A LYS 567.A N ASN 545.A O no hydrogen 2.945 N/A ASP 568.A N ASP 566.A OD2 no hydrogen 3.014 N/A ASN 569.A N ASP 566.A O no hydrogen 3.130 N/A ASN 569.A ND2 TYR 598.A OH no hydrogen 2.752 N/A ASN 569.A ND2 TYR 605.A O no hydrogen 3.278 N/A ASN 571.A ND2 TYR 605.A O no hydrogen 2.891 N/A ILE 573.A N PHE 562.A O no hydrogen 2.768 N/A ASN 574.A N SER 307.A O no hydrogen 2.998 N/A VAL 575.A N GLY 560.A O no hydrogen 2.949 N/A LYS 576.A N TYR 305.A O no hydrogen 2.808 N/A VAL 578.A N GLN 558.A O no hydrogen 2.997 N/A GLN 579.A NE2 ASP 577.A OD1 no hydrogen 3.169 N/A LYS 581.A N VAL 578.A O no hydrogen 2.697 N/A LYS 581.A NZ ASP 577.A O no hydrogen 3.086 N/A ALA 583.A N THR 552.A OG1 no hydrogen 3.152 N/A SER 584.A N GLY 582.A O no hydrogen 2.951 N/A SER 584.A OG GLY 582.A O no hydrogen 2.502 N/A TYR 585.A OH ASP 304.A OD1 no hydrogen 3.117 N/A TYR 585.A OH ASP 304.A OD2 no hydrogen 2.988 N/A ASN 586.A N ALA 583.A O no hydrogen 3.258 N/A ALA 587.A N ALA 583.A O no hydrogen 3.477 N/A LYS 588.A N SER 584.A O no hydrogen 2.963 N/A LYS 588.A NZ ASP 538.A OD1 no hydrogen 3.071 N/A ILE 589.A N TYR 585.A O no hydrogen 3.067 N/A SER 590.A N ASN 586.A O no hydrogen 2.900 N/A SER 590.A OG ASN 586.A O no hydrogen 2.612 N/A GLY 591.A N ALA 587.A O no hydrogen 2.912 N/A LYS 592.A N LYS 588.A O no hydrogen 2.882 N/A VAL 593.A N ILE 589.A O no hydrogen 2.970 N/A TYR 594.A N SER 590.A O no hydrogen 3.009 N/A TYR 594.A OH SER 564.A OG no hydrogen 2.787 N/A ASP 595.A N GLY 591.A O no hydrogen 3.013 N/A GLU 596.A N LYS 592.A O no hydrogen 3.141 N/A GLU 596.A N VAL 593.A O no hydrogen 2.979 N/A LEU 597.A N VAL 593.A O no hydrogen 3.048 N/A TYR 598.A N TYR 594.A O no hydrogen 2.841 N/A TYR 598.A OH ASP 566.A OD1 no hydrogen 2.641 N/A GLU 599.A N GLU 596.A O no hydrogen 3.056 N/A ASN 600.A N ASP 595.A O no hydrogen 2.577 N/A GLY 601.A N TYR 598.A O no hydrogen 2.889 N/A ASN 602.A N GLU 599.A O no hydrogen 2.961 N/A LYS 603.A N TYR 598.A O no hydrogen 3.064 N/A LYS 603.A NZ GLU 609.A OE1 no hydrogen 2.967 N/A TYR 605.A OH ASP 291.A OD2 no hydrogen 2.421 N/A ASP 608.A N ASP 606.A OD1 no hydrogen 3.233 N/A GLU 609.A N ASP 606.A O no hydrogen 3.266 N/A