Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pvw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 11.A N GLU 8.A O no hydrogen 3.064 N/A ARG 12.A N PRO 9.A O no hydrogen 3.011 N/A ARG 12.A NE GLN 16.A OE1 no hydrogen 2.925 N/A ARG 12.A NH1 THR 144.A OG1 no hydrogen 3.429 N/A ARG 12.A NH2 GLN 16.A OE1 no hydrogen 3.085 N/A SER 13.A N SER 10.A O no hydrogen 3.275 N/A SER 13.A OG HIS 513.A O no hydrogen 3.435 N/A MET 15.A N ILE 11.A O no hydrogen 2.919 N/A GLN 16.A N ARG 12.A O no hydrogen 2.750 N/A GLN 16.A NE2 GLU 20.A OE1 no hydrogen 3.334 N/A TYR 18.A N VAL 14.A O no hydrogen 3.276 N/A LEU 19.A N MET 15.A O no hydrogen 3.102 N/A GLU 20.A N GLN 16.A O no hydrogen 2.977 N/A ASP 21.A N LYS 17.A O no hydrogen 2.920 N/A ARG 22.A N LEU 19.A O no hydrogen 2.869 N/A ARG 22.A NH1 TYR 18.A O no hydrogen 2.700 N/A GLY 23.A N GLU 20.A O no hydrogen 3.300 N/A GLU 24.A N LEU 19.A O no hydrogen 2.973 N/A LYS 29.A N THR 26.A OG1 no hydrogen 3.150 N/A ILE 30.A N THR 26.A O no hydrogen 3.065 N/A PHE 31.A N PHE 27.A O no hydrogen 2.802 N/A SER 32.A N GLU 28.A O no hydrogen 3.144 N/A SER 32.A OG GLU 28.A O no hydrogen 2.790 N/A SER 32.A OG LYS 29.A O no hydrogen 3.544 N/A GLN 33.A N ILE 30.A O no hydrogen 3.046 N/A GLN 33.A NE2 LYS 29.A O no hydrogen 2.769 N/A LYS 34.A NZ GLN 470.A OE1 no hydrogen 2.688 N/A LEU 35.A N GLN 469.A OE1 no hydrogen 2.920 N/A TYR 37.A N GLN 33.A O no hydrogen 2.802 N/A TYR 37.A OH GLU 59.A OE1 no hydrogen 2.825 N/A LEU 38.A N LYS 34.A O no hydrogen 3.069 N/A LEU 39.A N LEU 35.A O no hydrogen 3.092 N/A PHE 40.A N GLY 36.A O no hydrogen 2.945 N/A ARG 41.A N TYR 37.A O no hydrogen 2.767 N/A ASP 42.A N LEU 38.A O no hydrogen 3.152 N/A PHE 43.A N LEU 39.A O no hydrogen 3.201 N/A CYS 44.A N PHE 40.A O no hydrogen 3.084 N/A CYS 44.A SG PHE 40.A O no hydrogen 3.412 N/A LEU 45.A N ARG 41.A O no hydrogen 2.953 N/A LYS 46.A N ASP 42.A O no hydrogen 2.992 N/A HIS 47.A N PHE 43.A O no hydrogen 2.953 N/A ALA 51.A N LEU 48.A O no hydrogen 3.397 N/A VAL 55.A N ALA 51.A O no hydrogen 3.266 N/A GLU 56.A N LYS 52.A O no hydrogen 3.060 N/A PHE 57.A N PRO 53.A O no hydrogen 2.822 N/A TYR 58.A N LEU 54.A O no hydrogen 2.871 N/A GLU 59.A N VAL 55.A O no hydrogen 2.811 N/A GLU 60.A N GLU 56.A O no hydrogen 2.970 N/A ILE 61.A N PHE 57.A O no hydrogen 2.977 N/A LYS 62.A N TYR 58.A O no hydrogen 3.008 N/A LYS 62.A NZ GLU 65.A OE1 no hydrogen 3.349 N/A LYS 62.A NZ GLU 65.A OE2 no hydrogen 3.426 N/A LYS 63.A N GLU 59.A O no hydrogen 3.008 N/A TYR 64.A N GLU 60.A O no hydrogen 3.104 N/A TYR 64.A OH PRO 114.A O no hydrogen 2.831 N/A GLU 65.A N ILE 61.A O no hydrogen 2.786 N/A LYS 66.A N LYS 63.A O no hydrogen 3.121 N/A LYS 66.A NZ LYS 62.A O no hydrogen 3.563 N/A LEU 67.A N TYR 64.A O no hydrogen 3.164 N/A THR 69.A OG1 GLU 72.A OE1 no hydrogen 3.370 N/A GLU 72.A N THR 69.A OG1 no hydrogen 3.168 N/A ARG 73.A N THR 69.A O no hydrogen 3.368 N/A ARG 73.A NE VAL 113.A O no hydrogen 3.101 N/A ARG 73.A NH1 LEU 67.A O no hydrogen 3.026 N/A LEU 74.A N GLU 70.A O no hydrogen 3.087 N/A VAL 75.A N GLU 71.A O no hydrogen 3.344 N/A CYS 76.A N GLU 72.A O no hydrogen 3.109 N/A SER 77.A N ARG 73.A O no hydrogen 3.020 N/A SER 77.A OG ARG 73.A O no hydrogen 2.610 N/A SER 77.A OG LEU 74.A O no hydrogen 2.901 N/A ARG 78.A N LEU 74.A O no hydrogen 3.323 N/A GLU 79.A N VAL 75.A O no hydrogen 3.275 N/A ILE 80.A N CYS 76.A O no hydrogen 2.998 N/A PHE 81.A N SER 77.A O no hydrogen 3.030 N/A ASP 82.A N ARG 78.A O no hydrogen 3.008 N/A THR 83.A N GLU 79.A O no hydrogen 3.031 N/A THR 83.A OG1 GLU 79.A O no hydrogen 3.189 N/A TYR 84.A N ILE 80.A O no hydrogen 2.728 N/A ILE 85.A N PHE 81.A O no hydrogen 3.107 N/A MET 86.A N PHE 81.A O no hydrogen 2.886 N/A LYS 87.A N ASP 82.A O no hydrogen 3.262 N/A LEU 89.A N ILE 85.A O no hydrogen 3.161 N/A LEU 90.A N MET 86.A O no hydrogen 2.925 N/A ALA 91.A N LYS 87.A O no hydrogen 2.699 N/A CYS 92.A N LEU 89.A O no hydrogen 3.125 N/A SER 93.A N GLU 88.A O no hydrogen 2.750 N/A SER 93.A OG ALA 91.A O no hydrogen 2.695 N/A HIS 94.A ND1 GLU 88.A OE1 no hydrogen 2.770 N/A HIS 94.A NE2 TYR 121.A OH no hydrogen 3.192 N/A PHE 96.A N HIS 94.A O no hydrogen 3.037 N/A SER 97.A N GLU 124.A OE1 no hydrogen 2.983 N/A SER 97.A OG SER 99.A OG no hydrogen 3.171 N/A SER 97.A OG GLU 124.A OE1 no hydrogen 3.391 N/A SER 97.A OG GLU 124.A OE2 no hydrogen 2.590 N/A SER 99.A OG SER 97.A OG no hydrogen 3.171 N/A ALA 100.A N SER 97.A OG no hydrogen 3.011 N/A ILE 101.A N SER 97.A O no hydrogen 3.168 N/A GLU 102.A N LYS 98.A O no hydrogen 2.984 N/A HIS 103.A N SER 99.A O no hydrogen 2.922 N/A VAL 104.A N ALA 100.A O no hydrogen 3.488 N/A GLN 105.A N ILE 101.A O no hydrogen 3.239 N/A GLY 106.A N GLU 102.A O no hydrogen 2.833 N/A HIS 107.A N HIS 103.A O no hydrogen 3.330 N/A LEU 108.A N VAL 104.A O no hydrogen 2.722 N/A VAL 109.A N GLN 105.A O no hydrogen 2.937 N/A LYS 111.A N LEU 108.A O no hydrogen 3.153 N/A GLN 112.A N HIS 107.A O no hydrogen 3.240 N/A LEU 117.A N PRO 114.A O no hydrogen 2.882 N/A GLN 119.A N ASP 116.A O no hydrogen 3.082 N/A TYR 121.A OH HIS 94.A NE2 no hydrogen 3.192 N/A ILE 122.A N PHE 118.A O no hydrogen 3.044 N/A GLU 123.A N GLN 119.A O no hydrogen 3.180 N/A GLU 124.A N PRO 120.A O no hydrogen 3.172 N/A ILE 125.A N TYR 121.A O no hydrogen 2.969 N/A CYS 126.A N ILE 122.A O no hydrogen 3.153 N/A CYS 126.A SG ILE 122.A O no hydrogen 3.589 N/A GLN 127.A N GLU 123.A O no hydrogen 3.047 N/A ASN 128.A N GLU 124.A O no hydrogen 3.073 N/A ASN 128.A ND2 PRO 95.A O no hydrogen 2.814 N/A LEU 129.A N ILE 125.A O no hydrogen 2.794 N/A LEU 129.A N CYS 126.A O no hydrogen 3.054 N/A ARG 130.A NH2 GLN 127.A OE1 no hydrogen 2.575 N/A GLN 135.A N GLY 131.A O no hydrogen 2.983 N/A LYS 136.A N ASP 132.A O no hydrogen 2.769 N/A LYS 136.A NZ ASP 132.A OD2 no hydrogen 3.417 N/A PHE 137.A N VAL 133.A O no hydrogen 2.870 N/A ILE 138.A N PHE 134.A O no hydrogen 3.065 N/A GLU 139.A N GLN 135.A O no hydrogen 3.070 N/A SER 140.A N PHE 137.A O no hydrogen 2.994 N/A SER 140.A OG PHE 137.A O no hydrogen 2.916 N/A PHE 143.A N SER 140.A O no hydrogen 3.148 N/A THR 144.A N SER 140.A O no hydrogen 3.249 N/A ARG 145.A N ASP 141.A O no hydrogen 2.691 N/A ARG 145.A NE GLN 148.A OE1 no hydrogen 2.863 N/A ARG 145.A NH1 ASN 481.A O no hydrogen 3.521 N/A ARG 145.A NH1 ASN 481.A OD1 no hydrogen 3.504 N/A ARG 145.A NH1 ASP 485.A OD1 no hydrogen 2.783 N/A ARG 145.A NH2 ASP 485.A OD1 no hydrogen 2.746 N/A ARG 145.A NH2 GLU 488.A OE1 no hydrogen 3.285 N/A PHE 146.A N LYS 142.A O no hydrogen 2.911 N/A CYS 147.A N PHE 143.A O no hydrogen 2.967 N/A CYS 147.A SG PHE 143.A O no hydrogen 3.600 N/A GLN 148.A N THR 144.A O no hydrogen 3.106 N/A GLN 148.A NE2 PRO 7.A O no hydrogen 3.050 N/A GLN 148.A NE2 GLU 488.A OE2 no hydrogen 3.044 N/A TRP 149.A N ARG 145.A O no hydrogen 3.031 N/A TRP 149.A NE1 ASN 481.A OD1 no hydrogen 2.843 N/A LYS 150.A N PHE 146.A O no hydrogen 2.761 N/A LYS 150.A NZ GLN 33.A OE1 no hydrogen 2.725 N/A LYS 150.A NZ GLU 153.A OE1 no hydrogen 3.115 N/A ASN 151.A N CYS 147.A O no hydrogen 2.833 N/A ASN 151.A ND2 SER 581.A OG no hydrogen 3.355 N/A VAL 152.A N GLN 148.A O no hydrogen 3.400 N/A GLU 153.A N TRP 149.A O no hydrogen 3.274 N/A LEU 154.A N LYS 150.A O no hydrogen 3.174 N/A ASN 155.A N VAL 152.A O no hydrogen 3.198 N/A ASN 155.A ND2 ASP 580.A O no hydrogen 3.666 N/A ILE 156.A N GLU 153.A O no hydrogen 3.142 N/A THR 159.A N ASP 162.A OD2 no hydrogen 3.156 N/A THR 159.A OG1 ASP 162.A OD2 no hydrogen 3.339 N/A PHE 163.A N MET 160.A O no hydrogen 2.966 N/A SER 164.A N ARG 181.A O no hydrogen 2.727 N/A HIS 166.A N GLY 179.A O no hydrogen 2.736 N/A ILE 169.A N VAL 177.A O no hydrogen 3.161 N/A GLY 172.A N GLY 175.A O no hydrogen 2.678 N/A VAL 177.A N GLY 170.A O no hydrogen 3.204 N/A TYR 178.A N MET 191.A O no hydrogen 2.760 N/A GLY 179.A N ARG 167.A O no hydrogen 2.833 N/A CYS 180.A N TYR 189.A O no hydrogen 3.021 N/A CYS 180.A SG TYR 189.A O no hydrogen 3.235 N/A ARG 181.A N SER 164.A O no hydrogen 2.721 N/A ARG 181.A NH1 GLY 186.A O no hydrogen 2.912 N/A LYS 182.A N LYS 187.A O no hydrogen 3.088 N/A LYS 182.A NZ ASP 184.A OD1 no hydrogen 3.450 N/A LYS 182.A NZ TYR 231.A OH no hydrogen 3.015 N/A LYS 182.A NZ GLU 471.A OE2 no hydrogen 3.004 N/A ALA 183.A N ASP 162.A O no hydrogen 3.049 N/A THR 185.A OG1 ASP 184.A OD1 no hydrogen 3.337 N/A THR 185.A OG1 GLU 471.A OE2 no hydrogen 2.353 N/A GLY 186.A N LYS 182.A O no hydrogen 2.656 N/A LYS 187.A NZ GLU 474.A OE1 no hydrogen 2.879 N/A TYR 189.A N CYS 180.A O no hydrogen 2.840 N/A TYR 189.A OH GLU 471.A OE1 no hydrogen 2.854 N/A ALA 190.A N LEU 243.A O no hydrogen 2.745 N/A MET 191.A N TYR 178.A O no hydrogen 2.940 N/A LYS 192.A N PHE 241.A O no hydrogen 2.965 N/A LYS 192.A NZ GLU 211.A OE1 no hydrogen 3.070 N/A LYS 192.A NZ ASP 307.A OD1 no hydrogen 3.271 N/A CYS 193.A N GLU 176.A O no hydrogen 2.924 N/A LEU 194.A N LEU 239.A O no hydrogen 3.100 N/A ASP 195.A N PHE 174.A O no hydrogen 3.305 N/A LYS 196.A N ASP 237.A O no hydrogen 3.443 N/A LYS 196.A NZ THR 235.A O no hydrogen 2.857 N/A LYS 197.A N ASP 195.A OD1 no hydrogen 3.315 N/A ARG 198.A NH2 GLY 173.A O no hydrogen 3.105 N/A ILE 199.A N ASP 195.A O no hydrogen 3.175 N/A LYS 200.A N LYS 196.A O no hydrogen 3.006 N/A LYS 200.A NZ ASP 453.A OD2 no hydrogen 2.566 N/A MET 201.A N LYS 197.A O no hydrogen 3.013 N/A LYS 202.A N ARG 198.A O no hydrogen 2.858 N/A GLY 204.A N ILE 199.A O no hydrogen 2.871 N/A LEU 207.A N GLY 204.A O no hydrogen 3.165 N/A ALA 208.A N GLY 204.A O no hydrogen 3.347 N/A LEU 209.A N GLU 205.A O no hydrogen 3.161 N/A ASN 210.A N THR 206.A O no hydrogen 3.086 N/A ASN 210.A ND2 GLY 309.A O no hydrogen 3.554 N/A ASN 210.A ND2 ALA 311.A O no hydrogen 2.777 N/A GLU 211.A N LEU 207.A O no hydrogen 3.023 N/A ARG 212.A N ALA 208.A O no hydrogen 3.235 N/A ARG 212.A NE PHE 460.A O no hydrogen 3.034 N/A ARG 212.A NH1 ARG 212.A O no hydrogen 3.222 N/A ARG 212.A NH2 ASN 459.A O no hydrogen 2.759 N/A ILE 213.A N LEU 209.A O no hydrogen 3.279 N/A MET 214.A N ASN 210.A O no hydrogen 2.767 N/A LEU 215.A N GLU 211.A O no hydrogen 2.697 N/A SER 216.A N ARG 212.A O no hydrogen 3.320 N/A SER 216.A OG ARG 212.A O no hydrogen 2.988 N/A SER 216.A OG ILE 213.A O no hydrogen 2.894 N/A LEU 217.A N ILE 213.A O no hydrogen 3.209 N/A VAL 218.A N LEU 215.A O no hydrogen 3.050 N/A SER 219.A N LEU 215.A O no hydrogen 2.742 N/A SER 219.A OG LEU 215.A O no hydrogen 2.514 N/A GLY 221.A N GLU 466.A OE2 no hydrogen 3.397 N/A VAL 227.A N ILE 305.A O no hydrogen 3.003 N/A CYS 228.A N ASP 244.A OD2 no hydrogen 3.155 N/A CYS 228.A SG VAL 218.A O no hydrogen 3.909 N/A CYS 228.A SG ILE 226.A O no hydrogen 3.670 N/A MET 229.A N SER 219.A OG no hydrogen 2.928 N/A SER 230.A N ILE 242.A O no hydrogen 2.861 N/A TYR 231.A N ILE 242.A O no hydrogen 3.509 N/A TYR 231.A OH GLU 471.A OE1 no hydrogen 2.783 N/A ALA 232.A N LEU 462.A O no hydrogen 2.993 N/A THR 235.A N LYS 238.A O no hydrogen 3.068 N/A THR 235.A OG1 ASP 237.A OD2 no hydrogen 2.879 N/A THR 235.A OG1 LYS 238.A O no hydrogen 3.025 N/A LYS 238.A N THR 235.A OG1 no hydrogen 3.075 N/A LEU 239.A N LEU 194.A O no hydrogen 2.857 N/A SER 240.A N PHE 233.A O no hydrogen 3.054 N/A PHE 241.A N LYS 192.A O no hydrogen 2.791 N/A ILE 242.A N TYR 231.A O no hydrogen 3.230 N/A LEU 243.A N ALA 190.A O no hydrogen 2.634 N/A ASP 244.A N CYS 228.A O no hydrogen 2.930 N/A GLY 248.A N LEU 297.A O no hydrogen 2.631 N/A LEU 251.A N ILE 295.A O no hydrogen 3.096 N/A TYR 253.A N ASP 250.A OD1 no hydrogen 2.701 N/A HIS 254.A N ASP 250.A O no hydrogen 3.007 N/A HIS 254.A NE2 GLY 248.A O no hydrogen 2.570 N/A LEU 255.A N LEU 251.A O no hydrogen 2.784 N/A SER 256.A N HIS 252.A O no hydrogen 3.291 N/A SER 256.A OG TYR 253.A O no hydrogen 2.602 N/A GLN 257.A N TYR 253.A O no hydrogen 3.406 N/A HIS 258.A N HIS 254.A O no hydrogen 2.820 N/A HIS 258.A ND1 GLY 259.A O no hydrogen 2.949 N/A GLY 259.A N LEU 255.A O no hydrogen 2.680 N/A PHE 261.A N LEU 356.A O no hydrogen 2.785 N/A ALA 264.A N SER 262.A OG no hydrogen 2.886 N/A ASP 265.A N SER 262.A O no hydrogen 3.260 N/A MET 266.A N SER 262.A O no hydrogen 2.986 N/A ARG 267.A N GLU 263.A O no hydrogen 3.330 N/A ARG 267.A NH1 PHE 424.A O no hydrogen 2.948 N/A TYR 269.A N ASP 265.A O no hydrogen 3.336 N/A ALA 270.A N MET 266.A O no hydrogen 2.745 N/A ALA 271.A N ARG 267.A O no hydrogen 2.865 N/A GLU 272.A N PHE 268.A O no hydrogen 3.248 N/A ILE 273.A N TYR 269.A O no hydrogen 2.919 N/A ILE 274.A N ALA 270.A O no hydrogen 2.863 N/A LEU 275.A N ALA 271.A O no hydrogen 3.296 N/A GLY 276.A N GLU 272.A O no hydrogen 3.119 N/A LEU 277.A N ILE 273.A O no hydrogen 2.875 N/A GLU 278.A N ILE 274.A O no hydrogen 2.827 N/A HIS 279.A N LEU 275.A O no hydrogen 3.295 N/A HIS 279.A NE2 VAL 218.A O no hydrogen 3.026 N/A MET 280.A N GLY 276.A O no hydrogen 3.178 N/A HIS 281.A N LEU 277.A O no hydrogen 3.002 N/A HIS 281.A NE2 ASP 345.A OD1 no hydrogen 2.709 N/A ASN 282.A N GLU 278.A O no hydrogen 3.045 N/A ARG 283.A N MET 280.A O no hydrogen 3.006 N/A ARG 283.A NH1 HIS 279.A O no hydrogen 3.428 N/A PHE 284.A N HIS 281.A O no hydrogen 3.293 N/A VAL 285.A N MET 280.A O no hydrogen 3.007 N/A VAL 286.A N CYS 312.A O no hydrogen 2.951 N/A TYR 287.A N ASP 345.A OD1 no hydrogen 2.871 N/A TYR 287.A OH ASP 307.A O no hydrogen 2.447 N/A ARG 288.A N ASP 345.A OD2 no hydrogen 2.799 N/A ARG 288.A NE LEU 310.A O no hydrogen 2.880 N/A ARG 288.A NH1 TYR 340.A OH no hydrogen 2.917 N/A ARG 288.A NH2 LEU 310.A O no hydrogen 3.079 N/A LYS 291.A NZ THR 325.A OG1 no hydrogen 3.298 N/A ASN 294.A N LYS 291.A O no hydrogen 3.083 N/A ASN 294.A ND2 ASP 289.A O no hydrogen 2.708 N/A ASN 294.A ND2 ASP 289.A OD2 no hydrogen 2.866 N/A ILE 295.A N PRO 292.A O no hydrogen 3.114 N/A LEU 296.A N ARG 304.A O no hydrogen 2.777 N/A LEU 297.A N GLY 249.A O no hydrogen 2.972 N/A ASP 298.A N HIS 302.A O no hydrogen 3.058 N/A GLY 301.A N ASP 298.A O no hydrogen 2.812 N/A HIS 302.A N ASP 298.A OD1 no hydrogen 2.703 N/A HIS 302.A ND1 GLU 272.A OE2 no hydrogen 2.928 N/A VAL 303.A N GLU 272.A OE1 no hydrogen 2.897 N/A ARG 304.A N LEU 296.A O no hydrogen 2.858 N/A ILE 305.A N PHE 225.A O no hydrogen 2.935 N/A SER 306.A N ASN 294.A O no hydrogen 2.886 N/A GLY 309.A N ASP 307.A OD1 no hydrogen 3.174 N/A ALA 311.A N LEU 308.A O no hydrogen 3.012 N/A CYS 312.A N VAL 286.A O no hydrogen 2.919 N/A PHE 314.A N PHE 284.A O no hydrogen 2.837 N/A SER 315.A N ASP 313.A OD1 no hydrogen 3.153 N/A SER 315.A OG ASP 313.A OD1 no hydrogen 2.704 N/A SER 315.A OG ASP 313.A OD2 no hydrogen 3.408 N/A LYS 318.A NZ ASP 341.A OD2 no hydrogen 3.251 N/A THR 325.A OG1 ASP 289.A OD1 no hydrogen 2.912 N/A HIS 326.A ND1 ASP 375.A OD1 no hydrogen 2.759 N/A TYR 328.A N THR 325.A O no hydrogen 3.329 N/A LEU 334.A N ALA 330.A O no hydrogen 3.098 N/A GLN 335.A N PRO 331.A O no hydrogen 3.109 N/A TYR 340.A N PRO 319.A O no hydrogen 3.094 N/A TYR 340.A OH ALA 321.A O no hydrogen 2.625 N/A SER 343.A N ASP 341.A OD1 no hydrogen 3.015 N/A SER 343.A OG GLU 332.A OE2 no hydrogen 2.626 N/A SER 343.A OG ASP 341.A OD1 no hydrogen 3.526 N/A ASP 345.A N SER 342.A O no hydrogen 3.129 N/A PHE 347.A N SER 343.A O no hydrogen 3.434 N/A SER 348.A N ALA 344.A O no hydrogen 2.999 N/A SER 348.A OG TYR 328.A O no hydrogen 2.468 N/A SER 348.A OG ALA 344.A O no hydrogen 3.186 N/A LEU 349.A N ASP 345.A O no hydrogen 2.624 N/A GLY 350.A N TRP 346.A O no hydrogen 3.344 N/A CYS 351.A N PHE 347.A O no hydrogen 2.977 N/A CYS 351.A SG GLY 327.A O no hydrogen 3.500 N/A CYS 351.A SG PHE 347.A O no hydrogen 3.696 N/A MET 352.A N SER 348.A O no hydrogen 2.575 N/A LEU 353.A N LEU 349.A O no hydrogen 2.843 N/A PHE 354.A N GLY 350.A O no hydrogen 3.246 N/A LYS 355.A N CYS 351.A O no hydrogen 3.136 N/A LEU 356.A N MET 352.A O no hydrogen 3.360 N/A LEU 357.A N LEU 353.A O no hydrogen 3.323 N/A ARG 358.A N PHE 354.A O no hydrogen 2.823 N/A ARG 358.A N LYS 355.A O no hydrogen 3.327 N/A GLY 359.A N LYS 355.A O no hydrogen 2.634 N/A HIS 360.A ND1 SER 361.A O no hydrogen 3.049 N/A ARG 364.A N SER 361.A O no hydrogen 3.182 N/A ARG 364.A NE LYS 367.A O no hydrogen 2.823 N/A ARG 364.A NH2 HIS 366.A ND1 no hydrogen 3.211 N/A GLU 373.A N ASP 370.A OD1 no hydrogen 3.135 N/A ASP 375.A N LYS 371.A O no hydrogen 2.823 N/A ARG 376.A N HIS 372.A O no hydrogen 2.730 N/A MET 377.A N GLU 373.A O no hydrogen 2.957 N/A THR 378.A N ILE 374.A O no hydrogen 2.955 N/A THR 378.A OG1 ILE 374.A O no hydrogen 2.866 N/A LEU 379.A N ASP 375.A O no hydrogen 3.087 N/A LEU 379.A N ARG 376.A O no hydrogen 3.187 N/A THR 380.A OG1 ARG 376.A O no hydrogen 2.663 N/A MET 381.A N MET 377.A O no hydrogen 2.898 N/A PHE 389.A N PRO 386.A O no hydrogen 3.131 N/A SER 390.A N GLU 263.A OE1 no hydrogen 3.283 N/A SER 390.A OG GLU 263.A OE2 no hydrogen 2.678 N/A SER 390.A OG GLU 392.A OE1 no hydrogen 3.527 N/A LEU 393.A N SER 390.A OG no hydrogen 2.919 N/A ARG 394.A N SER 390.A O no hydrogen 2.828 N/A ARG 394.A NH1 LEU 385.A O no hydrogen 3.260 N/A SER 395.A N PRO 391.A O no hydrogen 3.149 N/A SER 395.A OG PRO 391.A O no hydrogen 3.554 N/A SER 395.A OG GLU 392.A O no hydrogen 3.370 N/A LEU 396.A N GLU 392.A O no hydrogen 3.364 N/A LEU 397.A N LEU 393.A O no hydrogen 3.142 N/A GLU 398.A N ARG 394.A O no hydrogen 2.802 N/A GLY 399.A N SER 395.A O no hydrogen 2.787 N/A LEU 400.A N LEU 396.A O no hydrogen 2.920 N/A LEU 401.A N LEU 397.A O no hydrogen 2.813 N/A ARG 407.A N ASP 404.A O no hydrogen 3.348 N/A ARG 408.A N ASP 404.A O no hydrogen 3.336 N/A ARG 408.A NE GLN 402.A O no hydrogen 3.297 N/A ARG 408.A NH1 GLU 332.A OE1 no hydrogen 3.125 N/A ARG 408.A NH1 GLU 332.A OE2 no hydrogen 3.388 N/A ARG 408.A NH1 SER 343.A O no hydrogen 2.898 N/A ARG 408.A NH2 GLU 332.A OE1 no hydrogen 2.738 N/A ARG 408.A NH2 GLN 402.A O no hydrogen 3.306 N/A ARG 408.A NH2 ARG 403.A O no hydrogen 3.526 N/A LEU 409.A N GLY 399.A O no hydrogen 3.226 N/A GLY 410.A N GLU 418.A OE1 no hydrogen 3.117 N/A CYS 411.A N ARG 408.A O no hydrogen 3.361 N/A CYS 411.A SG LEU 409.A O no hydrogen 3.799 N/A ARG 414.A N GLU 418.A OE2 no hydrogen 2.642 N/A ARG 414.A NH2 GLU 421.A OE2 no hydrogen 3.241 N/A GLU 418.A N GLY 415.A O no hydrogen 3.041 N/A LYS 420.A N ALA 416.A O no hydrogen 2.929 N/A LYS 420.A NZ GLU 278.A OE2 no hydrogen 3.173 N/A GLU 421.A N GLN 417.A O no hydrogen 3.079 N/A SER 422.A N VAL 419.A O no hydrogen 2.807 N/A PHE 425.A N SER 422.A O no hydrogen 3.142 N/A ARG 426.A N PRO 423.A O no hydrogen 3.261 N/A LEU 428.A N PHE 425.A O no hydrogen 3.038 N/A ASP 429.A N TYR 438.A OH no hydrogen 2.793 N/A GLN 431.A N ASP 429.A OD2 no hydrogen 3.107 N/A MET 432.A N ASP 429.A O no hydrogen 2.956 N/A VAL 433.A N ASP 429.A O no hydrogen 3.161 N/A PHE 434.A N TRP 430.A O no hydrogen 3.113 N/A LEU 435.A N GLN 431.A O no hydrogen 3.021 N/A GLN 436.A N VAL 433.A O no hydrogen 3.072 N/A LYS 437.A N MET 432.A O no hydrogen 2.890 N/A LYS 437.A NZ GLU 68.A OE2 no hydrogen 3.063 N/A GLN 454.A NE2 PRO 236.A O no hydrogen 3.630 N/A LEU 456.A N ASP 453.A O no hydrogen 3.082 N/A TYR 457.A N GLN 454.A O no hydrogen 2.734 N/A LEU 462.A N ALA 232.A O no hydrogen 2.909 N/A ILE 464.A N SER 230.A O no hydrogen 3.335 N/A SER 465.A OG GLU 153.A OE2 no hydrogen 2.634 N/A ARG 467.A NE SER 219.A O no hydrogen 3.392 N/A TRP 468.A N ILE 464.A O no hydrogen 2.956 N/A GLN 469.A N SER 465.A O no hydrogen 2.889 N/A GLN 469.A NE2 GLN 33.A OE1 no hydrogen 3.128 N/A GLN 469.A NE2 GLU 153.A OE1 no hydrogen 3.236 N/A GLN 470.A N GLU 466.A O no hydrogen 3.410 N/A GLN 470.A NE2 GLU 474.A OE2 no hydrogen 3.485 N/A GLU 471.A N ARG 467.A O no hydrogen 3.196 N/A VAL 472.A N TRP 468.A O no hydrogen 3.078 N/A ALA 473.A N GLN 469.A O no hydrogen 2.945 N/A GLU 474.A N GLN 470.A O no hydrogen 2.947 N/A THR 475.A N VAL 472.A O no hydrogen 3.093 N/A THR 475.A OG1 GLU 471.A O no hydrogen 2.854 N/A PHE 477.A N VAL 472.A O no hydrogen 3.112 N/A THR 479.A OG1 VAL 476.A O no hydrogen 2.837 N/A ILE 480.A N VAL 476.A O no hydrogen 2.953 N/A ASN 481.A N PHE 477.A O no hydrogen 3.020 N/A ALA 482.A N ASP 478.A O no hydrogen 2.977 N/A GLU 483.A N THR 479.A O no hydrogen 2.964 N/A THR 484.A N ILE 480.A O no hydrogen 2.817 N/A THR 484.A OG1 ILE 480.A O no hydrogen 2.625 N/A ASP 485.A N ASN 481.A O no hydrogen 2.990 N/A ARG 486.A N ALA 482.A O no hydrogen 3.170 N/A LEU 487.A N GLU 483.A O no hydrogen 2.793 N/A ALA 489.A N ASP 485.A O no hydrogen 2.943 N/A ARG 490.A N ARG 486.A O no hydrogen 3.402 N/A ARG 490.A N LEU 487.A O no hydrogen 3.256 N/A LYS 491.A N LEU 487.A O no hydrogen 3.123 N/A LYS 491.A NZ GLU 8.A OE1 no hydrogen 3.144 N/A LYS 491.A NZ GLU 8.A OE2 no hydrogen 3.184 N/A LYS 492.A N GLU 488.A O no hydrogen 3.006 N/A THR 493.A N ALA 489.A O no hydrogen 3.161 N/A THR 493.A OG1 ALA 489.A O no hydrogen 3.045 N/A LYS 494.A N ARG 490.A O no hydrogen 2.769 N/A ASN 495.A N LYS 491.A O no hydrogen 2.976 N/A ASN 495.A ND2 LYS 491.A O no hydrogen 2.634 N/A LYS 496.A N LYS 492.A O no hydrogen 2.837 N/A LEU 498.A N LYS 494.A O no hydrogen 2.957 N/A TYR 504.A N GLU 501.A OE1 no hydrogen 3.470 N/A TYR 504.A OH GLU 534.A OE1 no hydrogen 2.671 N/A LEU 506.A N ASP 503.A O no hydrogen 3.220 N/A LYS 508.A NZ TYR 504.A O no hydrogen 2.611 N/A CYS 510.A SG MET 512.A O no hydrogen 3.373 N/A CYS 510.A SG LEU 528.A O no hydrogen 3.493 N/A ILE 511.A N LEU 528.A O no hydrogen 2.931 N/A HIS 513.A N SER 13.A OG no hydrogen 2.953 N/A HIS 513.A ND1 TYR 525.A OH no hydrogen 2.761 N/A GLY 514.A N PHE 526.A O no hydrogen 3.028 N/A TYR 515.A OH GLU 538.A OE2 no hydrogen 3.065 N/A MET 516.A N ARG 524.A O no hydrogen 3.083 N/A SER 517.A N GLN 578.A O no hydrogen 3.062 N/A LYS 518.A N GLN 522.A O no hydrogen 3.014 N/A LYS 518.A NZ GLN 522.A OE1 no hydrogen 3.265 N/A ARG 523.A NH2 ASP 580.A OD1 no hydrogen 3.298 N/A ARG 523.A NH2 ASP 580.A OD2 no hydrogen 3.348 N/A ARG 524.A N MET 516.A O no hydrogen 2.970 N/A TYR 525.A N ARG 536.A O no hydrogen 3.010 N/A TYR 525.A OH HIS 513.A ND1 no hydrogen 2.761 N/A PHE 526.A N GLY 514.A O no hydrogen 2.917 N/A TYR 527.A N GLU 534.A O no hydrogen 2.969 N/A LEU 528.A N MET 512.A O no hydrogen 2.913 N/A PHE 529.A N ARG 532.A O no hydrogen 2.790 N/A ARG 532.A N PHE 529.A O no hydrogen 3.302 N/A ARG 532.A NE GLU 534.A OE2 no hydrogen 2.956 N/A ARG 532.A NH1 ASN 531.A OD1 no hydrogen 2.861 N/A ARG 532.A NH2 GLU 534.A OE2 no hydrogen 3.154 N/A LEU 533.A N LEU 546.A O no hydrogen 2.655 N/A GLU 534.A N TYR 527.A O no hydrogen 2.894 N/A TRP 535.A N SER 544.A O no hydrogen 3.430 N/A ARG 536.A N TYR 525.A O no hydrogen 2.986 N/A ARG 536.A NE TYR 527.A OH no hydrogen 3.206 N/A ARG 536.A NH1 GLY 537.A O no hydrogen 3.253 N/A ARG 536.A NH2 TYR 527.A OH no hydrogen 3.431 N/A GLN 543.A NE2 PRO 542.A O no hydrogen 2.921 N/A LEU 546.A N LEU 533.A O no hydrogen 3.221 N/A THR 547.A N GLU 550.A OE1 no hydrogen 2.934 N/A THR 547.A OG1 GLU 550.A OE1 no hydrogen 3.105 N/A MET 548.A N ASN 531.A O no hydrogen 3.182 N/A GLU 550.A N THR 547.A O no hydrogen 3.083 N/A GLU 550.A N THR 547.A OG1 no hydrogen 3.190 N/A GLN 552.A N LYS 568.A O no hydrogen 2.700 N/A SER 553.A N LYS 568.A O no hydrogen 3.437 N/A GLU 555.A N LEU 566.A O no hydrogen 2.942 N/A GLU 556.A N GLU 556.A OE1 no hydrogen 2.680 N/A THR 557.A N CYS 564.A O no hydrogen 2.793 N/A ILE 559.A N ARG 562.A O no hydrogen 2.892 N/A ARG 562.A N ILE 559.A O no hydrogen 2.656 N/A ARG 562.A NH2 CYS 579.A O no hydrogen 2.629 N/A CYS 564.A N THR 557.A O no hydrogen 3.096 N/A LEU 565.A N LEU 577.A O no hydrogen 2.871 N/A LEU 566.A N GLU 555.A O no hydrogen 2.632 N/A LEU 567.A N PHE 575.A O no hydrogen 2.728 N/A LYS 568.A N SER 553.A O no hydrogen 2.974 N/A ILE 569.A N LYS 573.A O no hydrogen 2.531 N/A ARG 570.A N GLU 550.A O no hydrogen 2.606 N/A LYS 573.A N ILE 569.A O no hydrogen 2.994 N/A PHE 575.A N LEU 567.A O no hydrogen 2.916 N/A LEU 577.A N LEU 565.A O no hydrogen 2.943 N/A GLN 578.A N SER 517.A O no hydrogen 2.824 N/A SER 581.A OG GLU 584.A OE1 no hydrogen 2.560 N/A ASP 582.A N ASN 155.A OD1 no hydrogen 3.112 N/A GLU 584.A N SER 581.A OG no hydrogen 3.354 N/A LEU 585.A N SER 581.A O no hydrogen 2.963 N/A VAL 586.A N ASP 582.A O no hydrogen 2.982 N/A GLN 587.A N PRO 583.A O no hydrogen 2.901 N/A GLN 587.A N GLU 584.A O no hydrogen 2.991 N/A GLN 587.A NE2 ASP 21.A OD2 no hydrogen 3.168 N/A GLN 587.A NE2 GLU 591.A OE2 no hydrogen 3.069 N/A TRP 588.A N GLU 584.A O no hydrogen 2.888 N/A LYS 589.A N LEU 585.A O no hydrogen 3.167 N/A LYS 590.A N VAL 586.A O no hydrogen 3.292 N/A LYS 590.A NZ ASP 21.A OD2 no hydrogen 2.992 N/A GLU 591.A N GLN 587.A O no hydrogen 2.941 N/A LEU 592.A N TRP 588.A O no hydrogen 2.724 N/A ARG 593.A N LYS 589.A O no hydrogen 2.981 N/A ASP 594.A N LYS 590.A O no hydrogen 2.784 N/A ALA 595.A N GLU 591.A O no hydrogen 2.851 N/A TYR 596.A N LEU 592.A O no hydrogen 2.985 N/A ARG 597.A N ARG 593.A O no hydrogen 3.310 N/A ARG 597.A NE TYR 596.A OH no hydrogen 3.400 N/A GLU 598.A N ASP 594.A O no hydrogen 3.136 N/A ALA 599.A N ALA 595.A O no hydrogen 2.765 N/A GLN 600.A N TYR 596.A O no hydrogen 2.855 N/A GLN 600.A NE2 MET 548.A O no hydrogen 2.739 N/A GLN 600.A NE2 ILE 551.A O no hydrogen 2.768 N/A GLN 601.A N ARG 597.A O no hydrogen 3.218 N/A LEU 602.A N GLU 598.A O no hydrogen 3.071 N/A VAL 603.A N ALA 599.A O no hydrogen 2.992 N/A ARG 605.A N LEU 602.A O no hydrogen 2.729 N/A VAL 606.A N VAL 603.A O no hydrogen 2.990 N/A MET 609.A N VAL 606.A O no hydrogen 3.210 N/A LYS 610.A N VAL 606.A O no hydrogen 3.118 N/A LYS 610.A NZ GLN 604.A O no hydrogen 3.278 N/A