Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pyd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N VAL 167.A O no hydrogen 2.777 N/A LEU 5.A N LEU 165.A O no hydrogen 2.889 N/A GLY 6.A N VAL 163.A O no hydrogen 3.080 N/A LYS 7.A N THR 4.A OG1 no hydrogen 3.170 N/A LYS 7.A NZ GLU 38.A O no hydrogen 3.349 N/A TYR 8.A N THR 4.A O no hydrogen 3.003 N/A TYR 8.A OH ASP 141.A OD1 no hydrogen 2.911 N/A LEU 9.A N LEU 5.A O no hydrogen 3.145 N/A GLU 11.A N LYS 7.A O no hydrogen 2.981 N/A ARG 12.A N TYR 8.A O no hydrogen 2.970 N/A ARG 12.A NE ASP 141.A OD1 no hydrogen 3.090 N/A ARG 12.A NH1 GLN 15.A OE1 no hydrogen 2.999 N/A ARG 12.A NH1 THR 174.A O no hydrogen 2.713 N/A ARG 12.A NH2 ASP 141.A OD1 no hydrogen 3.453 N/A ARG 12.A NH2 ASP 141.A OD2 no hydrogen 3.068 N/A ARG 12.A NH2 THR 174.A O no hydrogen 3.020 N/A LEU 13.A N LEU 9.A O no hydrogen 2.877 N/A LYS 14.A N PHE 10.A O no hydrogen 3.019 N/A LYS 14.A NZ GLU 40.A O no hydrogen 3.150 N/A GLN 15.A N GLU 11.A O no hydrogen 3.019 N/A GLN 15.A NE2 LEU 172.A O no hydrogen 2.960 N/A VAL 16.A N ARG 12.A O no hydrogen 2.984 N/A VAL 16.A N LEU 13.A O no hydrogen 3.037 N/A ASN 17.A N LYS 14.A O no hydrogen 2.954 N/A VAL 18.A N LEU 13.A O no hydrogen 2.838 N/A ASN 19.A N TYR 60.A OH no hydrogen 2.811 N/A THR 20.A OG1 GLU 412.A OE2 no hydrogen 2.973 N/A VAL 21.A N ARG 43.A O no hydrogen 3.082 N/A PHE 22.A N CYS 68.A O no hydrogen 3.017 N/A GLY 23.A N ASN 47.A OD1 no hydrogen 3.157 N/A LEU 24.A N ILE 70.A O no hydrogen 3.146 N/A GLY 26.A N ASN 29.A OD1 no hydrogen 2.746 N/A PHE 28.A N THR 72.A OG1 no hydrogen 3.006 N/A ASN 29.A N GLY 26.A O no hydrogen 3.100 N/A ASN 29.A ND2 LEU 24.A O no hydrogen 2.892 N/A SER 31.A OG ASP 164.A OD2 no hydrogen 2.916 N/A LEU 33.A N ASN 29.A O no hydrogen 3.091 N/A ASP 34.A N LEU 30.A O no hydrogen 3.208 N/A LYS 35.A NZ SER 31.A O no hydrogen 2.549 N/A LYS 35.A NZ SER 31.A OG no hydrogen 3.356 N/A LYS 35.A NZ ASP 164.A OD1 no hydrogen 3.089 N/A ILE 36.A N LEU 33.A O no hydrogen 2.958 N/A GLU 38.A N LYS 35.A O no hydrogen 3.045 N/A ARG 43.A N ASN 19.A O no hydrogen 2.927 N/A ARG 43.A NH1 GLU 411.A OE1 no hydrogen 2.675 N/A ARG 43.A NH2 GLU 411.A OE1 no hydrogen 2.921 N/A ARG 43.A NH2 GLU 412.A OE2 no hydrogen 3.006 N/A ALA 45.A N VAL 21.A O no hydrogen 3.038 N/A ASN 47.A ND2 GLU 434.A OE2 no hydrogen 2.928 N/A ALA 48.A N GLU 434.A OE1 no hydrogen 3.202 N/A ALA 48.A N GLU 434.A OE2 no hydrogen 3.349 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.844 N/A ASN 52.A N ASN 49.A OD1 no hydrogen 2.956 N/A ASN 52.A ND2 THR 431.A O no hydrogen 3.502 N/A ASN 52.A ND2 GLN 433.A OE1 no hydrogen 3.495 N/A ASN 52.A ND2 GLU 434.A OE1 no hydrogen 3.146 N/A ALA 53.A N ASN 49.A O no hydrogen 2.871 N/A ALA 54.A N GLU 50.A O no hydrogen 2.860 N/A TYR 55.A N LEU 51.A O no hydrogen 3.028 N/A TYR 55.A OH ASN 82.A OD1 no hydrogen 2.807 N/A TYR 55.A OH SER 395.A OG no hydrogen 2.772 N/A ALA 56.A N ASN 52.A O no hydrogen 3.263 N/A ALA 57.A N ALA 53.A O no hydrogen 3.209 N/A ASP 58.A N ALA 54.A O no hydrogen 3.173 N/A GLY 59.A N TYR 55.A O no hydrogen 3.051 N/A TYR 60.A N ALA 56.A O no hydrogen 2.744 N/A TYR 60.A OH GLU 412.A OE1 no hydrogen 2.753 N/A ALA 61.A N ALA 57.A O no hydrogen 2.759 N/A ARG 62.A N ASP 58.A O no hydrogen 2.944 N/A ARG 62.A NE ASP 58.A OD1 no hydrogen 2.609 N/A ARG 62.A NH2 GLU 90.A OE1 no hydrogen 3.041 N/A ILE 63.A N GLY 59.A O no hydrogen 3.231 N/A ILE 63.A N TYR 60.A O no hydrogen 3.136 N/A LYS 64.A N TYR 60.A O no hydrogen 2.681 N/A LYS 64.A NZ ASN 17.A O no hydrogen 2.932 N/A LYS 64.A NZ GLU 412.A OE1 no hydrogen 3.031 N/A GLY 65.A N ALA 61.A O no hydrogen 2.793 N/A SER 67.A N GLY 93.A O no hydrogen 3.389 N/A SER 67.A OG ALA 57.A O no hydrogen 2.450 N/A CYS 68.A SG LEU 95.A O no hydrogen 3.730 N/A ILE 69.A N LEU 95.A O no hydrogen 2.882 N/A ILE 70.A N PHE 22.A O no hydrogen 2.799 N/A THR 71.A N VAL 97.A O no hydrogen 2.844 N/A THR 71.A OG1 HIS 96.A NE2 no hydrogen 2.628 N/A PHE 73.A N GLY 99.A O no hydrogen 3.056 N/A GLY 74.A N GLU 77.A OE2 no hydrogen 2.936 N/A VAL 75.A N PHE 73.A O no hydrogen 2.877 N/A GLY 76.A N THR 72.A O no hydrogen 2.904 N/A GLU 77.A N THR 72.A O no hydrogen 3.251 N/A LEU 78.A N GLY 74.A O no hydrogen 2.980 N/A SER 79.A OG VAL 75.A O no hydrogen 2.652 N/A ALA 80.A N GLU 77.A O no hydrogen 3.218 N/A GLY 83.A N ALA 80.A O no hydrogen 2.759 N/A ILE 84.A N ALA 80.A O no hydrogen 3.494 N/A ALA 85.A N LEU 81.A O no hydrogen 2.896 N/A GLY 86.A N ASN 82.A O no hydrogen 3.437 N/A SER 87.A N GLY 83.A O no hydrogen 3.106 N/A SER 87.A OG ASP 58.A OD2 no hydrogen 3.018 N/A SER 87.A OG GLY 83.A O no hydrogen 2.923 N/A TYR 88.A N ILE 84.A O no hydrogen 3.079 N/A ALA 89.A N ALA 85.A O no hydrogen 2.884 N/A GLU 90.A N GLY 86.A O no hydrogen 3.105 N/A VAL 92.A N SER 87.A O no hydrogen 2.839 N/A GLY 93.A N GLN 151.A OE1 no hydrogen 2.901 N/A LEU 95.A N SER 67.A O no hydrogen 2.914 N/A HIS 96.A N VAL 154.A O no hydrogen 3.049 N/A HIS 96.A NE2 THR 71.A OG1 no hydrogen 2.628 N/A VAL 97.A N ILE 69.A O no hydrogen 2.949 N/A VAL 98.A N LEU 156.A O no hydrogen 2.994 N/A GLY 99.A N THR 71.A O no hydrogen 3.012 N/A VAL 100.A N LEU 158.A O no hydrogen 3.263 N/A ILE 103.A N PRO 101.A O no hydrogen 2.539 N/A HIS 106.A NE2 ASP 27.A OD2 no hydrogen 2.777 N/A THR 114.A N ASP 112.A OD1 no hydrogen 3.111 N/A THR 114.A OG1 ASP 112.A OD1 no hydrogen 2.932 N/A ARG 118.A N THR 114.A O no hydrogen 2.873 N/A ARG 118.A NH1 ASP 112.A OD2 no hydrogen 3.319 N/A MET 119.A N VAL 115.A O no hydrogen 2.943 N/A SER 120.A N PHE 116.A O no hydrogen 3.081 N/A ALA 121.A N HIS 117.A O no hydrogen 3.223 N/A ASN 122.A ND2 MET 119.A O no hydrogen 3.180 N/A ILE 123.A N SER 120.A O no hydrogen 2.925 N/A SER 124.A OG SER 120.A O no hydrogen 2.477 N/A GLU 125.A N PRO 153.A O no hydrogen 2.941 N/A ALA 128.A N TYR 155.A O no hydrogen 2.797 N/A ILE 130.A N GLY 157.A O no hydrogen 2.956 N/A ALA 134.A N ASP 132.A OD1 no hydrogen 3.350 N/A ALA 136.A N ASP 132.A O no hydrogen 3.142 N/A ALA 136.A N ILE 133.A O no hydrogen 3.071 N/A GLU 139.A N THR 135.A O no hydrogen 3.231 N/A ILE 140.A N ALA 136.A O no hydrogen 3.030 N/A ASP 141.A N PRO 137.A O no hydrogen 2.827 N/A ARG 142.A N ALA 138.A O no hydrogen 2.707 N/A ARG 142.A NH1 GLU 139.A OE1 no hydrogen 2.778 N/A ARG 142.A NH2 THR 127.A O no hydrogen 3.274 N/A CYS 143.A N GLU 139.A O no hydrogen 2.990 N/A CYS 143.A SG GLU 139.A O no hydrogen 3.220 N/A ILE 144.A N ILE 140.A O no hydrogen 3.093 N/A ARG 145.A N ASP 141.A O no hydrogen 2.995 N/A ARG 145.A NH1 ASP 177.A O no hydrogen 2.913 N/A ARG 145.A NH1 SER 179.A O no hydrogen 3.230 N/A THR 146.A N ARG 142.A O no hydrogen 3.172 N/A THR 146.A OG1 ARG 142.A O no hydrogen 2.939 N/A THR 147.A N CYS 143.A O no hydrogen 3.155 N/A THR 147.A OG1 CYS 143.A O no hydrogen 2.844 N/A TYR 148.A N ILE 144.A O no hydrogen 3.096 N/A VAL 149.A N ARG 145.A O no hydrogen 2.706 N/A THR 150.A N THR 146.A O no hydrogen 2.789 N/A THR 150.A OG1 THR 146.A O no hydrogen 2.726 N/A GLN 151.A N THR 147.A O no hydrogen 2.900 N/A GLN 151.A NE2 GLY 65.A O no hydrogen 2.801 N/A GLN 151.A NE2 TYR 148.A O no hydrogen 3.052 N/A ARG 152.A NE TYR 88.A O no hydrogen 3.442 N/A ARG 152.A NH2 TYR 88.A O no hydrogen 3.197 N/A VAL 154.A N VAL 94.A O no hydrogen 3.296 N/A TYR 155.A N THR 126.A O no hydrogen 3.265 N/A TYR 155.A OH GLU 77.A OE1 no hydrogen 2.452 N/A LEU 156.A N HIS 96.A O no hydrogen 2.982 N/A GLY 157.A N ALA 128.A O no hydrogen 2.936 N/A LEU 158.A N VAL 98.A O no hydrogen 2.984 N/A ALA 160.A N VAL 100.A O no hydrogen 3.001 N/A LEU 165.A N LEU 162.A O no hydrogen 3.373 N/A VAL 167.A N ILE 3.A O no hydrogen 2.509 N/A ALA 169.A N SER 1.A O no hydrogen 3.396 N/A LEU 171.A N PRO 168.A O no hydrogen 3.276 N/A LEU 172.A N ALA 169.A O no hydrogen 3.259 N/A GLN 173.A N LYS 170.A O no hydrogen 2.936 N/A SER 179.A N ASP 177.A OD2 no hydrogen 3.110 N/A SER 179.A OG ASP 177.A OD1 no hydrogen 3.400 N/A SER 179.A OG ASP 177.A OD2 no hydrogen 3.081 N/A ASN 183.A ND2 GLU 188.A OE1 no hydrogen 3.066 N/A ASN 183.A ND2 GLN 306.A O no hydrogen 3.341 N/A SER 187.A N ASP 184.A OD2 no hydrogen 3.199 N/A SER 187.A OG ASP 184.A OD2 no hydrogen 2.606 N/A GLU 188.A N ASP 184.A O no hydrogen 2.986 N/A LYS 189.A N ALA 185.A O no hydrogen 2.986 N/A GLU 190.A N GLU 186.A O no hydrogen 3.136 N/A VAL 191.A N SER 187.A O no hydrogen 3.101 N/A ILE 192.A N GLU 188.A O no hydrogen 3.070 N/A ASP 193.A N LYS 189.A O no hydrogen 2.827 N/A THR 194.A N GLU 190.A O no hydrogen 3.116 N/A THR 194.A OG1 GLU 190.A O no hydrogen 2.822 N/A ILE 195.A N VAL 191.A O no hydrogen 2.984 N/A LEU 196.A N ILE 192.A O no hydrogen 3.176 N/A ALA 197.A N ASP 193.A O no hydrogen 3.028 N/A LEU 198.A N THR 194.A O no hydrogen 3.122 N/A VAL 199.A N ILE 195.A O no hydrogen 2.773 N/A LYS 200.A N LEU 196.A O no hydrogen 2.901 N/A ASP 201.A N LEU 198.A O no hydrogen 3.148 N/A ALA 202.A N VAL 199.A O no hydrogen 3.120 N/A LYS 203.A N ASP 271.A OD2 no hydrogen 3.104 N/A ASN 204.A N ASP 271.A OD1 no hydrogen 2.651 N/A VAL 206.A N LEU 272.A O no hydrogen 2.806 N/A ILE 207.A N PRO 232.A O no hydrogen 2.903 N/A LEU 208.A N LEU 274.A O no hydrogen 2.948 N/A ALA 209.A N PHE 234.A O no hydrogen 2.762 N/A ASP 210.A N VAL 276.A O no hydrogen 2.753 N/A ALA 211.A N ASP 210.A OD1 no hydrogen 2.962 N/A CYS 212.A N GLY 277.A O no hydrogen 3.199 N/A CYS 212.A SG HIS 216.A ND1 no hydrogen 3.439 N/A CYS 213.A N ASP 210.A O no hydrogen 2.744 N/A CYS 213.A SG THR 222.A OG1 no hydrogen 3.555 N/A SER 214.A OG SER 242.A OG no hydrogen 2.978 N/A ARG 215.A NE GLU 90.A O no hydrogen 3.576 N/A ARG 215.A NE HIS 91.A O no hydrogen 2.972 N/A ARG 215.A NH2 GLU 90.A O no hydrogen 3.479 N/A HIS 216.A N CYS 212.A O no hydrogen 2.978 N/A ASP 217.A N SER 214.A O no hydrogen 3.415 N/A LYS 219.A N ASP 217.A O no hydrogen 2.560 N/A THR 222.A N VAL 218.A O no hydrogen 2.582 N/A THR 222.A OG1 VAL 218.A O no hydrogen 2.743 N/A LYS 223.A N LYS 219.A O no hydrogen 3.206 N/A LYS 224.A N ALA 220.A O no hydrogen 3.109 N/A LEU 225.A N GLU 221.A O no hydrogen 3.152 N/A ILE 226.A N THR 222.A O no hydrogen 3.320 N/A ASP 227.A N LYS 223.A O no hydrogen 3.293 N/A LEU 228.A N LYS 224.A O no hydrogen 3.095 N/A THR 229.A N LEU 225.A O no hydrogen 3.292 N/A THR 229.A OG1 LEU 225.A O no hydrogen 2.739 N/A THR 229.A OG1 ILE 226.A O no hydrogen 3.366 N/A GLN 230.A N ILE 226.A O no hydrogen 2.738 N/A GLN 230.A NE2 ASP 227.A O no hydrogen 2.836 N/A PHE 231.A N THR 229.A OG1 no hydrogen 3.305 N/A ALA 233.A N ARG 249.A O no hydrogen 2.829 N/A PHE 234.A N ILE 207.A O no hydrogen 2.868 N/A VAL 235.A N GLY 252.A O no hydrogen 3.004 N/A THR 236.A OG1 ASP 210.A OD1 no hydrogen 3.184 N/A GLY 239.A N THR 236.A O no hydrogen 2.938 N/A GLY 239.A N THR 236.A OG1 no hydrogen 3.307 N/A LYS 240.A N PRO 237.A O no hydrogen 3.408 N/A LYS 240.A NZ GLU 245.A OE2 no hydrogen 2.793 N/A LYS 240.A NZ THR 379.A O no hydrogen 2.513 N/A SER 242.A N GLY 239.A O no hydrogen 2.845 N/A SER 242.A OG SER 214.A OG no hydrogen 2.978 N/A GLN 246.A N ASN 383.A OD1 no hydrogen 3.100 N/A HIS 247.A N SER 244.A O no hydrogen 3.423 N/A HIS 247.A NE2 ASP 227.A OD1 no hydrogen 3.102 N/A ARG 249.A N HIS 247.A ND1 no hydrogen 3.293 N/A ARG 249.A NE GLN 230.A O no hydrogen 2.847 N/A ARG 249.A NH1 VAL 328.A O no hydrogen 2.712 N/A ARG 249.A NH2 GLN 230.A O no hydrogen 2.870 N/A ARG 249.A NH2 VAL 328.A O no hydrogen 2.696 N/A TYR 250.A N HIS 247.A O no hydrogen 2.931 N/A GLY 251.A N ALA 233.A O no hydrogen 2.725 N/A TYR 254.A N VAL 235.A O no hydrogen 2.632 N/A TYR 254.A OH GLU 268.A OE2 no hydrogen 3.181 N/A VAL 255.A N SER 259.A OG no hydrogen 3.041 N/A SER 259.A N GLY 256.A O no hydrogen 3.226 N/A SER 259.A OG GLY 256.A O no hydrogen 2.777 N/A LYS 260.A NZ ASN 377.A O no hydrogen 3.152 N/A VAL 263.A N LYS 260.A O no hydrogen 2.698 N/A LYS 264.A N LYS 260.A O no hydrogen 3.013 N/A GLU 265.A N PRO 261.A O no hydrogen 3.248 N/A ALA 266.A N GLU 262.A O no hydrogen 3.198 N/A VAL 267.A N VAL 263.A O no hydrogen 3.176 N/A GLU 268.A N LYS 264.A O no hydrogen 3.068 N/A SER 269.A N GLU 265.A O no hydrogen 2.851 N/A SER 269.A OG GLU 265.A O no hydrogen 2.724 N/A SER 269.A OG ALA 266.A O no hydrogen 2.994 N/A ALA 270.A N VAL 267.A O no hydrogen 3.292 N/A ASP 271.A N ASN 204.A O no hydrogen 2.984 N/A ILE 273.A N ASN 286.A O no hydrogen 2.706 N/A LEU 274.A N VAL 206.A O no hydrogen 2.655 N/A SER 275.A N VAL 288.A O no hydrogen 2.762 N/A VAL 276.A N LEU 208.A O no hydrogen 2.896 N/A GLY 277.A N PHE 290.A O no hydrogen 2.975 N/A LYS 283.A NZ GLU 268.A O no hydrogen 3.325 N/A ASN 286.A ND2 ASP 271.A O no hydrogen 2.669 N/A VAL 288.A N ILE 273.A O no hydrogen 2.881 N/A GLU 289.A N LYS 296.A O no hydrogen 2.804 N/A PHE 290.A N SER 275.A O no hydrogen 2.618 N/A HIS 291.A N HIS 294.A O no hydrogen 2.875 N/A HIS 291.A NE2 GLU 289.A OE1 no hydrogen 2.642 N/A HIS 294.A N HIS 291.A O no hydrogen 3.241 N/A HIS 294.A ND1 ASP 293.A OD1 no hydrogen 3.107 N/A MET 295.A N PHE 302.A O no hydrogen 3.013 N/A LYS 296.A N GLU 289.A O no hydrogen 3.289 N/A ILE 297.A N ALA 300.A O no hydrogen 2.809 N/A ARG 298.A N ILE 287.A O no hydrogen 2.984 N/A ALA 300.A N ILE 297.A O no hydrogen 2.952 N/A PHE 302.A N MET 295.A O no hydrogen 2.912 N/A GLY 304.A N ASP 293.A O no hydrogen 3.134 N/A GLN 306.A N ASN 183.A OD1 no hydrogen 2.984 N/A GLN 306.A NE2 LYS 181.A O no hydrogen 2.580 N/A GLN 306.A NE2 ASN 183.A OD1 no hydrogen 3.103 N/A MET 307.A N HIS 291.A O no hydrogen 3.245 N/A LYS 308.A NZ ASP 217.A OD2 no hydrogen 2.707 N/A LYS 308.A NZ GLU 221.A OE1 no hydrogen 3.462 N/A LYS 308.A NZ GLU 221.A OE2 no hydrogen 2.953 N/A LEU 311.A N MET 307.A O no hydrogen 2.863 N/A GLN 312.A N LYS 308.A O no hydrogen 2.971 N/A LYS 313.A N PHE 309.A O no hydrogen 2.993 N/A LYS 313.A NZ GLU 188.A OE2 no hydrogen 3.036 N/A LEU 314.A N VAL 310.A O no hydrogen 2.852 N/A LEU 315.A N LEU 311.A O no hydrogen 3.404 N/A THR 316.A N LYS 313.A O no hydrogen 3.066 N/A THR 316.A OG1 LYS 313.A O no hydrogen 3.513 N/A ASN 317.A N LEU 314.A O no hydrogen 3.076 N/A ASN 317.A ND2 LYS 313.A O no hydrogen 3.349 N/A ILE 318.A N LEU 314.A O no hydrogen 2.875 N/A ALA 321.A N ASN 317.A O no hydrogen 3.225 N/A ALA 322.A N ILE 318.A O no hydrogen 3.007 N/A LYS 323.A N ASP 320.A O no hydrogen 3.167 N/A TYR 325.A N ALA 322.A O no hydrogen 2.751 N/A VAL 328.A N TYR 325.A OH no hydrogen 3.371 N/A ARG 333.A NE PRO 331.A O no hydrogen 3.428 N/A ASN 337.A ND2 TRP 350.A O no hydrogen 2.838 N/A ASN 337.A ND2 GLN 354.A OE1 no hydrogen 2.825 N/A THR 344.A N PRO 341.A O no hydrogen 3.044 N/A THR 344.A OG1 PRO 341.A O no hydrogen 2.888 N/A LEU 346.A N ALA 494.A O no hydrogen 2.801 N/A GLN 348.A N ASP 525.A OD2 no hydrogen 2.973 N/A GLN 348.A NE2 THR 371.A OG1 no hydrogen 3.136 N/A MET 351.A N LYS 347.A O no hydrogen 3.120 N/A TRP 352.A N GLN 348.A O no hydrogen 2.799 N/A TRP 352.A NE1 GLN 348.A OE1 no hydrogen 2.975 N/A ASN 353.A N GLU 349.A O no hydrogen 3.496 N/A ASN 353.A ND2 PRO 335.A O no hydrogen 2.981 N/A GLN 354.A N TRP 350.A O no hydrogen 3.034 N/A GLN 354.A NE2 ASP 500.A OD1 no hydrogen 3.290 N/A LEU 355.A N MET 351.A O no hydrogen 2.864 N/A GLY 356.A N ASN 353.A O no hydrogen 3.321 N/A ASN 357.A N GLN 354.A O no hydrogen 3.236 N/A PHE 358.A N LEU 355.A O no hydrogen 2.752 N/A LEU 359.A N LEU 355.A O no hydrogen 3.290 N/A GLN 360.A N ASP 363.A OD2 no hydrogen 3.103 N/A GLY 362.A N ASN 384.A O no hydrogen 2.699 N/A ASP 363.A N GLN 360.A O no hydrogen 3.307 N/A VAL 364.A N ARG 418.A O no hydrogen 2.829 N/A VAL 365.A N TYR 386.A O no hydrogen 2.964 N/A ILE 366.A N ILE 420.A O no hydrogen 2.924 N/A ALA 367.A N ILE 388.A O no hydrogen 3.154 N/A GLU 368.A N PHE 422.A O no hydrogen 2.929 N/A THR 369.A N GLU 368.A OE2 no hydrogen 3.004 N/A SER 372.A OG PHE 422.A O no hydrogen 3.350 N/A GLY 375.A N THR 371.A O no hydrogen 2.935 N/A ILE 376.A N SER 372.A O no hydrogen 3.124 N/A ASN 377.A ND2 PHE 374.A O no hydrogen 3.542 N/A GLN 378.A N GLY 375.A O no hydrogen 3.004 N/A GLN 378.A NE2 ASN 529.A OD1 no hydrogen 2.880 N/A THR 379.A N ILE 376.A O no hydrogen 2.932 N/A THR 379.A OG1 TRP 352.A O no hydrogen 2.809 N/A THR 379.A OG1 ILE 376.A O no hydrogen 3.504 N/A PHE 381.A N GLU 245.A OE1 no hydrogen 3.215 N/A THR 385.A OG1 PRO 382.A O no hydrogen 3.032 N/A THR 385.A OG1 ASN 383.A O no hydrogen 3.436 N/A TYR 386.A N ASP 363.A O no hydrogen 3.021 N/A ILE 388.A N VAL 365.A O no hydrogen 2.860 N/A SER 389.A OG ALA 367.A O no hydrogen 3.393 N/A TRP 393.A N GLU 90.A OE2 no hydrogen 2.802 N/A GLY 394.A N GLN 390.A O no hydrogen 2.840 N/A SER 395.A N GLN 390.A OE1 no hydrogen 3.112 N/A SER 395.A OG TYR 55.A OH no hydrogen 2.772 N/A SER 395.A OG ASN 82.A OD1 no hydrogen 3.001 N/A PHE 398.A N SER 395.A O no hydrogen 3.070 N/A THR 399.A N GLU 368.A OE1 no hydrogen 3.094 N/A THR 399.A OG1 GLU 368.A OE1 no hydrogen 2.453 N/A THR 400.A N GLY 397.A O no hydrogen 3.238 N/A THR 400.A OG1 THR 431.A OG1 no hydrogen 2.911 N/A ALA 402.A N PHE 398.A O no hydrogen 2.984 N/A THR 403.A N THR 399.A O no hydrogen 2.856 N/A THR 403.A OG1 THR 399.A O no hydrogen 2.697 N/A GLY 405.A N GLY 401.A O no hydrogen 3.206 N/A ALA 406.A N ALA 402.A O no hydrogen 2.981 N/A ALA 407.A N THR 403.A O no hydrogen 2.912 N/A PHE 408.A N LEU 404.A O no hydrogen 2.974 N/A ALA 409.A N GLY 405.A O no hydrogen 3.123 N/A ALA 410.A N ALA 406.A O no hydrogen 2.820 N/A GLU 411.A N ALA 407.A O no hydrogen 2.880 N/A GLU 412.A N PHE 408.A O no hydrogen 3.154 N/A ILE 413.A N ALA 409.A O no hydrogen 3.036 N/A ASP 414.A N ALA 410.A O no hydrogen 2.613 N/A LYS 417.A N ASP 414.A O no hydrogen 2.675 N/A LYS 417.A NZ TYR 386.A OH no hydrogen 3.142 N/A ARG 418.A NE ASP 363.A OD1 no hydrogen 2.840 N/A ARG 418.A NH1 ASN 509.A O no hydrogen 2.758 N/A ARG 418.A NH1 ASN 509.A OD1 no hydrogen 3.198 N/A ARG 418.A NH2 PHE 358.A O no hydrogen 2.783 N/A ARG 418.A NH2 ASP 363.A OD2 no hydrogen 3.143 N/A ILE 420.A N VAL 364.A O no hydrogen 2.673 N/A LEU 421.A N TYR 446.A O no hydrogen 2.713 N/A PHE 422.A N ILE 366.A O no hydrogen 2.801 N/A ILE 423.A N PHE 448.A O no hydrogen 3.001 N/A ASP 425.A N LEU 450.A O no hydrogen 3.228 N/A SER 427.A N GLY 424.A O no hydrogen 3.257 N/A LEU 428.A N GLY 424.A O no hydrogen 2.940 N/A GLN 429.A NE2 GLN 472.A O no hydrogen 3.085 N/A LEU 430.A N SER 427.A O no hydrogen 3.299 N/A THR 431.A OG1 GLY 397.A O no hydrogen 2.723 N/A THR 431.A OG1 THR 400.A OG1 no hydrogen 2.911 N/A GLU 434.A N THR 431.A O no hydrogen 3.223 N/A ILE 435.A N VAL 432.A O no hydrogen 3.005 N/A SER 436.A N GLN 433.A O no hydrogen 3.005 N/A THR 437.A N GLU 434.A O no hydrogen 3.179 N/A THR 437.A OG1 GLU 434.A OE2 no hydrogen 2.615 N/A MET 438.A N ILE 435.A O no hydrogen 3.206 N/A ILE 439.A N ILE 435.A O no hydrogen 3.279 N/A ARG 440.A N SER 436.A O no hydrogen 3.160 N/A TRP 441.A N THR 437.A O no hydrogen 3.168 N/A TRP 441.A NE1 ALA 45.A O no hydrogen 2.913 N/A GLY 442.A N ILE 439.A O no hydrogen 3.087 N/A LEU 443.A N MET 438.A O no hydrogen 2.763 N/A LYS 444.A NZ GLY 442.A O no hydrogen 2.622 N/A TYR 446.A N VAL 419.A O no hydrogen 2.850 N/A TYR 446.A OH PHE 508.A O no hydrogen 2.718 N/A LEU 447.A N ARG 515.A O no hydrogen 2.978 N/A PHE 448.A N LEU 421.A O no hydrogen 2.981 N/A VAL 449.A N ILE 517.A O no hydrogen 2.980 N/A LEU 450.A N ILE 423.A O no hydrogen 3.062 N/A ASN 451.A N ILE 519.A O no hydrogen 2.637 N/A ASN 451.A ND2 GLU 518.A OE2 no hydrogen 2.634 N/A ASP 453.A N ASN 451.A OD1 no hydrogen 3.430 N/A GLY 454.A N ASP 425.A OD2 no hydrogen 3.300 N/A TYR 455.A N ASN 469.A O no hydrogen 3.205 N/A LYS 459.A N TYR 455.A O no hydrogen 3.207 N/A LYS 459.A NZ ASP 453.A O no hydrogen 2.795 N/A LYS 459.A NZ GLU 470.A OE1 no hydrogen 2.807 N/A LYS 459.A NZ GLU 470.A OE2 no hydrogen 3.514 N/A LEU 460.A N THR 456.A O no hydrogen 2.770 N/A ILE 461.A N GLU 458.A O no hydrogen 3.102 N/A HIS 462.A N GLU 458.A O no hydrogen 2.722 N/A HIS 462.A ND1 TYR 468.A OH no hydrogen 2.980 N/A ALA 466.A N GLY 463.A O no hydrogen 2.952 N/A TYR 468.A OH HIS 462.A ND1 no hydrogen 2.980 N/A ASN 469.A N ALA 466.A O no hydrogen 2.797 N/A ASN 469.A ND2 HIS 462.A O no hydrogen 2.962 N/A ASN 469.A ND2 GLY 463.A O no hydrogen 2.763 N/A GLU 470.A N GLN 467.A O no hydrogen 3.095 N/A HIS 476.A ND1 GLU 518.A OE2 no hydrogen 2.690 N/A SER 478.A N ASP 475.A O no hydrogen 3.255 N/A SER 478.A OG ASP 475.A OD2 no hydrogen 2.284 N/A LEU 479.A N HIS 476.A O no hydrogen 3.155 N/A THR 482.A N SER 478.A O no hydrogen 3.044 N/A THR 482.A OG1 SER 478.A O no hydrogen 2.733 N/A PHE 483.A N LEU 479.A O no hydrogen 3.175 N/A PHE 483.A N LEU 480.A O no hydrogen 3.217 N/A GLY 484.A N PRO 481.A O no hydrogen 3.216 N/A ALA 485.A N LEU 480.A O no hydrogen 3.205 N/A LYS 486.A NZ ILE 439.A O no hydrogen 3.348 N/A HIS 491.A NE2 GLU 489.A OE1 no hydrogen 2.432 N/A VAL 493.A N GLU 518.A O no hydrogen 3.071 N/A ALA 494.A N GLU 498.A OE1 no hydrogen 2.849 N/A THR 495.A OG1 ALA 342.A O no hydrogen 2.901 N/A THR 496.A N THR 344.A O no hydrogen 2.982 N/A GLY 497.A N ALA 342.A O no hydrogen 3.208 N/A GLU 498.A N THR 495.A OG1 no hydrogen 3.306 N/A TRP 499.A N THR 495.A O no hydrogen 2.924 N/A ASP 500.A N THR 496.A O no hydrogen 3.239 N/A LYS 501.A N GLY 497.A O no hydrogen 3.057 N/A LEU 502.A N GLU 498.A O no hydrogen 3.035 N/A THR 503.A N TRP 499.A O no hydrogen 2.671 N/A THR 503.A OG1 TRP 499.A O no hydrogen 2.862 N/A GLN 504.A N ASP 500.A O no hydrogen 2.794 N/A ASP 505.A N LEU 502.A O no hydrogen 3.247 N/A SER 507.A N ASP 505.A OD1 no hydrogen 3.368 N/A PHE 508.A N ASP 505.A OD2 no hydrogen 3.321 N/A ASN 509.A N ASP 505.A O no hydrogen 3.426 N/A ASN 509.A ND2 THR 503.A O no hydrogen 2.949 N/A ASN 509.A ND2 ASP 505.A O no hydrogen 2.766 N/A ASP 510.A N SER 507.A O no hydrogen 3.152 N/A ASN 511.A ND2 PRO 415.A O no hydrogen 3.225 N/A SER 512.A OG ASP 510.A O no hydrogen 3.419 N/A ARG 515.A N PRO 445.A O no hydrogen 3.176 N/A ARG 515.A NE GLU 489.A OE1 no hydrogen 3.344 N/A ARG 515.A NH1 ASP 510.A O no hydrogen 2.650 N/A ARG 515.A NH1 SER 512.A OG no hydrogen 3.428 N/A ARG 515.A NH2 SER 512.A OG no hydrogen 3.124 N/A MET 516.A N GLU 489.A O no hydrogen 2.948 N/A ILE 517.A N LEU 447.A O no hydrogen 2.802 N/A GLU 518.A N HIS 491.A O no hydrogen 2.768 N/A ILE 519.A N VAL 449.A O no hydrogen 2.831 N/A MET 520.A N VAL 493.A O no hydrogen 3.029 N/A LEU 521.A N ASN 451.A O no hydrogen 2.734 N/A ASP 525.A N PRO 522.A O no hydrogen 3.109 N/A GLN 528.A N GLU 349.A OE1 no hydrogen 2.871 N/A LEU 530.A N PRO 527.A O no hydrogen 3.139 N/A VAL 531.A N GLN 528.A O no hydrogen 2.877 N/A LYS 532.A N GLN 528.A O no hydrogen 3.214 N/A GLN 533.A N ASN 529.A O no hydrogen 3.394 N/A ALA 534.A N LEU 530.A O no hydrogen 2.842 N/A LYS 535.A N VAL 531.A O no hydrogen 2.937 N/A THR 537.A N GLN 533.A O no hydrogen 2.742 N/A