Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1upc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 GLY 163.A O no hydrogen 3.170 N/A ALA 3.A N SER 164.A O no hydrogen 3.138 N/A ALA 4.A N LEU 162.A O no hydrogen 2.913 N/A ALA 6.A N THR 2.A O no hydrogen 3.030 N/A LEU 7.A N ALA 3.A O no hydrogen 2.838 N/A LEU 8.A N ALA 4.A O no hydrogen 3.182 N/A SER 9.A N HIS 5.A O no hydrogen 2.945 N/A ARG 10.A N ALA 6.A O no hydrogen 3.129 N/A ARG 10.A NE ASP 139.A OD1 no hydrogen 2.869 N/A ARG 10.A NH1 ASP 13.A OD2 no hydrogen 2.884 N/A ARG 10.A NH1 PRO 173.A O no hydrogen 2.946 N/A ARG 10.A NH2 ASP 139.A OD2 no hydrogen 3.177 N/A ARG 10.A NH2 PRO 173.A O no hydrogen 3.199 N/A ARG 10.A NH2 PRO 174.A O no hydrogen 3.548 N/A LEU 11.A N LEU 7.A O no hydrogen 3.031 N/A ARG 12.A N LEU 8.A O no hydrogen 3.010 N/A ASP 13.A N SER 9.A O no hydrogen 3.004 N/A HIS 14.A N ARG 10.A O no hydrogen 3.300 N/A HIS 14.A N LEU 11.A O no hydrogen 2.963 N/A HIS 14.A ND1 THR 177.A OG1 no hydrogen 2.671 N/A HIS 14.A NE2 ASP 139.A OD1 no hydrogen 2.750 N/A GLY 15.A N ARG 12.A O no hydrogen 3.200 N/A VAL 16.A N LEU 11.A O no hydrogen 3.104 N/A LYS 18.A NZ ASP 39.A OD2 no hydrogen 3.039 N/A VAL 19.A N ASP 39.A O no hydrogen 2.955 N/A PHE 20.A N ALA 65.A O no hydrogen 3.115 N/A GLY 21.A N VAL 41.A O no hydrogen 3.054 N/A VAL 22.A N TRP 67.A O no hydrogen 3.208 N/A GLY 24.A N GLU 26.A OE2 no hydrogen 2.869 N/A ARG 25.A NH1 GLU 99.A OE2 no hydrogen 2.700 N/A ARG 25.A NH2 GLU 99.A OE1 no hydrogen 2.932 N/A ARG 25.A NH2 GLU 99.A OE2 no hydrogen 3.498 N/A GLU 26.A N GLU 26.A OE1 no hydrogen 2.840 N/A ALA 27.A N GLY 24.A O no hydrogen 2.957 N/A ALA 28.A N ARG 25.A O no hydrogen 3.136 N/A SER 29.A N GLU 26.A O no hydrogen 2.765 N/A SER 29.A OG VAL 159.A O no hydrogen 2.827 N/A ILE 30.A N ALA 27.A O no hydrogen 3.359 N/A LEU 31.A N GLU 34.A OE2 no hydrogen 2.860 N/A PHE 32.A N GLU 34.A OE1 no hydrogen 2.778 N/A GLU 34.A N GLU 34.A OE1 no hydrogen 2.903 N/A ILE 38.A N VAL 35.A O no hydrogen 3.458 N/A ASP 39.A N GLY 17.A O no hydrogen 2.956 N/A VAL 41.A N VAL 19.A O no hydrogen 2.873 N/A THR 43.A N GLY 21.A O no hydrogen 2.926 N/A THR 43.A OG1 GLY 21.A O no hydrogen 3.414 N/A THR 43.A OG1 HIS 45.A O no hydrogen 2.760 N/A ARG 44.A N ASP 459.A OD1 no hydrogen 2.804 N/A ARG 44.A NE GLU 461.A OE1 no hydrogen 2.962 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.821 N/A PHE 47.A N HIS 45.A ND1 no hydrogen 3.196 N/A THR 48.A OG1 ASP 459.A OD2 no hydrogen 2.542 N/A GLY 50.A N GLU 46.A O no hydrogen 3.056 N/A VAL 51.A N PHE 47.A O no hydrogen 3.022 N/A ALA 52.A N THR 48.A O no hydrogen 2.952 N/A ALA 53.A N ALA 49.A O no hydrogen 3.224 N/A ASP 54.A N GLY 50.A O no hydrogen 3.132 N/A VAL 55.A N VAL 51.A O no hydrogen 2.966 N/A LEU 56.A N ALA 52.A O no hydrogen 2.898 N/A ALA 57.A N ALA 53.A O no hydrogen 2.942 N/A ARG 58.A N ASP 54.A O no hydrogen 2.992 N/A ARG 58.A NH1 ASP 54.A OD1 no hydrogen 2.927 N/A ARG 58.A NH1 ASP 54.A OD2 no hydrogen 3.366 N/A ARG 58.A NH2 ASP 54.A OD2 no hydrogen 2.982 N/A ARG 58.A NH2 ASP 87.A O no hydrogen 3.086 N/A ARG 58.A NH2 ARG 88.A O no hydrogen 3.450 N/A ILE 59.A N VAL 55.A O no hydrogen 2.948 N/A THR 60.A N LEU 56.A O no hydrogen 2.992 N/A THR 60.A OG1 LEU 56.A O no hydrogen 2.596 N/A GLY 61.A N ALA 57.A O no hydrogen 2.881 N/A ARG 62.A N THR 60.A OG1 no hydrogen 3.393 N/A GLN 64.A N PRO 90.A O no hydrogen 3.149 N/A GLN 64.A NE2 ARG 62.A O no hydrogen 3.429 N/A CYS 66.A N ILE 92.A O no hydrogen 3.036 N/A TRP 67.A NE1 GLU 26.A OE2 no hydrogen 2.861 N/A ALA 68.A N LEU 94.A O no hydrogen 2.789 N/A THR 69.A OG1 GLU 26.A OE1 no hydrogen 2.730 N/A GLY 73.A N LEU 70.A O no hydrogen 3.109 N/A THR 75.A N GLY 71.A O no hydrogen 3.132 N/A THR 75.A OG1 PRO 72.A O no hydrogen 3.256 N/A ASN 76.A N PRO 72.A O no hydrogen 3.028 N/A ASN 76.A ND2 GLU 46.A OE1 no hydrogen 3.002 N/A LEU 77.A N GLY 73.A O no hydrogen 3.063 N/A SER 78.A N MET 74.A O no hydrogen 3.038 N/A SER 78.A N THR 75.A O no hydrogen 3.294 N/A SER 78.A OG THR 75.A O no hydrogen 2.466 N/A THR 79.A N ASN 76.A O no hydrogen 3.294 N/A ILE 81.A N LEU 77.A O no hydrogen 2.882 N/A ALA 82.A N SER 78.A O no hydrogen 2.833 N/A THR 83.A N THR 79.A O no hydrogen 2.987 N/A THR 83.A OG1 THR 79.A O no hydrogen 3.045 N/A SER 84.A N GLY 80.A O no hydrogen 2.995 N/A SER 84.A OG SER 89.A O no hydrogen 2.788 N/A SER 84.A OG SER 89.A OG no hydrogen 2.853 N/A VAL 85.A N ILE 81.A O no hydrogen 2.921 N/A LEU 86.A N ALA 82.A O no hydrogen 3.038 N/A ASP 87.A N THR 83.A O no hydrogen 2.860 N/A ARG 88.A NE ASP 284.A OD2 no hydrogen 2.764 N/A ARG 88.A NH1 VAL 85.A O no hydrogen 3.095 N/A ARG 88.A NH2 ASP 284.A OD1 no hydrogen 2.958 N/A SER 89.A N SER 84.A O no hydrogen 3.125 N/A SER 89.A OG ASP 54.A OD2 no hydrogen 2.721 N/A SER 89.A OG SER 84.A OG no hydrogen 2.853 N/A ILE 92.A N GLN 64.A O no hydrogen 2.846 N/A ALA 93.A N SER 153.A O no hydrogen 2.871 N/A LEU 94.A N CYS 66.A O no hydrogen 2.993 N/A ALA 95.A N ILE 155.A O no hydrogen 3.219 N/A ALA 96.A N ALA 68.A O no hydrogen 2.914 N/A GLN 97.A N LEU 157.A O no hydrogen 3.034 N/A GLN 97.A NE2 LEU 112.A O no hydrogen 3.048 N/A SER 98.A N GLN 97.A OE1 no hydrogen 3.011 N/A GLU 99.A N GLU 99.A OE1 no hydrogen 2.693 N/A SER 100.A N ASP 160.A OD1 no hydrogen 2.895 N/A SER 100.A N ASP 160.A OD2 no hydrogen 3.322 N/A SER 100.A OG ASP 160.A OD1 no hydrogen 3.517 N/A SER 100.A OG ASP 160.A OD2 no hydrogen 2.369 N/A ASP 102.A N GLU 99.A O no hydrogen 2.733 N/A ASN 106.A N CYS 111.A O no hydrogen 2.826 N/A ASP 107.A N PHE 104.A O no hydrogen 2.959 N/A THR 108.A N PHE 104.A O no hydrogen 2.937 N/A THR 108.A OG1 ASP 102.A O no hydrogen 2.731 N/A CYS 111.A N THR 108.A O no hydrogen 2.941 N/A CYS 111.A SG GLN 97.A OE1 no hydrogen 3.619 N/A ILE 117.A N ASP 113.A O no hydrogen 3.120 N/A VAL 118.A N SER 114.A O no hydrogen 2.853 N/A ALA 119.A N VAL 115.A O no hydrogen 2.908 N/A MET 121.A N VAL 118.A O no hydrogen 2.903 N/A SER 122.A OG VAL 118.A O no hydrogen 3.145 N/A SER 122.A OG ALA 119.A O no hydrogen 3.307 N/A SER 122.A OG TYR 124.A O no hydrogen 3.256 N/A LYS 123.A N PRO 152.A O no hydrogen 2.678 N/A LYS 123.A NZ ALA 144.A O no hydrogen 2.874 N/A LYS 123.A NZ PRO 149.A O no hydrogen 2.823 N/A VAL 126.A N PHE 154.A O no hydrogen 3.175 N/A LEU 128.A N SER 156.A O no hydrogen 2.855 N/A ARG 130.A NE GLU 133.A OE2 no hydrogen 2.913 N/A ARG 130.A NH2 GLU 133.A OE1 no hydrogen 2.919 N/A GLU 133.A N ARG 130.A O no hydrogen 3.061 N/A ILE 134.A N PRO 131.A O no hydrogen 3.119 N/A LEU 137.A N GLU 133.A O no hydrogen 3.013 N/A VAL 138.A N ILE 134.A O no hydrogen 3.065 N/A ASP 139.A N THR 135.A O no hydrogen 3.206 N/A SER 140.A N ASP 136.A O no hydrogen 2.912 N/A SER 140.A OG ASP 136.A O no hydrogen 3.446 N/A ALA 141.A N LEU 137.A O no hydrogen 2.891 N/A VAL 142.A N VAL 138.A O no hydrogen 2.967 N/A ASN 143.A N ASP 139.A O no hydrogen 2.861 N/A ALA 144.A N SER 140.A O no hydrogen 3.090 N/A ALA 145.A N ALA 141.A O no hydrogen 2.819 N/A MET 146.A N VAL 142.A O no hydrogen 2.919 N/A THR 147.A N ALA 144.A O no hydrogen 3.448 N/A THR 147.A OG1 ASN 143.A O no hydrogen 2.763 N/A GLU 148.A N VAL 182.A O no hydrogen 2.907 N/A GLY 151.A N ALA 145.A O no hydrogen 3.221 N/A SER 153.A N VAL 91.A O no hydrogen 2.895 N/A SER 153.A OG ALA 141.A O no hydrogen 2.749 N/A PHE 154.A N TYR 124.A O no hydrogen 2.816 N/A ILE 155.A N ALA 93.A O no hydrogen 3.046 N/A SER 156.A N VAL 126.A O no hydrogen 2.880 N/A LEU 157.A N ALA 95.A O no hydrogen 2.833 N/A VAL 159.A N GLN 97.A O no hydrogen 2.948 N/A LEU 162.A N PRO 158.A O no hydrogen 3.026 N/A GLY 163.A N VAL 159.A O no hydrogen 3.253 N/A SER 164.A N LEU 161.A O no hydrogen 3.224 N/A GLU 166.A N SER 164.A OG no hydrogen 3.038 N/A ILE 168.A N SER 165.A O no hydrogen 3.052 N/A ASN 172.A ND2 ASP 13.A OD2 no hydrogen 2.943 N/A THR 177.A OG1 HIS 14.A ND1 no hydrogen 2.671 N/A LYS 180.A NZ SER 217.A O no hydrogen 2.719 N/A LYS 180.A NZ SER 217.A OG no hydrogen 2.896 N/A LYS 180.A NZ ASP 325.A OD1 no hydrogen 2.884 N/A LYS 180.A NZ ASP 325.A OD2 no hydrogen 2.709 N/A VAL 182.A N MET 146.A O no hydrogen 2.875 N/A VAL 184.A N PRO 307.A O no hydrogen 3.166 N/A ALA 186.A N VAL 323.A O no hydrogen 2.917 N/A TRP 189.A N ALA 186.A O no hydrogen 3.344 N/A GLN 190.A N GLN 190.A OE1 no hydrogen 3.001 N/A ALA 192.A N GLY 188.A O no hydrogen 3.236 N/A ALA 193.A N TRP 189.A O no hydrogen 2.747 N/A ASP 194.A N GLN 190.A O no hydrogen 3.023 N/A ASP 194.A N LYS 191.A O no hydrogen 3.274 N/A GLN 195.A N LYS 191.A O no hydrogen 3.086 N/A ALA 196.A N ALA 192.A O no hydrogen 3.086 N/A ALA 197.A N ALA 193.A O no hydrogen 3.052 N/A ALA 198.A N ASP 194.A O no hydrogen 2.941 N/A LEU 199.A N GLN 195.A O no hydrogen 3.160 N/A LEU 200.A N ALA 196.A O no hydrogen 2.970 N/A ALA 201.A N ALA 197.A O no hydrogen 3.131 N/A GLU 202.A N ALA 198.A O no hydrogen 3.321 N/A ALA 203.A N LEU 200.A O no hydrogen 3.119 N/A LYS 204.A N ASP 276.A OD2 no hydrogen 2.775 N/A LYS 204.A NZ HIS 205.A NE2 no hydrogen 3.405 N/A HIS 205.A N ASP 276.A OD1 no hydrogen 2.948 N/A VAL 207.A N LEU 277.A O no hydrogen 3.027 N/A LEU 208.A N PRO 233.A O no hydrogen 2.907 N/A VAL 209.A N LEU 279.A O no hydrogen 2.911 N/A VAL 210.A N ILE 235.A O no hydrogen 2.716 N/A GLY 211.A N VAL 281.A O no hydrogen 3.006 N/A ALA 212.A N GLU 287.A OE1 no hydrogen 3.345 N/A ALA 212.A N GLU 287.A OE2 no hydrogen 3.035 N/A ALA 214.A N GLY 211.A O no hydrogen 3.079 N/A ILE 215.A N ALA 212.A O no hydrogen 2.873 N/A ARG 216.A N ALA 212.A O no hydrogen 3.221 N/A ARG 216.A NE GLU 148.A OE2 no hydrogen 2.827 N/A ARG 216.A NH2 GLU 148.A OE1 no hydrogen 3.153 N/A SER 217.A N ALA 213.A O no hydrogen 3.028 N/A SER 217.A OG ASP 325.A OD1 no hydrogen 2.691 N/A GLY 218.A N ILE 215.A O no hydrogen 3.066 N/A ALA 219.A N ALA 214.A O no hydrogen 2.991 N/A ILE 223.A N ALA 219.A O no hydrogen 2.867 N/A ARG 224.A N VAL 220.A O no hydrogen 2.842 N/A ARG 224.A NE GLU 228.A OE2 no hydrogen 2.994 N/A ALA 225.A N PRO 221.A O no hydrogen 3.029 N/A LEU 226.A N ALA 222.A O no hydrogen 3.091 N/A ALA 227.A N ILE 223.A O no hydrogen 2.960 N/A GLU 228.A N ARG 224.A O no hydrogen 2.896 N/A ARG 229.A N ALA 225.A O no hydrogen 3.139 N/A ARG 229.A NE GLU 334.A OE1 no hydrogen 3.355 N/A ARG 229.A NH1 THR 337.A O no hydrogen 2.856 N/A ARG 229.A NH2 GLU 334.A OE1 no hydrogen 2.837 N/A ARG 229.A NH2 THR 337.A O no hydrogen 3.192 N/A ARG 229.A NH2 THR 337.A OG1 no hydrogen 3.127 N/A LEU 230.A N LEU 226.A O no hydrogen 3.090 N/A ASN 231.A N GLU 228.A O no hydrogen 3.422 N/A ASN 231.A ND2 LYS 343.A O no hydrogen 2.758 N/A ILE 232.A N ALA 227.A O no hydrogen 3.020 N/A VAL 234.A N LEU 250.A O no hydrogen 2.906 N/A ILE 235.A N LEU 208.A O no hydrogen 2.812 N/A THR 236.A N GLY 253.A O no hydrogen 3.141 N/A THR 236.A OG1 THR 237.A O no hydrogen 2.961 N/A THR 237.A N VAL 210.A O no hydrogen 3.098 N/A THR 237.A OG1 GLU 287.A OE2 no hydrogen 2.760 N/A LYS 241.A NZ VAL 405.A O no hydrogen 3.071 N/A LYS 241.A NZ ALA 408.A O no hydrogen 2.897 N/A VAL 246.A N ASP 411.A OD1 no hydrogen 3.302 N/A HIS 248.A N PRO 245.A O no hydrogen 3.373 N/A HIS 248.A NE2 GLU 228.A OE2 no hydrogen 2.775 N/A LEU 250.A N HIS 248.A ND1 no hydrogen 3.000 N/A ASN 251.A N HIS 248.A O no hydrogen 3.242 N/A ASN 251.A ND2 PRO 245.A O no hydrogen 3.052 N/A TYR 252.A N VAL 234.A O no hydrogen 3.090 N/A TYR 252.A OH HIS 346.A O no hydrogen 2.649 N/A GLY 253.A N ASN 251.A OD1 no hydrogen 3.318 N/A VAL 255.A N THR 236.A O no hydrogen 3.146 N/A THR 256.A OG1 HIS 402.A ND1 no hydrogen 2.822 N/A TYR 258.A N THR 256.A OG1 no hydrogen 3.254 N/A TYR 258.A OH TYR 486.A OH no hydrogen 2.601 N/A MET 259.A N THR 256.A O no hydrogen 3.071 N/A ILE 262.A N TYR 258.A O no hydrogen 2.930 N/A LEU 263.A N MET 259.A O no hydrogen 3.076 N/A PHE 265.A N ASP 260.A O no hydrogen 3.241 N/A LEU 268.A N ASP 260.A OD1 no hydrogen 2.938 N/A THR 270.A N PRO 266.A O no hydrogen 3.054 N/A THR 270.A OG1 PRO 266.A O no hydrogen 2.877 N/A MET 271.A N ALA 267.A O no hydrogen 2.989 N/A PHE 272.A N LEU 268.A O no hydrogen 2.995 N/A ALA 273.A N GLN 269.A O no hydrogen 2.823 N/A VAL 275.A N PHE 272.A O no hydrogen 3.117 N/A ASP 276.A N HIS 205.A O no hydrogen 3.137 N/A VAL 278.A N LYS 301.A O no hydrogen 2.900 N/A LEU 279.A N VAL 207.A O no hydrogen 3.055 N/A THR 280.A N VAL 303.A O no hydrogen 2.802 N/A THR 280.A OG1 VAL 303.A O no hydrogen 3.415 N/A THR 280.A OG1 TYR 316.A OH no hydrogen 2.744 N/A VAL 281.A N VAL 209.A O no hydrogen 2.775 N/A GLY 282.A N ILE 305.A O no hydrogen 2.793 N/A TYR 283.A N ILE 305.A O no hydrogen 3.346 N/A TYR 283.A OH LEU 289.A O no hydrogen 2.629 N/A ALA 286.A N ASP 284.A OD1 no hydrogen 3.052 N/A GLU 287.A N ASP 284.A O no hydrogen 3.004 N/A ASP 288.A N TYR 285.A O no hydrogen 3.060 N/A ARG 290.A NH1 ASP 288.A OD1 no hydrogen 3.124 N/A MET 293.A N ARG 290.A O no hydrogen 2.987 N/A TRP 294.A N PRO 291.A O no hydrogen 3.151 N/A ILE 298.A N ALA 273.A O no hydrogen 3.143 N/A LYS 300.A NZ PHE 272.A O no hydrogen 2.685 N/A LYS 300.A NZ ALA 273.A O no hydrogen 3.208 N/A LYS 300.A NZ VAL 275.A O no hydrogen 2.579 N/A LYS 300.A NZ LYS 296.A O no hydrogen 2.809 N/A LYS 300.A NZ ILE 298.A O no hydrogen 2.919 N/A LYS 301.A N ASP 276.A O no hydrogen 3.049 N/A THR 302.A N ASP 319.A OD2 no hydrogen 2.872 N/A THR 302.A OG1 ASP 319.A OD2 no hydrogen 3.192 N/A VAL 303.A N VAL 278.A O no hydrogen 2.824 N/A ARG 304.A N VAL 320.A O no hydrogen 2.915 N/A ARG 304.A NH1 THR 308.A O no hydrogen 3.067 N/A ARG 304.A NH1 ASP 321.A OD1 no hydrogen 2.933 N/A ARG 304.A NH2 THR 308.A O no hydrogen 3.197 N/A ARG 304.A NH2 THR 308.A OG1 no hydrogen 3.195 N/A ILE 305.A N THR 280.A O no hydrogen 3.088 N/A SER 306.A N VAL 322.A O no hydrogen 3.235 N/A SER 306.A OG THR 308.A OG1 no hydrogen 3.010 N/A THR 308.A OG1 SER 306.A OG no hydrogen 3.010 N/A THR 308.A OG1 VAL 309.A O no hydrogen 3.555 N/A ASN 310.A ND2 TYR 316.A O no hydrogen 2.908 N/A ILE 312.A N ASN 310.A OD1 no hydrogen 3.092 N/A VAL 315.A N ILE 312.A O no hydrogen 3.066 N/A TYR 316.A N ILE 312.A O no hydrogen 3.005 N/A TYR 316.A OH THR 280.A OG1 no hydrogen 2.744 N/A ASP 319.A N THR 302.A OG1 no hydrogen 3.309 N/A VAL 320.A N THR 302.A O no hydrogen 3.270 N/A VAL 322.A N ARG 304.A O no hydrogen 2.743 N/A THR 324.A N SER 306.A O no hydrogen 3.067 N/A LEU 327.A N SER 217.A OG no hydrogen 3.341 N/A ALA 328.A N ASP 325.A OD2 no hydrogen 3.206 N/A PHE 329.A N ASP 325.A O no hydrogen 2.928 N/A VAL 330.A N VAL 326.A O no hydrogen 2.887 N/A GLU 331.A N LEU 327.A O no hydrogen 3.055 N/A HIS 332.A N ALA 328.A O no hydrogen 3.132 N/A HIS 332.A NE2 ASP 194.A OD1 no hydrogen 2.766 N/A PHE 333.A N PHE 329.A O no hydrogen 2.867 N/A GLU 334.A N VAL 330.A O no hydrogen 2.806 N/A THR 335.A N GLU 331.A O no hydrogen 3.224 N/A ALA 336.A N HIS 332.A O no hydrogen 3.072 N/A THR 337.A N PHE 333.A O no hydrogen 2.989 N/A THR 337.A N GLU 334.A O no hydrogen 3.116 N/A THR 337.A OG1 PHE 333.A O no hydrogen 2.684 N/A THR 337.A OG1 GLU 334.A O no hydrogen 3.565 N/A ALA 338.A N THR 335.A O no hydrogen 3.387 N/A PHE 340.A N THR 337.A O no hydrogen 3.332 N/A LYS 343.A N LEU 230.A O no hydrogen 3.070 N/A LYS 343.A NZ LEU 200.A O no hydrogen 2.755 N/A LYS 343.A NZ ALA 203.A O no hydrogen 2.831 N/A ARG 345.A NE ASN 231.A OD1 no hydrogen 3.336 N/A GLU 349.A N ASP 347.A OD1 no hydrogen 2.976 N/A ARG 352.A N ILE 348.A O no hydrogen 3.043 N/A ARG 352.A NH1 GLU 349.A OE2 no hydrogen 2.982 N/A ARG 352.A NH2 GLU 249.A O no hydrogen 3.123 N/A ARG 352.A NH2 ASN 251.A O no hydrogen 3.316 N/A ALA 353.A N GLU 349.A O no hydrogen 2.852 N/A ARG 354.A N PRO 350.A O no hydrogen 3.128 N/A ARG 354.A NE LEU 263.A O no hydrogen 2.932 N/A ARG 354.A NH1 GLU 357.A OE1 no hydrogen 3.053 N/A ARG 354.A NH2 LEU 263.A O no hydrogen 3.206 N/A ILE 355.A N LEU 351.A O no hydrogen 2.944 N/A ALA 356.A N ARG 352.A O no hydrogen 2.974 N/A GLU 357.A N ALA 353.A O no hydrogen 2.986 N/A PHE 358.A N ARG 354.A O no hydrogen 3.275 N/A LEU 359.A N ILE 355.A O no hydrogen 3.150 N/A ALA 360.A N ALA 356.A O no hydrogen 2.984 N/A ASP 361.A N GLU 357.A O no hydrogen 3.054 N/A ASP 361.A N PHE 358.A O no hydrogen 3.318 N/A GLU 363.A N ASP 361.A OD1 no hydrogen 3.213 N/A TYR 365.A OH ASP 361.A OD2 no hydrogen 2.957 N/A MET 369.A N PRO 545.A O no hydrogen 3.058 N/A ARG 370.A N GLN 373.A OE1 no hydrogen 3.318 N/A ARG 370.A NH1 MET 369.A O no hydrogen 3.394 N/A ARG 370.A NH2 ASP 367.A OD1 no hydrogen 3.130 N/A HIS 372.A ND1 PHE 358.A O no hydrogen 3.188 N/A GLN 373.A NE2 ASP 361.A O no hydrogen 3.014 N/A GLN 373.A NE2 GLU 363.A O no hydrogen 2.935 N/A VAL 374.A N ARG 370.A O no hydrogen 3.054 N/A ILE 375.A N VAL 371.A O no hydrogen 2.814 N/A ASP 376.A N HIS 372.A O no hydrogen 2.918 N/A SER 377.A N GLN 373.A O no hydrogen 3.309 N/A SER 377.A OG GLN 373.A O no hydrogen 2.694 N/A MET 378.A N VAL 374.A O no hydrogen 3.236 N/A ASN 379.A N ILE 375.A O no hydrogen 2.839 N/A ASN 379.A ND2 PHE 407.A O no hydrogen 2.734 N/A THR 380.A N ASP 376.A O no hydrogen 3.062 N/A THR 380.A OG1 ASP 376.A O no hydrogen 3.334 N/A VAL 381.A N SER 377.A O no hydrogen 3.171 N/A MET 382.A N MET 378.A O no hydrogen 2.925 N/A GLU 383.A N ASN 379.A O no hydrogen 3.009 N/A GLU 384.A N THR 380.A O no hydrogen 3.147 N/A ALA 385.A N VAL 381.A O no hydrogen 2.941 N/A ALA 386.A N MET 382.A O no hydrogen 2.971 N/A GLY 389.A N ASP 411.A OD2 no hydrogen 2.926 N/A GLU 390.A N GLU 387.A O no hydrogen 3.265 N/A GLY 391.A N GLN 442.A OE1 no hydrogen 2.839 N/A THR 392.A N PRO 443.A O no hydrogen 3.094 N/A ILE 393.A N GLY 415.A O no hydrogen 2.801 N/A VAL 394.A N PHE 445.A O no hydrogen 2.746 N/A SER 395.A N LEU 417.A O no hydrogen 2.717 N/A SER 395.A OG ASP 396.A O no hydrogen 2.832 N/A ASP 396.A N ILE 447.A O no hydrogen 3.078 N/A ILE 397.A N ASP 396.A OD1 no hydrogen 2.640 N/A ARG 401.A N GLY 398.A O no hydrogen 3.116 N/A ARG 401.A NH1 SER 419.A O no hydrogen 2.928 N/A ARG 401.A NH2 SER 423.A OG no hydrogen 3.142 N/A HIS 402.A N PHE 399.A O no hydrogen 3.172 N/A GLY 404.A N PHE 400.A O no hydrogen 3.026 N/A VAL 405.A N ARG 401.A O no hydrogen 2.988 N/A LEU 406.A N HIS 402.A O no hydrogen 3.201 N/A LEU 406.A N TYR 403.A O no hydrogen 3.211 N/A PHE 407.A N TYR 403.A O no hydrogen 2.922 N/A ALA 408.A N GLY 404.A O no hydrogen 3.025 N/A ARG 409.A N ASN 379.A OD1 no hydrogen 2.911 N/A GLN 412.A NE2 GLY 391.A O no hydrogen 3.244 N/A GLN 412.A NE2 GLN 442.A OE1 no hydrogen 2.898 N/A GLY 415.A N GLN 412.A O no hydrogen 2.938 N/A LEU 417.A N ILE 393.A O no hydrogen 2.969 N/A THR 418.A OG1 SER 395.A O no hydrogen 2.743 N/A SER 419.A OG ASP 87.A OD1 no hydrogen 3.232 N/A SER 419.A OG ASP 87.A OD2 no hydrogen 2.567 N/A GLY 421.A N ASP 87.A OD1 no hydrogen 2.908 N/A CYS 422.A N ASP 87.A OD1 no hydrogen 3.021 N/A SER 423.A N SER 419.A OG no hydrogen 2.945 N/A SER 423.A OG SER 419.A O no hydrogen 2.603 N/A SER 424.A OG PHE 425.A O no hydrogen 2.829 N/A GLY 428.A N ASP 396.A OD2 no hydrogen 2.968 N/A ALA 431.A N TYR 427.A O no hydrogen 2.976 N/A ALA 432.A N GLY 428.A O no hydrogen 2.932 N/A ALA 432.A N ILE 429.A O no hydrogen 3.169 N/A ILE 433.A N ILE 429.A O no hydrogen 2.990 N/A GLY 434.A N PRO 430.A O no hydrogen 2.968 N/A ALA 435.A N ALA 431.A O no hydrogen 2.868 N/A GLN 436.A N ALA 432.A O no hydrogen 2.863 N/A GLN 436.A NE2 GLN 436.A O no hydrogen 2.922 N/A GLN 436.A NE2 GLN 442.A O no hydrogen 3.074 N/A MET 437.A N ILE 433.A O no hydrogen 3.023 N/A ALA 438.A N GLY 434.A O no hydrogen 3.106 N/A ARG 439.A N ALA 435.A O no hydrogen 3.112 N/A ARG 439.A NH1 THR 392.A OG1 no hydrogen 2.806 N/A ARG 439.A NH1 PHE 414.A O no hydrogen 2.838 N/A ARG 439.A NH2 PRO 413.A O no hydrogen 3.142 N/A GLN 442.A N ARG 439.A O no hydrogen 3.227 N/A PHE 445.A N THR 392.A O no hydrogen 2.942 N/A LEU 446.A N VAL 471.A O no hydrogen 2.844 N/A ILE 447.A N VAL 394.A O no hydrogen 2.850 N/A ALA 448.A N VAL 473.A O no hydrogen 3.071 N/A PHE 453.A N GLY 449.A O no hydrogen 2.910 N/A HIS 454.A N ASP 450.A O no hydrogen 3.076 N/A HIS 454.A ND1 SER 457.A OG no hydrogen 2.884 N/A SER 455.A N GLY 451.A O no hydrogen 3.146 N/A SER 455.A OG GLY 452.A O no hydrogen 2.732 N/A ASN 456.A N PHE 453.A O no hydrogen 3.298 N/A ASN 456.A ND2 THR 48.A OG1 no hydrogen 3.032 N/A ASN 456.A ND2 GLY 426.A O no hydrogen 2.993 N/A SER 457.A OG HIS 454.A ND1 no hydrogen 2.884 N/A SER 457.A OG HIS 454.A O no hydrogen 3.455 N/A LEU 460.A N SER 457.A O no hydrogen 3.086 N/A GLU 461.A N SER 458.A O no hydrogen 3.349 N/A THR 462.A N ASP 459.A O no hydrogen 3.110 N/A THR 462.A OG1 ASP 459.A OD1 no hydrogen 2.516 N/A ILE 463.A N ASP 459.A O no hydrogen 3.187 N/A ALA 464.A N LEU 460.A O no hydrogen 3.044 N/A ARG 465.A N GLU 461.A O no hydrogen 3.000 N/A ARG 465.A NH1 LEU 42.A O no hydrogen 2.354 N/A ARG 465.A NH2 GLU 461.A OE1 no hydrogen 2.823 N/A ARG 465.A NH2 GLU 461.A OE2 no hydrogen 3.437 N/A LEU 466.A N THR 462.A O no hydrogen 2.963 N/A ASN 467.A N ALA 464.A O no hydrogen 3.061 N/A LEU 468.A N ILE 463.A O no hydrogen 3.193 N/A VAL 471.A N THR 444.A O no hydrogen 3.050 N/A THR 472.A N PHE 540.A O no hydrogen 2.780 N/A VAL 473.A N LEU 446.A O no hydrogen 2.791 N/A VAL 474.A N ILE 542.A O no hydrogen 2.995 N/A VAL 475.A N ALA 448.A O no hydrogen 2.882 N/A ASN 476.A N VAL 544.A O no hydrogen 3.112 N/A ASN 476.A ND2 VAL 504.A O no hydrogen 3.509 N/A ASN 476.A ND2 GLU 543.A OE2 no hydrogen 3.002 N/A ASN 477.A N ASP 450.A OD1 no hydrogen 3.375 N/A ASP 478.A N ASN 476.A OD1 no hydrogen 2.861 N/A THR 479.A OG1 ASN 477.A O no hydrogen 2.782 N/A ASN 480.A N VAL 499.A O no hydrogen 2.968 N/A ILE 483.A N ASN 480.A O no hydrogen 3.064 N/A GLU 484.A N ASN 480.A O no hydrogen 3.140 N/A LEU 485.A N GLY 481.A O no hydrogen 2.986 N/A TYR 486.A N LEU 482.A O no hydrogen 3.142 N/A TYR 486.A OH TYR 258.A OH no hydrogen 2.601 N/A GLN 487.A N ILE 483.A O no hydrogen 2.863 N/A GLN 487.A NE2 HIS 495.A O no hydrogen 3.101 N/A ASN 488.A N GLU 484.A O no hydrogen 3.009 N/A ASN 488.A ND2 GLU 484.A O no hydrogen 3.043 N/A ASN 488.A ND2 SER 494.A OG no hydrogen 3.045 N/A ILE 489.A N LEU 485.A O no hydrogen 2.848 N/A GLY 490.A N TYR 486.A O no hydrogen 3.062 N/A HIS 491.A N GLN 487.A O no hydrogen 2.938 N/A HIS 492.A N ASN 488.A O no hydrogen 2.875 N/A SER 494.A OG GLU 484.A OE2 no hydrogen 2.709 N/A HIS 495.A N GLN 487.A OE1 no hydrogen 3.108 N/A ALA 498.A N HIS 495.A O no hydrogen 3.270 N/A VAL 499.A N ASP 496.A O no hydrogen 2.893 N/A LYS 500.A N ASP 496.A O no hydrogen 2.727 N/A LYS 500.A NZ THR 479.A OG1 no hydrogen 2.957 N/A LYS 500.A NZ GLU 484.A OE1 no hydrogen 3.108 N/A PHE 501.A N ASP 478.A O no hydrogen 2.920 N/A PHE 506.A N GLU 543.A OE1 no hydrogen 2.888 N/A ALA 508.A N ASP 505.A OD1 no hydrogen 3.086 N/A LEU 509.A N ASP 505.A O no hydrogen 3.011 N/A ALA 510.A N PHE 506.A O no hydrogen 2.978 N/A GLU 511.A N VAL 507.A O no hydrogen 3.156 N/A ALA 512.A N ALA 508.A O no hydrogen 2.867 N/A ASN 513.A N ALA 510.A O no hydrogen 2.951 N/A ASN 513.A ND2 LEU 509.A O no hydrogen 2.904 N/A GLY 514.A N GLU 511.A O no hydrogen 3.184 N/A VAL 515.A N ALA 510.A O no hydrogen 2.999 N/A ALA 517.A N GLU 511.A OE2 no hydrogen 3.280 N/A THR 518.A N LEU 541.A O no hydrogen 3.065 N/A ALA 520.A N GLU 543.A O no hydrogen 2.909 N/A THR 521.A N GLU 525.A OE1 no hydrogen 2.983 N/A THR 521.A OG1 GLU 525.A OE1 no hydrogen 3.045 N/A ARG 523.A NE ASP 361.A O no hydrogen 3.172 N/A ARG 523.A NH1 ASP 376.A OD2 no hydrogen 3.356 N/A ARG 523.A NH2 LEU 359.A O no hydrogen 2.890 N/A ARG 523.A NH2 ASP 361.A O no hydrogen 2.988 N/A GLU 525.A N ASN 522.A OD1 no hydrogen 3.003 N/A LEU 526.A N ASN 522.A O no hydrogen 2.934 N/A LEU 527.A N ARG 523.A O no hydrogen 2.981 N/A ALA 528.A N GLU 524.A O no hydrogen 3.166 N/A ALA 529.A N GLU 525.A O no hydrogen 2.864 N/A LEU 530.A N LEU 526.A O no hydrogen 2.684 N/A ARG 531.A N LEU 527.A O no hydrogen 3.029 N/A ARG 531.A NE GLU 384.A OE1 no hydrogen 3.000 N/A ARG 531.A NH2 GLU 384.A OE1 no hydrogen 3.318 N/A ARG 531.A NH2 GLU 384.A OE2 no hydrogen 2.840 N/A LYS 532.A N ALA 528.A O no hydrogen 3.108 N/A GLY 533.A N ALA 529.A O no hydrogen 2.926 N/A ALA 534.A N LEU 530.A O no hydrogen 3.112 N/A GLU 535.A N LYS 532.A O no hydrogen 3.218 N/A LEU 536.A N GLY 533.A O no hydrogen 3.376 N/A ARG 538.A NH2 ASP 516.A OD2 no hydrogen 3.058 N/A PHE 540.A N ILE 470.A O no hydrogen 3.089 N/A LEU 541.A N ASP 516.A O no hydrogen 3.101 N/A ILE 542.A N THR 472.A O no hydrogen 2.711 N/A GLU 543.A N THR 518.A O no hydrogen 2.986 N/A VAL 544.A N VAL 474.A O no hydrogen 2.973 N/A VAL 546.A N ASN 476.A O no hydrogen 3.080 N/A ASN 547.A N MET 369.A O no hydrogen 3.336 N/A GLY 554.A N GLN 551.A O no hydrogen 3.188 N/A LEU 558.A N PHE 555.A O no hydrogen 3.035 N/A SER 559.A N GLY 556.A O no hydrogen 3.169 N/A