Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1sks_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 49.A OE2 no hydrogen 3.198 N/A ILE 2.A N LEU 55.A O no hydrogen 2.927 N/A VAL 3.A N TYR 24.A O no hydrogen 2.884 N/A SER 4.A N VAL 57.A O no hydrogen 2.796 N/A SER 4.A OG VAL 22.A O no hydrogen 2.837 N/A SER 4.A OG TYR 42.A OH no hydrogen 2.678 N/A ASP 5.A N VAL 22.A O no hydrogen 3.338 N/A GLU 7.A N CYS 20.A O no hydrogen 2.765 N/A ASN 9.A N LYS 17.A O no hydrogen 3.074 N/A ASN 9.A ND2 THR 16.A OG1 no hydrogen 2.821 N/A SER 14.A N LEU 11.A O no hydrogen 3.064 N/A VAL 15.A N LEU 12.A O no hydrogen 3.345 N/A THR 16.A N ASN 9.A OD1 no hydrogen 2.884 N/A LYS 17.A N ASN 9.A OD1 no hydrogen 3.016 N/A PHE 18.A N GLN 76.A OE1 no hydrogen 2.571 N/A HIS 19.A N GLU 7.A O no hydrogen 2.835 N/A HIS 19.A NE2 TRP 154.A O no hydrogen 2.787 N/A CYS 20.A N GLU 7.A O no hydrogen 3.148 N/A CYS 20.A SG ASN 165.A OD1 no hydrogen 3.433 N/A GLY 21.A N TYR 34.A O no hydrogen 3.021 N/A VAL 22.A N ASP 5.A O no hydrogen 3.037 N/A ILE 23.A N VAL 32.A O no hydrogen 2.964 N/A TYR 24.A N VAL 3.A O no hydrogen 2.848 N/A ASP 25.A N GLU 30.A O no hydrogen 3.332 N/A TYR 26.A N MET 1.A O no hydrogen 3.137 N/A TYR 26.A OH GLU 177.A OE2 no hydrogen 3.016 N/A SER 27.A N ASP 25.A OD1 no hydrogen 2.958 N/A SER 27.A OG ASP 25.A OD1 no hydrogen 2.616 N/A THR 28.A N ASP 25.A O no hydrogen 3.256 N/A ALA 29.A N ASP 25.A O no hydrogen 2.674 N/A VAL 32.A N ILE 23.A O no hydrogen 2.902 N/A TYR 34.A N GLY 21.A O no hydrogen 2.874 N/A ARG 35.A N ASP 38.A OD2 no hydrogen 2.736 N/A ASP 38.A N ARG 35.A O no hydrogen 2.654 N/A PHE 39.A N PRO 36.A O no hydrogen 3.302 N/A TYR 42.A N ASP 38.A O no hydrogen 2.837 N/A TYR 42.A OH SER 4.A OG no hydrogen 2.678 N/A LEU 43.A N PHE 39.A O no hydrogen 3.020 N/A ASP 44.A N GLY 40.A O no hydrogen 3.142 N/A ALA 45.A N ALA 41.A O no hydrogen 2.963 N/A LEU 46.A N TYR 42.A O no hydrogen 3.195 N/A GLU 47.A N LEU 43.A O no hydrogen 2.935 N/A ALA 48.A N ASP 44.A O no hydrogen 2.975 N/A GLU 49.A N ALA 45.A O no hydrogen 3.355 N/A VAL 50.A N LEU 46.A O no hydrogen 3.132 N/A ALA 51.A N GLU 47.A O no hydrogen 2.904 N/A ARG 52.A N ALA 48.A O no hydrogen 3.051 N/A GLY 53.A N VAL 50.A O no hydrogen 3.089 N/A GLY 54.A N GLU 49.A O no hydrogen 2.826 N/A LEU 55.A N GLU 49.A OE2 no hydrogen 3.081 N/A ILE 56.A N ASN 87.A O no hydrogen 2.837 N/A VAL 57.A N ILE 2.A O no hydrogen 2.797 N/A PHE 58.A N ILE 89.A O no hydrogen 3.064 N/A HIS 59.A ND1 THR 91.A OG1 no hydrogen 2.622 N/A ASN 60.A N ASP 90.A OD1 no hydrogen 2.614 N/A HIS 62.A N ASP 90.A OD2 no hydrogen 3.093 N/A LYS 63.A NZ GLU 222.A OE1 no hydrogen 3.161 N/A LYS 63.A NZ GLU 222.A OE2 no hydrogen 2.661 N/A LYS 63.A NZ SER 407.A OG no hydrogen 3.369 N/A LYS 63.A NZ VAL 408.A O no hydrogen 3.338 N/A TYR 64.A N ASN 60.A O no hydrogen 3.324 N/A TYR 64.A OH ALA 10.A O no hydrogen 2.669 N/A VAL 66.A N GLY 61.A O no hydrogen 2.954 N/A ALA 68.A N TYR 64.A O no hydrogen 2.742 N/A LEU 69.A N ASP 65.A O no hydrogen 2.957 N/A THR 70.A N VAL 66.A O no hydrogen 3.281 N/A THR 70.A OG1 VAL 66.A O no hydrogen 3.469 N/A THR 70.A OG1 PHE 81.A O no hydrogen 2.938 N/A LYS 71.A N PRO 67.A O no hydrogen 3.173 N/A LYS 71.A NZ LEU 12.A O no hydrogen 2.886 N/A LEU 72.A N ALA 68.A O no hydrogen 2.767 N/A ALA 73.A N LEU 69.A O no hydrogen 2.841 N/A LYS 74.A N THR 70.A O no hydrogen 3.236 N/A LYS 74.A NZ ASN 78.A OD1 no hydrogen 2.961 N/A LEU 75.A N LYS 71.A O no hydrogen 3.030 N/A GLN 76.A N LEU 72.A O no hydrogen 2.877 N/A LEU 77.A N ALA 73.A O no hydrogen 3.070 N/A ASN 78.A N LYS 74.A O no hydrogen 3.057 N/A ARG 79.A N ALA 73.A O no hydrogen 2.912 N/A ARG 79.A NH1 ASP 44.A OD1 no hydrogen 3.066 N/A ARG 79.A NH2 ASP 44.A OD1 no hydrogen 3.057 N/A HIS 82.A NE2 GLU 80.A OE1 no hydrogen 3.318 N/A GLU 86.A N GLU 86.A OE1 no hydrogen 3.002 N/A ASN 87.A N PRO 84.A O no hydrogen 3.061 N/A ASN 87.A ND2 GLY 54.A O no hydrogen 3.031 N/A CYS 88.A N ARG 85.A O no hydrogen 3.079 N/A CYS 88.A SG PRO 84.A O no hydrogen 3.527 N/A ILE 89.A N ILE 56.A O no hydrogen 2.904 N/A ASP 90.A N HIS 212.A NE2 no hydrogen 3.083 N/A THR 91.A N PHE 58.A O no hydrogen 3.066 N/A THR 91.A OG1 HIS 59.A ND1 no hydrogen 2.622 N/A LEU 92.A N ASP 90.A OD1 no hydrogen 2.793 N/A VAL 93.A N ASP 90.A OD1 no hydrogen 3.449 N/A LEU 94.A N ASP 90.A O no hydrogen 2.998 N/A SER 95.A N THR 91.A O no hydrogen 2.896 N/A SER 95.A OG THR 91.A O no hydrogen 2.752 N/A ARG 96.A N LEU 92.A O no hydrogen 3.012 N/A ARG 96.A NE ASP 104.A OD2 no hydrogen 2.814 N/A ARG 96.A NH2 ASP 104.A OD1 no hydrogen 3.426 N/A ARG 96.A NH2 ASP 104.A OD2 no hydrogen 3.482 N/A ARG 96.A NH2 ASP 106.A OD1 no hydrogen 3.130 N/A LEU 97.A N VAL 93.A O no hydrogen 3.265 N/A LEU 97.A N LEU 94.A O no hydrogen 3.161 N/A ILE 98.A N LEU 94.A O no hydrogen 2.937 N/A HIS 99.A N SER 95.A O no hydrogen 2.738 N/A LEU 102.A N HIS 99.A O no hydrogen 3.121 N/A GLY 108.A N THR 105.A OG1 no hydrogen 3.147 N/A LEU 109.A N THR 105.A O no hydrogen 3.052 N/A LEU 110.A N THR 105.A O no hydrogen 3.015 N/A LYS 114.A N ARG 111.A O no hydrogen 2.896 N/A LEU 115.A N SER 112.A O no hydrogen 3.123 N/A TRP 122.A N GLU 120.A OE2 no hydrogen 2.805 N/A GLY 123.A N GLU 120.A OE1 no hydrogen 2.445 N/A TYR 124.A N GLU 120.A O no hydrogen 2.843 N/A ARG 125.A N ALA 121.A O no hydrogen 3.008 N/A ARG 125.A NH1 ARG 125.A O no hydrogen 3.101 N/A LEU 126.A N TRP 122.A O no hydrogen 3.112 N/A GLY 127.A N GLY 123.A O no hydrogen 3.104 N/A GLU 128.A N TYR 124.A O no hydrogen 3.061 N/A GLU 128.A N ARG 125.A O no hydrogen 3.342 N/A GLU 132.A N GLU 128.A O no hydrogen 2.953 N/A GLU 132.A N MET 129.A O no hydrogen 2.989 N/A TYR 133.A N MET 129.A O no hydrogen 2.718 N/A TYR 133.A OH GLU 153.A O no hydrogen 2.597 N/A LYS 134.A N LYS 130.A O no hydrogen 2.900 N/A ASP 135.A N GLY 131.A O no hydrogen 3.310 N/A ASP 135.A N GLU 132.A O no hydrogen 3.041 N/A ASP 136.A N GLU 132.A O no hydrogen 3.030 N/A PHE 137.A N TYR 133.A O no hydrogen 3.022 N/A LYS 138.A N LYS 134.A O no hydrogen 3.101 N/A ARG 139.A N ASP 135.A O no hydrogen 3.184 N/A MET 140.A N ASP 136.A O no hydrogen 3.031 N/A LEU 141.A N PHE 137.A O no hydrogen 3.108 N/A GLU 142.A N LYS 138.A O no hydrogen 2.670 N/A GLU 143.A N ARG 139.A O no hydrogen 2.848 N/A GLN 144.A N MET 140.A O no hydrogen 3.345 N/A GLU 146.A N LEU 141.A O no hydrogen 3.121 N/A TYR 148.A OH ASP 150.A O no hydrogen 2.616 N/A TYR 148.A OH GLU 153.A OE1 no hydrogen 2.437 N/A MET 152.A N VAL 149.A O no hydrogen 3.300 N/A GLU 153.A N GLU 153.A OE1 no hydrogen 2.929 N/A TRP 154.A N GLY 151.A O no hydrogen 2.955 N/A TRP 155.A N MET 152.A O no hydrogen 3.220 N/A ASN 158.A ND2 TYR 133.A OH no hydrogen 2.858 N/A MET 161.A N ASN 158.A OD1 no hydrogen 2.758 N/A MET 162.A N ASN 158.A O no hydrogen 3.324 N/A ASP 163.A N GLU 159.A O no hydrogen 3.039 N/A TYR 164.A N GLU 160.A O no hydrogen 3.053 N/A TYR 164.A OH ASP 136.A OD1 no hydrogen 2.781 N/A ASN 165.A N MET 161.A O no hydrogen 3.039 N/A ASN 165.A ND2 ASP 5.A O no hydrogen 3.244 N/A VAL 166.A N MET 162.A O no hydrogen 2.998 N/A GLN 167.A N ASP 163.A O no hydrogen 3.148 N/A ASP 168.A N TYR 164.A O no hydrogen 2.839 N/A VAL 169.A N ASN 165.A O no hydrogen 3.268 N/A VAL 170.A N VAL 166.A O no hydrogen 3.221 N/A VAL 171.A N GLN 167.A O no hydrogen 3.062 N/A THR 172.A N ASP 168.A O no hydrogen 2.851 N/A THR 172.A OG1 ASP 168.A O no hydrogen 2.682 N/A LYS 173.A N VAL 169.A O no hydrogen 2.996 N/A LYS 173.A NZ GLU 177.A OE2 no hydrogen 2.790 N/A ALA 174.A N VAL 170.A O no hydrogen 3.057 N/A LEU 175.A N VAL 171.A O no hydrogen 2.774 N/A LEU 176.A N THR 172.A O no hydrogen 2.875 N/A GLU 177.A N LYS 173.A O no hydrogen 3.144 N/A LYS 178.A N ALA 174.A O no hydrogen 3.029 N/A LEU 179.A N LEU 175.A O no hydrogen 2.782 N/A LEU 180.A N LEU 176.A O no hydrogen 2.811 N/A SER 181.A N LYS 178.A O no hydrogen 3.358 N/A SER 181.A OG LYS 178.A O no hydrogen 2.685 N/A ASP 182.A N LEU 179.A O no hydrogen 3.259 N/A HIS 184.A N ASP 182.A OD1 no hydrogen 2.853 N/A HIS 184.A NE2 GLY 575.A O no hydrogen 2.560 N/A TYR 185.A N ASP 182.A O no hydrogen 3.150 N/A PHE 186.A N ASP 182.A O no hydrogen 2.969 N/A ILE 190.A N PRO 187.A O no hydrogen 3.350 N/A THR 193.A N ASP 191.A OD1 no hydrogen 2.975 N/A THR 193.A OG1 ASP 191.A OD1 no hydrogen 2.537 N/A THR 193.A OG1 ASP 191.A OD2 no hydrogen 3.517 N/A ASP 194.A N ASP 191.A O no hydrogen 3.264 N/A TYR 197.A N GLY 53.A O no hydrogen 3.096 N/A PHE 200.A N GLY 196.A O no hydrogen 3.116 N/A TRP 201.A N TYR 197.A O no hydrogen 3.032 N/A TRP 201.A NE1 GLU 86.A O no hydrogen 2.722 N/A SER 202.A N THR 198.A O no hydrogen 3.052 N/A SER 202.A OG THR 198.A O no hydrogen 2.750 N/A SER 202.A OG THR 199.A O no hydrogen 3.165 N/A GLU 203.A N THR 199.A O no hydrogen 2.715 N/A SER 204.A OG PHE 200.A O no hydrogen 2.874 N/A LEU 205.A N TYR 185.A O no hydrogen 3.020 N/A VAL 208.A N LEU 205.A O no hydrogen 3.008 N/A ILE 210.A N GLU 206.A O no hydrogen 3.135 N/A GLU 211.A N ALA 207.A O no hydrogen 2.933 N/A HIS 212.A N VAL 208.A O no hydrogen 3.257 N/A HIS 212.A ND1 VAL 208.A O no hydrogen 2.917 N/A ARG 213.A N ASP 209.A O no hydrogen 3.014 N/A ARG 213.A NE ASP 209.A OD1 no hydrogen 3.213 N/A ARG 213.A NE ASP 209.A OD2 no hydrogen 3.462 N/A ALA 214.A N ILE 210.A O no hydrogen 2.914 N/A ALA 215.A N GLU 211.A O no hydrogen 2.954 N/A TRP 216.A N HIS 212.A O no hydrogen 3.151 N/A LEU 217.A N ARG 213.A O no hydrogen 2.992 N/A LEU 218.A N ALA 214.A O no hydrogen 2.819 N/A ALA 219.A N ALA 215.A O no hydrogen 2.929 N/A LYS 220.A N TRP 216.A O no hydrogen 3.274 N/A LYS 220.A NZ HIS 617.A O no hydrogen 2.648 N/A GLN 221.A N LEU 217.A O no hydrogen 3.028 N/A GLU 222.A N LEU 218.A O no hydrogen 2.974 N/A ARG 223.A N ALA 219.A O no hydrogen 3.090 N/A ASN 224.A N LYS 220.A O no hydrogen 2.878 N/A ASN 224.A ND2 HIS 617.A NE2 no hydrogen 3.235 N/A ASN 224.A ND2 TYR 625.A O no hydrogen 2.985 N/A GLY 225.A N GLN 221.A O no hydrogen 2.999 N/A PHE 226.A N ILE 404.A O no hydrogen 3.003 N/A PHE 228.A N GLY 402.A O no hydrogen 3.030 N/A ASP 229.A N ALA 442.A O no hydrogen 2.848 N/A LYS 231.A NZ GLU 234.A OE1 no hydrogen 3.109 N/A ALA 232.A N ASP 229.A OD1 no hydrogen 3.235 N/A ILE 233.A N ASP 229.A O no hydrogen 3.243 N/A GLU 234.A N THR 230.A O no hydrogen 2.932 N/A GLU 235.A N LYS 231.A O no hydrogen 2.921 N/A LEU 236.A N ALA 232.A O no hydrogen 2.994 N/A TYR 237.A N ILE 233.A O no hydrogen 2.859 N/A TYR 237.A OH GLU 389.A OE2 no hydrogen 2.824 N/A VAL 238.A N GLU 234.A O no hydrogen 3.109 N/A GLU 239.A N GLU 235.A O no hydrogen 3.303 N/A LEU 240.A N LEU 236.A O no hydrogen 2.906 N/A ALA 241.A N TYR 237.A O no hydrogen 2.730 N/A ALA 242.A N VAL 238.A O no hydrogen 3.029 N/A ARG 243.A N GLU 239.A O no hydrogen 3.089 N/A ARG 243.A NE GLU 376.A OE2 no hydrogen 3.005 N/A ARG 243.A NH2 GLU 376.A OE1 no hydrogen 2.621 N/A ARG 243.A NH2 GLU 376.A OE2 no hydrogen 3.320 N/A ARG 244.A N LEU 240.A O no hydrogen 2.890 N/A ARG 244.A NH1 GLN 381.A OE1 no hydrogen 2.962 N/A ARG 244.A NH1 GLU 389.A OE1 no hydrogen 2.952 N/A ARG 244.A NH2 GLU 389.A OE2 no hydrogen 3.337 N/A SER 245.A N ALA 241.A O no hydrogen 2.928 N/A SER 245.A OG ALA 241.A O no hydrogen 3.214 N/A GLU 246.A N ALA 242.A O no hydrogen 2.998 N/A LEU 247.A N ARG 243.A O no hydrogen 2.965 N/A LEU 248.A N ARG 244.A O no hydrogen 2.962 N/A ARG 249.A N SER 245.A O no hydrogen 2.988 N/A ARG 249.A NE GLU 246.A OE1 no hydrogen 3.248 N/A ARG 249.A NE GLU 246.A OE2 no hydrogen 3.147 N/A ARG 249.A NH2 GLU 246.A OE2 no hydrogen 2.608 N/A LYS 250.A N GLU 246.A O no hydrogen 3.129 N/A LEU 251.A N LEU 247.A O no hydrogen 2.995 N/A THR 252.A N LEU 248.A O no hydrogen 2.810 N/A THR 252.A OG1 LEU 248.A O no hydrogen 3.194 N/A THR 252.A OG1 ARG 249.A O no hydrogen 2.995 N/A GLU 253.A N ARG 249.A O no hydrogen 3.278 N/A THR 254.A N LYS 250.A O no hydrogen 3.197 N/A THR 254.A OG1 LYS 250.A O no hydrogen 3.038 N/A PHE 255.A N LEU 251.A O no hydrogen 2.891 N/A SER 257.A OG HIS 319.A NE2 no hydrogen 2.664 N/A TRP 258.A N VAL 320.A O no hydrogen 3.022 N/A TRP 258.A NE1 GLN 260.A OE1 no hydrogen 3.227 N/A GLN 260.A N GLU 318.A O no hydrogen 3.029 N/A LYS 262.A N PRO 316.A O no hydrogen 2.835 N/A LYS 262.A NZ GLU 318.A OE2 no hydrogen 2.611 N/A THR 265.A N ILE 283.A O no hydrogen 3.077 N/A CYS 269.A SG MET 267.A O no hydrogen 3.561 N/A HIS 270.A N LYS 275.A O no hydrogen 3.085 N/A LEU 277.A N PHE 268.A O no hydrogen 2.891 N/A TYR 280.A N LEU 277.A O no hydrogen 3.043 N/A ARG 282.A NH2 TYR 280.A O no hydrogen 3.149 N/A ILE 283.A N GLU 266.A O no hydrogen 2.981 N/A LYS 284.A N TYR 314.A O no hydrogen 3.085 N/A THR 285.A N GLU 266.A OE1 no hydrogen 3.167 N/A THR 285.A OG1 GLU 266.A OE2 no hydrogen 2.756 N/A LYS 293.A N GLU 302.A O no hydrogen 2.803 N/A ASP 304.A N ILE 291.A O no hydrogen 3.036 N/A ARG 306.A N ASP 304.A OD2 no hydrogen 2.989 N/A ALA 310.A N GLY 289.A O no hydrogen 3.209 N/A GLY 311.A N PRO 286.A O no hydrogen 3.200 N/A ALA 312.A N VAL 309.A O no hydrogen 2.771 N/A TYR 314.A N LYS 284.A O no hydrogen 3.238 N/A GLU 318.A N GLN 260.A O no hydrogen 2.775 N/A VAL 320.A N TRP 258.A O no hydrogen 2.844 N/A ASN 323.A N HIS 329.A ND1 no hydrogen 3.125 N/A SER 325.A N ASN 323.A OD1 no hydrogen 2.766 N/A SER 326.A N ASN 323.A O no hydrogen 2.938 N/A ARG 327.A NH1 VAL 352.A O no hydrogen 2.833 N/A HIS 329.A N SER 326.A OG no hydrogen 3.195 N/A ILE 330.A N SER 326.A O no hydrogen 3.067 N/A GLN 331.A N ARG 327.A O no hydrogen 2.934 N/A LYS 332.A N ASP 328.A O no hydrogen 2.728 N/A LYS 333.A N HIS 329.A O no hydrogen 2.953 N/A LYS 333.A NZ GLY 256.A O no hydrogen 2.863 N/A LEU 334.A N ILE 330.A O no hydrogen 3.071 N/A GLN 335.A N GLN 331.A O no hydrogen 3.397 N/A GLN 335.A NE2 GLN 331.A OE1 no hydrogen 2.566 N/A GLU 336.A N LYS 332.A O no hydrogen 3.441 N/A ALA 337.A N LEU 334.A O no hydrogen 3.256 N/A GLY 338.A N GLN 335.A O no hydrogen 2.742 N/A TRP 339.A N LEU 334.A O no hydrogen 2.954 N/A THR 345.A N ALA 349.A O no hydrogen 2.520 N/A THR 345.A OG1 ALA 349.A O no hydrogen 2.810 N/A LYS 347.A N THR 345.A O no hydrogen 2.450 N/A VAL 351.A N LYS 343.A O no hydrogen 2.941 N/A VAL 356.A N ASP 353.A OD1 no hydrogen 2.778 N/A LEU 357.A N ASP 353.A O no hydrogen 2.890 N/A GLU 358.A N ASP 354.A O no hydrogen 3.096 N/A GLY 359.A N VAL 356.A O no hydrogen 2.765 N/A ARG 361.A NH1 GLU 358.A O no hydrogen 3.281 N/A ARG 361.A NH1 VAL 360.A O no hydrogen 3.119 N/A VAL 362.A N GLN 368.A OE1 no hydrogen 2.623 N/A LYS 367.A N ASP 364.A OD2 no hydrogen 2.782 N/A GLN 368.A N ASP 364.A O no hydrogen 3.056 N/A GLN 368.A NE2 VAL 360.A O no hydrogen 2.877 N/A GLN 368.A NE2 GLN 368.A O no hydrogen 3.388 N/A ALA 369.A N PRO 365.A O no hydrogen 3.081 N/A ALA 370.A N GLU 366.A O no hydrogen 3.051 N/A ASP 372.A N ALA 369.A O no hydrogen 3.235 N/A ILE 374.A N ALA 370.A O no hydrogen 2.822 N/A LYS 375.A N ILE 371.A O no hydrogen 2.934 N/A LYS 375.A NZ ASP 372.A OD1 no hydrogen 3.178 N/A GLU 376.A N ASP 372.A O no hydrogen 3.116 N/A TYR 377.A N LEU 373.A O no hydrogen 2.931 N/A LEU 378.A N ILE 374.A O no hydrogen 2.979 N/A MET 379.A N LYS 375.A O no hydrogen 3.227 N/A ILE 380.A N GLU 376.A O no hydrogen 3.003 N/A GLN 381.A N TYR 377.A O no hydrogen 3.065 N/A GLN 381.A NE2 SER 325.A OG no hydrogen 3.218 N/A LYS 382.A N LEU 378.A O no hydrogen 3.080 N/A ARG 383.A N MET 379.A O no hydrogen 3.078 N/A ARG 383.A NE PRO 434.A O no hydrogen 2.915 N/A ARG 383.A NH2 PRO 434.A O no hydrogen 3.387 N/A ILE 384.A N ILE 380.A O no hydrogen 2.895 N/A GLY 385.A N GLN 381.A O no hydrogen 2.814 N/A GLN 386.A N LYS 382.A O no hydrogen 3.019 N/A GLN 386.A NE2 GLN 427.A O no hydrogen 2.861 N/A SER 387.A N ARG 383.A O no hydrogen 3.053 N/A SER 387.A OG ARG 383.A O no hydrogen 3.010 N/A ALA 388.A N ILE 384.A O no hydrogen 2.864 N/A GLU 389.A N ILE 384.A O no hydrogen 2.987 N/A GLY 390.A N GLY 385.A O no hydrogen 2.773 N/A ALA 393.A N GLY 390.A O no hydrogen 3.185 N/A TRP 394.A N GLN 386.A O no hydrogen 3.180 N/A LEU 395.A N SER 387.A O no hydrogen 3.177 N/A ARG 396.A N ALA 393.A O no hydrogen 3.117 N/A ARG 396.A NE GLY 390.A O no hydrogen 2.658 N/A ARG 396.A NH2 GLU 389.A O no hydrogen 3.251 N/A TYR 397.A N TRP 394.A O no hydrogen 2.983 N/A VAL 398.A N TRP 394.A O no hydrogen 3.112 N/A ALA 399.A N LYS 403.A O no hydrogen 2.873 N/A GLY 402.A N ALA 399.A O no hydrogen 2.949 N/A LYS 403.A N ASP 401.A OD1 no hydrogen 3.188 N/A LYS 403.A NZ ASP 401.A O no hydrogen 3.338 N/A LYS 403.A NZ HIS 448.A ND1 no hydrogen 3.131 N/A ILE 404.A N PHE 226.A O no hydrogen 3.114 N/A HIS 405.A ND1 GLU 222.A O no hydrogen 2.685 N/A SER 407.A N ALA 421.A O no hydrogen 2.844 N/A VAL 408.A N GLU 222.A OE2 no hydrogen 2.766 N/A ASN 409.A N THR 419.A O no hydrogen 2.872 N/A ASN 411.A N ASN 409.A OD1 no hydrogen 3.082 N/A ASN 411.A ND2 ARG 96.A O no hydrogen 3.058 N/A GLY 412.A N ASN 409.A O no hydrogen 3.134 N/A ALA 413.A N ARG 417.A O no hydrogen 3.032 N/A GLY 416.A N ALA 413.A O no hydrogen 2.869 N/A THR 419.A N ASN 409.A O no hydrogen 3.052 N/A HIS 420.A NE2 TRP 628.A O no hydrogen 2.620 N/A ALA 421.A N SER 407.A O no hydrogen 3.078 N/A ALA 426.A N ASN 424.A OD1 no hydrogen 2.659 N/A GLN 427.A N ASN 424.A O no hydrogen 3.221 N/A SER 433.A N GLY 430.A O no hydrogen 3.040 N/A SER 433.A OG GLY 430.A O no hydrogen 3.084 N/A GLY 436.A N SER 433.A O no hydrogen 2.940 N/A CYS 439.A N TYR 435.A O no hydrogen 3.077 N/A CYS 439.A SG TYR 435.A O no hydrogen 3.156 N/A ARG 440.A N GLY 436.A O no hydrogen 2.837 N/A ALA 441.A N GLU 437.A O no hydrogen 2.929 N/A ALA 442.A N CYS 439.A O no hydrogen 3.182 N/A PHE 443.A N ARG 440.A O no hydrogen 3.169 N/A GLY 444.A N PRO 227.A O no hydrogen 3.123 N/A ALA 445.A N GLN 459.A OE1 no hydrogen 2.935 N/A GLU 446.A N PRO 675.A O no hydrogen 3.031 N/A HIS 447.A N GLY 444.A O no hydrogen 3.041 N/A HIS 447.A NE2 ALA 441.A O no hydrogen 2.876 N/A HIS 448.A N ALA 445.A O no hydrogen 2.965 N/A ASP 450.A N LYS 455.A O no hydrogen 2.803 N/A ILE 452.A N ASP 450.A OD2 no hydrogen 2.995 N/A THR 453.A N ASP 450.A OD2 no hydrogen 3.066 N/A THR 453.A OG1 ASP 450.A OD2 no hydrogen 3.527 N/A GLY 454.A N ASP 450.A O no hydrogen 2.837 N/A LYS 455.A N THR 453.A OG1 no hydrogen 3.314 N/A TRP 457.A N HIS 448.A O no hydrogen 3.124 N/A TRP 457.A NE1 ASP 450.A OD1 no hydrogen 3.016 N/A VAL 458.A N CYS 637.A O no hydrogen 2.861 N/A GLN 459.A N GLY 674.A O no hydrogen 2.760 N/A GLN 459.A NE2 GLN 634.A OE1 no hydrogen 2.737 N/A ALA 460.A N VAL 635.A O no hydrogen 2.833 N/A GLY 461.A N LYS 672.A O no hydrogen 2.747 N/A ILE 462.A N ILE 633.A O no hydrogen 3.053 N/A ASP 463.A N GLU 670.A O no hydrogen 2.889 N/A ALA 464.A N ASP 631.A O no hydrogen 3.005 N/A SER 465.A N ASP 668.A O no hydrogen 3.062 N/A ARG 470.A N GLY 466.A O no hydrogen 3.280 N/A ARG 470.A NH1 LEU 666.A O no hydrogen 2.703 N/A ARG 470.A NH1 ASP 668.A OD2 no hydrogen 2.980 N/A CYS 471.A N LEU 467.A O no hydrogen 3.011 N/A CYS 471.A SG LEU 467.A O no hydrogen 3.215 N/A LEU 472.A N GLU 468.A O no hydrogen 2.970 N/A ALA 473.A N LEU 469.A O no hydrogen 2.834 N/A HIS 474.A N ARG 470.A O no hydrogen 2.858 N/A PHE 475.A N CYS 471.A O no hydrogen 3.082 N/A MET 476.A N LEU 472.A O no hydrogen 3.072 N/A MET 476.A N ALA 473.A O no hydrogen 3.273 N/A ALA 477.A N HIS 474.A O no hydrogen 3.276 N/A PHE 479.A N MET 476.A O no hydrogen 2.837 N/A ASP 480.A N MET 476.A O no hydrogen 2.904 N/A ASN 481.A N ALA 477.A O no hydrogen 2.723 N/A GLY 482.A N ASP 480.A OD1 no hydrogen 3.090 N/A GLU 483.A N ASP 480.A O no hydrogen 3.344 N/A TYR 484.A N ASP 480.A OD2 no hydrogen 2.864 N/A TYR 484.A OH ASN 497.A OD1 no hydrogen 2.785 N/A HIS 486.A N GLY 482.A O no hydrogen 2.729 N/A GLU 487.A N GLU 483.A O no hydrogen 2.945 N/A ILE 488.A N TYR 484.A O no hydrogen 3.134 N/A LEU 489.A N ALA 485.A O no hydrogen 3.367 N/A ASN 490.A N GLU 487.A O no hydrogen 3.401 N/A ASN 490.A ND2 HIS 486.A O no hydrogen 3.109 N/A THR 495.A N ASP 492.A OD2 no hydrogen 3.408 N/A THR 495.A OG1 ASP 492.A O no hydrogen 3.438 N/A THR 495.A OG1 ASP 492.A OD2 no hydrogen 3.237 N/A LYS 496.A N ASP 492.A O no hydrogen 3.321 N/A ASN 497.A N ILE 493.A O no hydrogen 2.954 N/A ASN 497.A ND2 TYR 484.A OH no hydrogen 2.945 N/A GLN 498.A N HIS 494.A O no hydrogen 2.850 N/A ILE 499.A N THR 495.A O no hydrogen 2.910 N/A ALA 500.A N LYS 496.A O no hydrogen 3.187 N/A ALA 501.A N ASN 497.A O no hydrogen 2.791 N/A THR 505.A OG1 ASN 508.A OD1 no hydrogen 2.389 N/A ARG 506.A NE ASP 492.A OD2 no hydrogen 3.126 N/A ARG 506.A NH2 ASP 492.A OD1 no hydrogen 2.908 N/A ASN 508.A N THR 505.A O no hydrogen 2.883 N/A ASN 508.A N THR 505.A OG1 no hydrogen 3.013 N/A ASN 508.A ND2 ILE 528.A O no hydrogen 2.955 N/A ALA 509.A N ARG 506.A O no hydrogen 2.677 N/A LYS 510.A N ARG 506.A O no hydrogen 3.174 N/A THR 511.A N ASP 507.A O no hydrogen 3.040 N/A THR 511.A OG1 ASP 507.A O no hydrogen 3.447 N/A PHE 512.A N ASN 508.A O no hydrogen 2.786 N/A ILE 513.A N ALA 509.A O no hydrogen 2.835 N/A GLY 515.A N THR 511.A O no hydrogen 3.127 N/A PHE 516.A N PHE 512.A O no hydrogen 2.885 N/A LEU 517.A N ILE 513.A O no hydrogen 2.798 N/A GLY 519.A N PHE 516.A O no hydrogen 3.203 N/A ALA 520.A N GLY 515.A O no hydrogen 2.639 N/A ILE 525.A N GLY 521.A O no hydrogen 3.257 N/A GLY 526.A N ASP 522.A O no hydrogen 3.011 N/A GLN 527.A N GLU 523.A O no hydrogen 2.927 N/A ILE 528.A N ILE 525.A O no hydrogen 3.488 N/A VAL 529.A N GLY 526.A O no hydrogen 3.031 N/A GLU 534.A N GLY 532.A O no hydrogen 2.525 N/A GLU 538.A N GLU 534.A O no hydrogen 3.327 N/A LEU 539.A N ARG 535.A O no hydrogen 2.811 N/A LYS 540.A N GLY 536.A O no hydrogen 3.248 N/A LYS 540.A NZ ALA 520.A O no hydrogen 3.023 N/A LYS 541.A N LYS 537.A O no hydrogen 3.231 N/A LYS 541.A N GLU 538.A O no hydrogen 3.004 N/A LYS 542.A N GLU 538.A O no hydrogen 2.965 N/A LYS 542.A NZ GLU 502.A OE2 no hydrogen 3.355 N/A PHE 543.A N LEU 539.A O no hydrogen 2.720 N/A LEU 544.A N LYS 540.A O no hydrogen 3.402 N/A GLU 545.A N LYS 541.A O no hydrogen 3.199 N/A ASN 546.A N LYS 542.A O no hydrogen 3.315 N/A ASN 546.A N PHE 543.A O no hydrogen 3.264 N/A ASN 546.A ND2 ALA 500.A O no hydrogen 3.130 N/A ASN 546.A ND2 LYS 542.A O no hydrogen 2.890 N/A THR 547.A N LEU 544.A O no hydrogen 2.967 N/A THR 547.A OG1 PHE 543.A O no hydrogen 3.061 N/A ILE 550.A N THR 547.A O no hydrogen 3.040 N/A ALA 552.A N PRO 548.A O no hydrogen 2.860 N/A LEU 553.A N ALA 549.A O no hydrogen 3.017 N/A ARG 554.A N ILE 550.A O no hydrogen 2.860 N/A GLU 555.A N ALA 551.A O no hydrogen 3.003 N/A SER 556.A N ALA 552.A O no hydrogen 2.957 N/A SER 556.A OG ALA 552.A O no hydrogen 3.519 N/A SER 556.A OG LEU 553.A O no hydrogen 3.080 N/A ILE 557.A N LEU 553.A O no hydrogen 3.136 N/A GLN 558.A N ARG 554.A O no hydrogen 3.199 N/A GLN 559.A N GLU 555.A O no hydrogen 3.123 N/A THR 560.A N SER 556.A O no hydrogen 3.160 N/A THR 560.A OG1 SER 556.A O no hydrogen 3.487 N/A LEU 561.A N ILE 557.A O no hydrogen 3.219 N/A LEU 561.A N GLN 558.A O no hydrogen 3.225 N/A VAL 562.A N GLN 558.A O no hydrogen 2.731 N/A LYS 566.A N LEU 561.A O no hydrogen 2.584 N/A LYS 566.A NZ GLN 559.A O no hydrogen 2.608 N/A LYS 566.A NZ VAL 562.A O no hydrogen 3.386 N/A ARG 568.A NE VAL 580.A O no hydrogen 3.317 N/A ARG 568.A NH2 ARG 581.A O no hydrogen 2.845 N/A ILE 570.A N VAL 578.A O no hydrogen 2.922 N/A GLY 572.A N ARG 576.A O no hydrogen 2.779 N/A GLY 575.A N GLY 572.A O no hydrogen 2.847 N/A ARG 576.A N ASP 574.A OD1 no hydrogen 3.148 N/A ARG 576.A NH1 GLU 211.A OE2 no hydrogen 3.004 N/A ARG 576.A NH1 ASP 574.A OD2 no hydrogen 2.568 N/A ARG 576.A NH2 GLU 211.A OE2 no hydrogen 2.677 N/A LYS 577.A N TYR 185.A OH no hydrogen 3.209 N/A VAL 578.A N ILE 570.A O no hydrogen 2.633 N/A VAL 580.A N ARG 568.A O no hydrogen 3.070 N/A ALA 585.A N SER 582.A O no hydrogen 2.701 N/A ALA 586.A N PRO 583.A O no hydrogen 3.123 N/A ASN 588.A ND2 LEU 517.A O no hydrogen 2.742 N/A THR 589.A N ALA 585.A O no hydrogen 2.941 N/A THR 589.A OG1 ALA 585.A O no hydrogen 2.792 N/A LEU 590.A N ALA 586.A O no hydrogen 2.866 N/A LEU 591.A N LEU 587.A O no hydrogen 2.896 N/A GLN 592.A N ASN 588.A O no hydrogen 2.881 N/A SER 593.A N THR 589.A O no hydrogen 2.842 N/A SER 593.A OG THR 415.A O no hydrogen 3.232 N/A ALA 594.A N LEU 590.A O no hydrogen 3.030 N/A GLY 595.A N LEU 591.A O no hydrogen 3.136 N/A ALA 596.A N GLN 592.A O no hydrogen 3.184 N/A LEU 597.A N SER 593.A O no hydrogen 3.028 N/A ILE 598.A N ALA 594.A O no hydrogen 2.874 N/A CYS 599.A N GLY 595.A O no hydrogen 2.795 N/A CYS 599.A SG GLY 595.A O no hydrogen 3.353 N/A CYS 599.A SG HIS 630.A O no hydrogen 3.231 N/A LYS 600.A N ALA 596.A O no hydrogen 2.984 N/A LYS 600.A NZ GLU 211.A OE1 no hydrogen 3.429 N/A LYS 600.A NZ GLU 211.A OE2 no hydrogen 2.853 N/A LYS 600.A NZ PRO 410.A O no hydrogen 2.976 N/A LYS 600.A NZ GLY 416.A O no hydrogen 2.851 N/A LEU 601.A N LEU 597.A O no hydrogen 3.031 N/A TRP 602.A N ILE 598.A O no hydrogen 2.937 N/A TRP 602.A NE1 ALA 650.A O no hydrogen 2.950 N/A ILE 603.A N CYS 599.A O no hydrogen 3.133 N/A ILE 604.A N LYS 600.A O no hydrogen 3.261 N/A LYS 605.A N LEU 601.A O no hydrogen 2.838 N/A LYS 605.A NZ GLU 608.A OE1 no hydrogen 3.538 N/A THR 606.A N TRP 602.A O no hydrogen 2.868 N/A THR 606.A OG1 TRP 602.A O no hydrogen 2.841 N/A GLU 607.A N ILE 603.A O no hydrogen 3.238 N/A GLU 608.A N ILE 604.A O no hydrogen 3.069 N/A MET 609.A N LYS 605.A O no hydrogen 2.948 N/A LEU 610.A N THR 606.A O no hydrogen 2.997 N/A VAL 611.A N GLU 607.A O no hydrogen 3.014 N/A GLU 612.A N GLU 608.A O no hydrogen 3.123 N/A LYS 613.A N LEU 610.A O no hydrogen 3.032 N/A LYS 613.A NZ THR 649.A OG1 no hydrogen 2.688 N/A LYS 613.A NZ GLU 652.A OE2 no hydrogen 3.247 N/A GLY 614.A N VAL 611.A O no hydrogen 3.366 N/A LEU 615.A N LEU 610.A O no hydrogen 3.148 N/A LYS 616.A N ASP 622.A OD2 no hydrogen 3.003 N/A HIS 617.A ND1 GLU 607.A OE2 no hydrogen 2.663 N/A GLY 618.A N PHE 623.A O no hydrogen 2.791 N/A TRP 619.A NE1 ASN 224.A O no hydrogen 2.744 N/A ASP 620.A N ASP 620.A OD1 no hydrogen 2.589 N/A GLY 621.A N GLY 618.A O no hydrogen 2.958 N/A ASP 622.A N LYS 616.A O no hydrogen 2.893 N/A PHE 623.A N LYS 616.A O no hydrogen 3.418 N/A ALA 624.A N GLY 636.A O no hydrogen 2.690 N/A TYR 625.A N HIS 617.A NE2 no hydrogen 3.129 N/A TYR 625.A OH ILE 603.A O no hydrogen 2.872 N/A MET 626.A N GLN 634.A O no hydrogen 2.958 N/A ALA 627.A N GLN 634.A O no hydrogen 3.311 N/A TRP 628.A NE1 HIS 630.A O no hydrogen 3.057 N/A VAL 629.A N GLU 632.A O no hydrogen 2.801 N/A GLU 632.A N VAL 629.A O no hydrogen 3.283 N/A ILE 633.A N ILE 462.A O no hydrogen 3.044 N/A GLN 634.A N ALA 627.A O no hydrogen 2.816 N/A GLN 634.A NE2 GLU 632.A OE2 no hydrogen 2.907 N/A VAL 635.A N ALA 460.A O no hydrogen 2.942 N/A GLY 636.A N ALA 624.A O no hydrogen 2.735 N/A CYS 637.A N VAL 458.A O no hydrogen 2.736 N/A CYS 637.A SG VAL 635.A O no hydrogen 3.815 N/A ARG 638.A N ASP 622.A O no hydrogen 2.952 N/A ARG 638.A NE GLY 621.A O no hydrogen 3.188 N/A ARG 638.A NE ASP 622.A OD1 no hydrogen 3.389 N/A ARG 638.A NH2 ASP 622.A OD1 no hydrogen 2.737 N/A ILE 642.A N THR 639.A OG1 no hydrogen 3.117 N/A ALA 643.A N THR 639.A O no hydrogen 3.042 N/A GLN 644.A N GLU 640.A O no hydrogen 3.012 N/A VAL 645.A N GLU 641.A O no hydrogen 3.065 N/A VAL 646.A N ILE 642.A O no hydrogen 2.883 N/A ILE 647.A N ALA 643.A O no hydrogen 3.061 N/A GLU 648.A N GLN 644.A O no hydrogen 3.144 N/A THR 649.A N VAL 645.A O no hydrogen 2.768 N/A THR 649.A OG1 VAL 645.A O no hydrogen 2.554 N/A ALA 650.A N VAL 646.A O no hydrogen 2.859 N/A GLN 651.A N ILE 647.A O no hydrogen 3.307 N/A GLN 651.A NE2 ASP 668.A OD1 no hydrogen 2.868 N/A GLU 652.A N GLU 648.A O no hydrogen 3.168 N/A ALA 653.A N THR 649.A O no hydrogen 2.858 N/A MET 654.A N ALA 650.A O no hydrogen 2.933 N/A ARG 655.A N GLN 651.A O no hydrogen 3.088 N/A TRP 656.A N GLU 652.A O no hydrogen 2.924 N/A VAL 657.A N ALA 653.A O no hydrogen 2.924 N/A GLY 658.A N MET 654.A O no hydrogen 3.124 N/A ASP 659.A N ARG 655.A O no hydrogen 3.141 N/A HIS 660.A N TRP 656.A O no hydrogen 2.852 N/A HIS 660.A NE2 GLU 206.A OE2 no hydrogen 2.840 N/A TRP 661.A N VAL 657.A O no hydrogen 3.115 N/A TRP 661.A NE1 GLU 206.A OE1 no hydrogen 3.182 N/A ASN 662.A N ASP 659.A O no hydrogen 3.057 N/A PHE 663.A N GLY 658.A O no hydrogen 2.695 N/A ARG 664.A N HIS 474.A ND1 no hydrogen 2.787 N/A CYS 665.A SG LEU 666.A O no hydrogen 3.907 N/A THR 669.A N GLN 651.A OE1 no hydrogen 2.850 N/A THR 669.A OG1 GLN 651.A OE1 no hydrogen 2.578 N/A GLU 670.A N ASP 463.A O no hydrogen 2.974 N/A LYS 672.A N GLY 461.A O no hydrogen 2.752 N/A GLY 674.A N GLN 459.A O no hydrogen 3.016 N/A ASN 676.A ND2 GLU 446.A OE2 no hydrogen 2.776 N/A TRP 677.A N PHE 443.A O no hydrogen 2.858 N/A TRP 677.A NE1 GLU 632.A OE2 no hydrogen 3.023 N/A ILE 679.A N ASN 676.A OD1 no hydrogen 3.142 N/A CYS 680.A N ASN 676.A O no hydrogen 3.026 N/A CYS 680.A SG GLN 459.A O no hydrogen 3.476 N/A CYS 680.A SG LYS 672.A O no hydrogen 3.706 N/A CYS 680.A SG ASN 676.A O no hydrogen 3.456 N/A