Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2d5l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 12.A NE2 GLY 10.A O no hydrogen 3.604 N/A TRP 13.A NE1 GLN 369.A O no hydrogen 3.147 N/A MET 14.A N ASN 17.A O no hydrogen 3.011 N/A GLY 15.A N ALA 52.A O no hydrogen 2.838 N/A ASN 17.A N MET 14.A O no hydrogen 3.306 N/A ASN 17.A ND2 MET 14.A O no hydrogen 3.531 N/A TYR 18.A N ASN 29.A O no hydrogen 3.061 N/A VAL 19.A N GLN 12.A O no hydrogen 2.756 N/A PHE 20.A N VAL 27.A O no hydrogen 3.385 N/A GLU 22.A N ASP 25.A O no hydrogen 2.941 N/A ASP 24.A N GLU 22.A O no hydrogen 2.668 N/A LEU 26.A N PHE 34.A O no hydrogen 3.028 N/A VAL 27.A N PHE 20.A O no hydrogen 2.985 N/A PHE 28.A N THR 32.A O no hydrogen 3.018 N/A ASN 29.A N TYR 18.A O no hydrogen 3.164 N/A ASN 29.A ND2 TYR 18.A O no hydrogen 3.559 N/A THR 31.A OG1 ASN 29.A OD1 no hydrogen 3.390 N/A SER 35.A OG ASP 24.A OD2 no hydrogen 3.084 N/A ALA 36.A N ASP 24.A O no hydrogen 3.052 N/A ALA 37.A N SER 35.A OG no hydrogen 3.194 N/A LEU 39.A N SER 35.A O no hydrogen 3.149 N/A ASN 40.A N ALA 36.A O no hydrogen 2.820 N/A ALA 41.A N ALA 37.A O no hydrogen 2.712 N/A LEU 42.A N LEU 39.A O no hydrogen 2.605 N/A MET 43.A N ASN 40.A O no hydrogen 3.112 N/A ARG 48.A N VAL 58.A O no hydrogen 3.007 N/A ARG 48.A NH1 LEU 88.A O no hydrogen 3.368 N/A THR 49.A OG1 GLN 12.A OE1 no hydrogen 2.718 N/A LEU 50.A N LEU 56.A O no hydrogen 2.786 N/A ASP 51.A N LEU 56.A O no hydrogen 3.121 N/A ARG 54.A N ASP 51.A OD2 no hydrogen 3.301 N/A GLY 55.A N ALA 52.A O no hydrogen 3.144 N/A LEU 56.A N ASP 51.A O no hydrogen 3.077 N/A VAL 57.A N PHE 68.A O no hydrogen 2.893 N/A VAL 58.A N ARG 48.A O no hydrogen 2.869 N/A LEU 59.A N VAL 66.A O no hydrogen 2.726 N/A THR 61.A N GLY 64.A O no hydrogen 3.262 N/A LEU 65.A N PHE 79.A O no hydrogen 3.079 N/A VAL 66.A N LEU 59.A O no hydrogen 2.797 N/A GLY 67.A N TYR 77.A O no hydrogen 2.692 N/A PHE 68.A N VAL 57.A O no hydrogen 2.811 N/A ASP 69.A N LYS 74.A O no hydrogen 2.728 N/A MET 70.A N GLY 55.A O no hydrogen 2.909 N/A ALA 72.A N ASP 69.A OD1 no hydrogen 2.861 N/A LYS 74.A N ASP 69.A O no hydrogen 3.155 N/A THR 76.A N GLY 67.A O no hydrogen 2.872 N/A TYR 77.A N THR 76.A OG1 no hydrogen 2.699 N/A LEU 78.A N GLY 111.A O no hydrogen 2.846 N/A PHE 79.A N LEU 65.A O no hydrogen 2.975 N/A THR 81.A OG1 GLU 84.A O no hydrogen 2.608 N/A ASN 82.A N ASP 80.A OD2 no hydrogen 2.988 N/A GLU 84.A N THR 81.A O no hydrogen 2.999 N/A SER 87.A N GLU 84.A OE2 no hydrogen 2.891 N/A SER 87.A OG GLU 84.A OE2 no hydrogen 2.835 N/A SER 87.A OG VAL 100.A O no hydrogen 3.431 N/A LEU 88.A N THR 85.A O no hydrogen 3.510 N/A ASP 89.A N ALA 98.A O no hydrogen 2.949 N/A SER 91.A N ARG 96.A O no hydrogen 2.857 N/A VAL 93.A N SER 91.A OG no hydrogen 3.034 N/A GLY 94.A N SER 91.A O no hydrogen 2.800 N/A VAL 97.A N ALA 108.A O no hydrogen 2.822 N/A ALA 98.A N ASP 89.A O no hydrogen 2.894 N/A TYR 99.A N TYR 106.A O no hydrogen 2.956 N/A VAL 100.A N SER 87.A OG no hydrogen 2.756 N/A ARG 101.A N ASN 104.A O no hydrogen 2.940 N/A ASN 104.A N ARG 101.A O no hydrogen 3.188 N/A LEU 105.A N THR 124.A OG1 no hydrogen 3.010 N/A TYR 106.A N TYR 99.A O no hydrogen 2.771 N/A ILE 107.A N ILE 121.A O no hydrogen 2.924 N/A ALA 108.A N VAL 97.A O no hydrogen 2.742 N/A GLY 110.A N ASP 95.A O no hydrogen 2.837 N/A GLY 111.A N LEU 78.A O no hydrogen 2.918 N/A GLU 115.A N LYS 112.A O no hydrogen 2.751 N/A ILE 121.A N ILE 107.A O no hydrogen 2.828 N/A VAL 123.A N LEU 105.A O no hydrogen 2.855 N/A THR 124.A N LEU 105.A O no hydrogen 3.474 N/A THR 124.A OG1 ASN 104.A OD1 no hydrogen 3.026 N/A GLY 127.A N ASN 104.A OD1 no hydrogen 2.836 N/A THR 128.A N LEU 131.A O no hydrogen 2.967 N/A THR 128.A OG1 ASP 126.A O no hydrogen 3.384 N/A LEU 131.A N THR 128.A O no hydrogen 3.092 N/A VAL 132.A N MET 162.A O no hydrogen 2.823 N/A TYR 133.A OH ASP 126.A OD1 no hydrogen 2.717 N/A GLY 134.A N TYR 160.A O no hydrogen 2.933 N/A HIS 138.A ND1 HIS 195.A NE2 no hydrogen 2.965 N/A ARG 140.A N VAL 137.A O no hydrogen 3.034 N/A GLU 141.A N HIS 138.A O no hydrogen 3.045 N/A ILE 144.A N GLU 141.A O no hydrogen 3.120 N/A LYS 146.A NZ ASP 89.A OD1 no hydrogen 3.018 N/A LYS 146.A NZ THR 148.A O no hydrogen 3.091 N/A THR 148.A OG1 ASP 89.A OD1 no hydrogen 2.580 N/A PHE 149.A N ALA 158.A O no hydrogen 2.782 N/A TRP 150.A NE1 ASP 89.A O no hydrogen 2.857 N/A SER 151.A N CYS 156.A O no hydrogen 2.880 N/A SER 151.A OG CYS 156.A O no hydrogen 3.296 N/A SER 151.A OG GLU 231.A OE2 no hydrogen 2.515 N/A LYS 153.A N GLU 231.A OE2 no hydrogen 2.771 N/A GLY 154.A N SER 151.A O no hydrogen 2.862 N/A SER 155.A N GLU 231.A OE2 no hydrogen 3.278 N/A SER 155.A OG GLU 231.A OE1 no hydrogen 2.636 N/A SER 155.A OG GLU 231.A OE2 no hydrogen 3.379 N/A CYS 156.A N SER 151.A OG no hydrogen 2.808 N/A CYS 156.A SG HIS 203.A ND1 no hydrogen 3.424 N/A LEU 157.A N TYR 202.A O no hydrogen 2.922 N/A ALA 158.A N PHE 149.A O no hydrogen 2.893 N/A PHE 159.A N GLY 200.A O no hydrogen 2.823 N/A TYR 160.A N GLY 147.A O no hydrogen 3.095 N/A TYR 160.A OH LEU 222.A O no hydrogen 2.615 N/A ARG 161.A N THR 198.A O no hydrogen 2.955 N/A ARG 161.A NE TYR 133.A OH no hydrogen 3.248 N/A MET 162.A N VAL 132.A O no hydrogen 2.750 N/A ASP 163.A N HIS 196.A O no hydrogen 2.912 N/A GLN 164.A N THR 130.A O no hydrogen 2.840 N/A GLN 164.A NE2 GLU 129.A O no hydrogen 2.770 N/A SER 165.A N ASP 163.A OD1 no hydrogen 3.023 N/A SER 165.A OG ASP 163.A OD1 no hydrogen 2.753 N/A VAL 167.A N GLN 164.A O no hydrogen 3.126 N/A THR 170.A N LEU 185.A O no hydrogen 2.786 N/A ILE 172.A N LYS 183.A O no hydrogen 2.867 N/A ASP 174.A N GLU 181.A O no hydrogen 2.735 N/A HIS 176.A N ASP 174.A OD1 no hydrogen 3.150 N/A HIS 176.A NE2 SER 640.A OG no hydrogen 2.706 N/A GLU 181.A N ASP 174.A O no hydrogen 2.911 N/A LYS 183.A N ILE 172.A O no hydrogen 2.898 N/A LEU 185.A N THR 170.A O no hydrogen 2.708 N/A TYR 186.A OH GLU 129.A OE2 no hydrogen 2.490 N/A TYR 187.A N LEU 185.A O no hydrogen 2.827 N/A TYR 187.A OH VAL 613.A O no hydrogen 2.834 N/A ALA 190.A N TYR 568.A O no hydrogen 2.798 N/A GLY 191.A N GLU 574.A OE1 no hydrogen 2.676 N/A THR 192.A N MET 189.A O no hydrogen 3.063 N/A THR 192.A OG1 MET 189.A O no hydrogen 2.653 N/A SER 194.A N GLU 219.A OE2 no hydrogen 2.797 N/A HIS 195.A NE2 HIS 138.A ND1 no hydrogen 2.965 N/A HIS 196.A N ASP 163.A O no hydrogen 2.885 N/A THR 198.A N ARG 161.A O no hydrogen 2.933 N/A THR 198.A OG1 ARG 161.A O no hydrogen 3.560 N/A GLY 200.A N PHE 159.A O no hydrogen 2.825 N/A ILE 201.A N VAL 210.A O no hydrogen 2.816 N/A TYR 202.A N LEU 157.A O no hydrogen 2.797 N/A HIS 203.A N LYS 208.A O no hydrogen 2.840 N/A HIS 203.A NE2 ALA 253.A O no hydrogen 2.931 N/A LEU 204.A N SER 155.A O no hydrogen 3.181 N/A GLY 207.A N HIS 203.A O no hydrogen 2.680 N/A LYS 208.A N THR 206.A OG1 no hydrogen 3.147 N/A VAL 210.A N ILE 201.A O no hydrogen 3.135 N/A LEU 212.A N VAL 199.A O no hydrogen 2.840 N/A GLN 213.A N GLY 256.A O no hydrogen 2.816 N/A LYS 218.A NZ GLU 216.A OE2 no hydrogen 2.651 N/A LYS 220.A N PRO 217.A O no hydrogen 3.084 N/A LYS 220.A NZ THR 214.A O no hydrogen 2.697 N/A LYS 220.A NZ GLU 216.A O no hydrogen 2.839 N/A PHE 221.A N VAL 239.A O no hydrogen 2.956 N/A LEU 222.A N HIS 138.A NE2 no hydrogen 3.031 N/A THR 223.A N ALA 237.A O no hydrogen 2.975 N/A THR 223.A OG1 ASN 224.A OD1 no hydrogen 2.985 N/A THR 223.A OG1 ALA 237.A O no hydrogen 2.781 N/A ASN 224.A ND2 PHE 142.A O no hydrogen 3.665 N/A SER 226.A N TYR 235.A O no hydrogen 2.892 N/A SER 226.A OG ASN 224.A O no hydrogen 2.823 N/A TRP 227.A NE1 PHE 149.A O no hydrogen 2.948 N/A SER 228.A N ILE 233.A O no hydrogen 2.915 N/A SER 228.A OG ASP 230.A OD1 no hydrogen 2.721 N/A SER 228.A OG ILE 233.A O no hydrogen 3.205 N/A ASP 230.A N ASN 284.A OD1 no hydrogen 3.122 N/A GLU 231.A N SER 228.A O no hydrogen 2.939 N/A ASN 232.A N ASP 230.A OD1 no hydrogen 2.970 N/A ASN 232.A ND2 ASP 230.A OD2 no hydrogen 2.798 N/A ILE 233.A N SER 228.A OG no hydrogen 3.057 N/A LEU 234.A N TYR 251.A O no hydrogen 2.983 N/A TYR 235.A N SER 226.A O no hydrogen 2.742 N/A VAL 236.A N ASN 249.A O no hydrogen 2.866 N/A ALA 237.A N THR 223.A O no hydrogen 2.858 N/A GLU 238.A N LYS 247.A O no hydrogen 2.798 N/A VAL 239.A N PHE 221.A O no hydrogen 2.955 N/A ASN 240.A N GLU 245.A O no hydrogen 3.312 N/A ASN 240.A ND2 ASN 244.A OD1 no hydrogen 2.902 N/A ARG 241.A NE GLU 574.A OE2 no hydrogen 2.866 N/A ARG 241.A NH1 THR 192.A O no hydrogen 3.062 N/A ARG 241.A NH1 GLU 219.A OE1 no hydrogen 2.902 N/A ARG 241.A NH2 THR 192.A O no hydrogen 2.917 N/A ARG 241.A NH2 GLU 574.A OE1 no hydrogen 2.787 N/A ARG 241.A NH2 GLU 574.A OE2 no hydrogen 3.522 N/A GLN 243.A N ASN 240.A O no hydrogen 2.836 N/A GLN 243.A NE2 MET 571.A O no hydrogen 2.894 N/A ASN 244.A N ASN 240.A OD1 no hydrogen 3.088 N/A GLU 245.A N ASN 240.A OD1 no hydrogen 3.218 N/A CYS 246.A N GLU 265.A O no hydrogen 2.827 N/A LYS 247.A N GLU 238.A O no hydrogen 2.810 N/A VAL 248.A N PHE 263.A O no hydrogen 3.035 N/A ASN 249.A N VAL 236.A O no hydrogen 2.828 N/A ASN 249.A ND2 GLU 238.A OE2 no hydrogen 2.913 N/A ALA 250.A N ARG 260.A O no hydrogen 2.870 N/A TYR 251.A N LEU 234.A O no hydrogen 3.023 N/A TYR 251.A OH GLU 238.A OE2 no hydrogen 2.615 N/A ASP 252.A N ARG 257.A O no hydrogen 2.789 N/A ALA 253.A N ASN 232.A O no hydrogen 3.026 N/A THR 255.A N ASP 252.A OD2 no hydrogen 2.691 N/A THR 255.A OG1 ASP 252.A OD2 no hydrogen 2.702 N/A GLY 256.A N ASP 252.A O no hydrogen 2.605 N/A ARG 257.A N THR 255.A OG1 no hydrogen 3.139 N/A VAL 259.A N ALA 250.A O no hydrogen 2.831 N/A ARG 260.A N ALA 250.A O no hydrogen 3.394 N/A ARG 260.A NE THR 304.A O no hydrogen 3.315 N/A ARG 260.A NH2 THR 304.A O no hydrogen 2.668 N/A THR 261.A OG1 ASN 249.A OD1 no hydrogen 2.604 N/A LEU 262.A N VAL 248.A O no hydrogen 2.850 N/A GLU 265.A N CYS 246.A O no hydrogen 2.849 N/A ASP 267.A N ASN 244.A O no hydrogen 3.321 N/A HIS 269.A N ASP 267.A OD1 no hydrogen 2.771 N/A HIS 269.A ND1 HIS 501.A ND1 no hydrogen 3.047 N/A TYR 270.A N ASP 267.A OD1 no hydrogen 2.871 N/A TYR 270.A OH GLU 497.A OE2 no hydrogen 2.687 N/A VAL 271.A N GLN 243.A O no hydrogen 2.878 N/A LEU 277.A N SER 226.A OG no hydrogen 2.869 N/A THR 278.A N ILE 288.A O no hydrogen 3.092 N/A LEU 280.A N GLN 286.A O no hydrogen 2.978 N/A SER 283.A N LEU 280.A O no hydrogen 2.988 N/A ASN 285.A N SER 283.A OG no hydrogen 3.158 N/A GLN 286.A N SER 283.A OG no hydrogen 3.061 N/A PHE 287.A N TYR 302.A O no hydrogen 2.934 N/A ILE 288.A N THR 278.A O no hydrogen 2.735 N/A TRP 289.A N TYR 300.A O no hydrogen 2.743 N/A TRP 289.A NE1 GLU 265.A OE2 no hydrogen 2.621 N/A SER 291.A N HIS 298.A O no hydrogen 2.973 N/A SER 291.A OG GLU 265.A OE1 no hydrogen 2.954 N/A SER 291.A OG GLU 265.A OE2 no hydrogen 3.005 N/A ARG 292.A NE GLU 318.A OE2 no hydrogen 2.875 N/A ARG 292.A NH1 GLU 497.A OE1 no hydrogen 2.820 N/A ARG 292.A NH2 GLU 318.A OE1 no hydrogen 2.844 N/A ARG 292.A NH2 GLU 318.A OE2 no hydrogen 3.405 N/A ARG 293.A N SER 291.A OG no hydrogen 3.100 N/A ARG 293.A NE SER 291.A OG no hydrogen 3.065 N/A ARG 293.A NH1 TYR 302.A OH no hydrogen 2.829 N/A ARG 293.A NH2 GLU 265.A OE2 no hydrogen 2.803 N/A ARG 293.A NH2 TYR 302.A OH no hydrogen 2.880 N/A GLY 295.A N ARG 292.A O no hydrogen 2.853 N/A TRP 296.A N ASP 294.A OD2 no hydrogen 2.906 N/A ASN 297.A N GLU 318.A OE2 no hydrogen 2.972 N/A ASN 297.A ND2 GLN 290.A OE1 no hydrogen 3.102 N/A ASN 297.A ND2 VAL 319.A O no hydrogen 2.837 N/A HIS 298.A N SER 291.A O no hydrogen 2.881 N/A HIS 298.A ND1 THR 313.A OG1 no hydrogen 2.762 N/A HIS 298.A NE2 GLY 315.A O no hydrogen 2.850 N/A LEU 299.A N THR 313.A OG1 no hydrogen 2.978 N/A TYR 300.A N TRP 289.A O no hydrogen 2.715 N/A LEU 301.A N ARG 310.A O no hydrogen 2.779 N/A TYR 302.A N PHE 287.A O no hydrogen 2.961 N/A ASP 303.A N ARG 307.A O no hydrogen 3.146 N/A THR 304.A N ASN 285.A O no hydrogen 2.728 N/A THR 305.A N ASP 303.A OD1 no hydrogen 2.681 N/A THR 305.A OG1 ASP 303.A OD1 no hydrogen 2.339 N/A THR 305.A OG1 ASP 303.A OD2 no hydrogen 3.096 N/A GLY 306.A N ASP 303.A O no hydrogen 3.040 N/A ARG 307.A N ASP 303.A OD1 no hydrogen 3.172 N/A ARG 307.A N THR 305.A OG1 no hydrogen 3.406 N/A ILE 309.A N LEU 301.A O no hydrogen 2.772 N/A ARG 310.A N LEU 301.A O no hydrogen 3.257 N/A ARG 310.A NH1 ILE 351.A O no hydrogen 3.019 N/A GLN 311.A NE2 ASP 294.A OD1 no hydrogen 3.032 N/A GLN 311.A NE2 THR 313.A O no hydrogen 2.944 N/A VAL 312.A N LEU 299.A O no hydrogen 2.808 N/A THR 313.A OG1 HIS 298.A ND1 no hydrogen 2.762 N/A GLU 318.A N THR 337.A OG1 no hydrogen 2.873 N/A VAL 319.A N ASN 297.A O no hydrogen 2.890 N/A THR 320.A N GLU 335.A O no hydrogen 2.818 N/A THR 320.A OG1 GLU 335.A OE2 no hydrogen 2.549 N/A ASN 321.A N GLU 335.A O no hydrogen 3.393 N/A ALA 323.A N TYR 333.A O no hydrogen 2.840 N/A GLY 324.A N TYR 333.A O no hydrogen 3.306 N/A ASP 326.A N ARG 331.A O no hydrogen 3.300 N/A GLY 329.A N ASP 326.A O no hydrogen 2.917 N/A THR 330.A N ASP 326.A OD2 no hydrogen 2.697 N/A THR 330.A OG1 ASP 326.A OD1 no hydrogen 2.617 N/A ARG 331.A N ASP 326.A OD2 no hydrogen 3.175 N/A LEU 332.A N ILE 349.A O no hydrogen 2.807 N/A TYR 333.A N GLY 324.A O no hydrogen 2.805 N/A PHE 334.A N TYR 347.A O no hydrogen 3.030 N/A GLU 335.A N ASN 321.A O no hydrogen 2.762 N/A SER 336.A N HIS 345.A O no hydrogen 3.047 N/A THR 337.A N GLU 318.A O no hydrogen 3.071 N/A GLU 338.A N SER 336.A OG no hydrogen 3.173 N/A LEU 342.A N SER 340.A OG no hydrogen 3.132 N/A GLU 343.A N SER 340.A O no hydrogen 2.946 N/A ARG 344.A N GLY 364.A O no hydrogen 3.248 N/A ARG 344.A NH1 PRO 341.A O no hydrogen 2.998 N/A ARG 344.A NH1 GLU 343.A O no hydrogen 2.835 N/A ARG 344.A NH2 GLN 457.A OE1 no hydrogen 2.770 N/A HIS 345.A N SER 336.A O no hydrogen 3.376 N/A HIS 345.A ND1 ASP 358.A OD1 no hydrogen 2.569 N/A HIS 345.A NE2 GLU 343.A OE1 no hydrogen 2.739 N/A PHE 346.A N THR 360.A OG1 no hydrogen 2.961 N/A TYR 347.A N PHE 334.A O no hydrogen 2.670 N/A CYS 348.A N LYS 357.A O no hydrogen 3.076 N/A ILE 349.A N LEU 332.A O no hydrogen 2.999 N/A ILE 351.A N THR 330.A O no hydrogen 2.825 N/A LYS 352.A N ASP 350.A OD1 no hydrogen 2.694 N/A GLY 353.A N ASP 350.A O no hydrogen 2.715 N/A THR 356.A OG1 GLU 338.A OE1 no hydrogen 3.406 N/A THR 356.A OG1 GLU 338.A OE2 no hydrogen 2.667 N/A LYS 357.A N CYS 348.A O no hydrogen 2.852 N/A LEU 359.A N PHE 346.A O no hydrogen 2.802 N/A THR 360.A N ASP 358.A OD2 no hydrogen 2.771 N/A SER 363.A OG GLU 343.A OE2 no hydrogen 2.973 N/A GLY 364.A N GLU 343.A OE1 no hydrogen 3.087 N/A MET 365.A N GLN 382.A O no hydrogen 2.958 N/A HIS 366.A N ARG 344.A O no hydrogen 2.835 N/A HIS 366.A ND1 ASP 379.A OD2 no hydrogen 2.635 N/A HIS 366.A NE2 GLU 362.A O no hydrogen 2.780 N/A ARG 367.A N ILE 380.A O no hydrogen 3.161 N/A ARG 367.A NE GLU 335.A OE1 no hydrogen 3.154 N/A ARG 367.A NE HIS 366.A O no hydrogen 3.103 N/A ARG 367.A NH2 GLU 335.A OE1 no hydrogen 3.062 N/A ARG 367.A NH2 GLU 335.A OE2 no hydrogen 2.679 N/A THR 368.A OG1 ASP 379.A OD1 no hydrogen 2.691 N/A GLN 369.A N ILE 378.A O no hydrogen 2.868 N/A GLN 369.A NE2 LEU 11.A O no hydrogen 3.545 N/A SER 371.A N ALA 376.A O no hydrogen 2.921 N/A SER 371.A OG ALA 376.A O no hydrogen 3.143 N/A GLY 374.A N SER 371.A OG no hydrogen 3.064 N/A ALA 376.A N SER 371.A OG no hydrogen 3.203 N/A ILE 377.A N THR 393.A O no hydrogen 2.851 N/A ILE 378.A N GLN 369.A O no hydrogen 2.976 N/A ASP 379.A N THR 391.A O no hydrogen 2.609 N/A ILE 380.A N ARG 367.A O no hydrogen 3.052 N/A PHE 381.A N LYS 389.A O no hydrogen 3.089 N/A GLN 382.A N MET 365.A O no hydrogen 3.339 N/A SER 383.A N VAL 386.A O no hydrogen 2.768 N/A SER 383.A OG THR 385.A OG1 no hydrogen 3.319 N/A THR 385.A OG1 SER 383.A OG no hydrogen 3.319 N/A VAL 386.A N SER 383.A O no hydrogen 3.205 N/A VAL 386.A N SER 383.A OG no hydrogen 2.851 N/A LYS 389.A N PHE 381.A O no hydrogen 2.798 N/A VAL 390.A N LEU 403.A O no hydrogen 2.730 N/A THR 391.A N ASP 379.A O no hydrogen 2.744 N/A VAL 392.A N HIS 400.A O no hydrogen 3.017 N/A THR 393.A N ILE 377.A O no hydrogen 2.895 N/A THR 393.A OG1 SER 399.A OG no hydrogen 2.668 N/A ILE 395.A N SER 375.A O no hydrogen 2.639 N/A LYS 397.A N ASN 394.A O no hydrogen 2.631 N/A SER 399.A OG THR 393.A OG1 no hydrogen 2.668 N/A HIS 400.A N VAL 392.A O no hydrogen 3.066 N/A LEU 402.A N VAL 390.A O no hydrogen 2.797 N/A LEU 403.A N VAL 390.A O no hydrogen 3.503 N/A ALA 405.A N ARG 388.A O no hydrogen 3.121 N/A THR 407.A OG1 TYR 409.A O no hydrogen 3.094 N/A ARG 415.A N LEU 432.A O no hydrogen 2.762 N/A ARG 415.A NE GLU 413.A OE2 no hydrogen 3.144 N/A GLY 417.A N TYR 430.A O no hydrogen 3.321 N/A ILE 419.A N LEU 428.A O no hydrogen 2.905 N/A ALA 421.A N THR 426.A O no hydrogen 2.704 N/A ALA 422.A N ASP 511.A OD1 no hydrogen 2.942 N/A GLY 424.A N ALA 421.A O no hydrogen 2.919 N/A GLN 425.A N ASP 423.A OD1 no hydrogen 2.826 N/A THR 426.A N ASP 423.A OD1 no hydrogen 2.941 N/A THR 426.A OG1 ASP 423.A OD2 no hydrogen 2.603 N/A LEU 428.A N ILE 419.A O no hydrogen 2.670 N/A TYR 430.A N GLY 417.A O no hydrogen 3.009 N/A LYS 431.A N THR 483.A O no hydrogen 2.880 N/A LYS 431.A NZ ARG 464.A O no hydrogen 2.890 N/A LEU 432.A N ARG 415.A O no hydrogen 2.652 N/A THR 433.A N VAL 481.A O no hydrogen 2.826 N/A THR 433.A OG1 ASP 471.A OD2 no hydrogen 2.868 N/A MET 434.A N GLU 413.A O no hydrogen 2.766 N/A LEU 436.A N ALA 475.A O no hydrogen 3.001 N/A PHE 438.A N PRO 435.A O no hydrogen 3.079 N/A ASP 439.A N TYR 444.A OH no hydrogen 2.655 N/A ALA 441.A N ASP 439.A OD1 no hydrogen 2.777 N/A LYS 442.A N ASP 439.A O no hydrogen 2.794 N/A LYS 443.A NZ SER 523.A O no hydrogen 3.105 N/A LYS 443.A NZ VAL 525.A O no hydrogen 3.055 N/A TYR 444.A N TRP 524.A O no hydrogen 2.722 N/A VAL 446.A N ARG 529.A O no hydrogen 3.050 N/A ILE 447.A N ALA 480.A O no hydrogen 2.745 N/A VAL 448.A N GLY 531.A O no hydrogen 2.901 N/A TYR 449.A N PHE 482.A O no hydrogen 2.753 N/A VAL 450.A N HIS 533.A O no hydrogen 2.786 N/A HIS 455.A NE2 GLU 272.A OE2 no hydrogen 2.837 N/A GLN 457.A NE2 PRO 341.A O no hydrogen 2.926 N/A LEU 458.A N ASP 485.A OD1 no hydrogen 2.941 N/A VAL 459.A N ASP 485.A OD2 no hydrogen 2.769 N/A LYS 461.A N LEU 342.A O no hydrogen 2.787 N/A LYS 461.A NZ GLU 343.A OE2 no hydrogen 3.424 N/A LYS 461.A NZ SER 363.A OG no hydrogen 2.844 N/A THR 462.A N THR 460.A O no hydrogen 2.900 N/A THR 462.A OG1 GLN 382.A OE1 no hydrogen 2.534 N/A TRP 463.A N GLN 382.A OE1 no hydrogen 2.785 N/A SER 465.A OG ASP 471.A OD1 no hydrogen 2.563 N/A SER 466.A OG LEU 458.A O no hydrogen 3.273 N/A VAL 467.A N SER 465.A OG no hydrogen 2.911 N/A GLY 468.A N ASN 4.A OD1 no hydrogen 2.651 N/A GLY 469.A N SER 465.A OG no hydrogen 2.986 N/A TRP 470.A N VAL 467.A O no hydrogen 3.320 N/A TYR 473.A N GLY 469.A O no hydrogen 3.013 N/A TYR 473.A OH GLU 655.A OE2 no hydrogen 2.434 N/A MET 474.A N TRP 470.A O no hydrogen 2.889 N/A ALA 475.A N ASP 471.A O no hydrogen 2.969 N/A GLN 476.A N ILE 472.A O no hydrogen 2.959 N/A LYS 477.A N MET 474.A O no hydrogen 2.880 N/A LYS 477.A NZ TYR 473.A OH no hydrogen 3.229 N/A LYS 477.A NZ THR 658.A OG1 no hydrogen 2.828 N/A GLY 478.A N ALA 475.A O no hydrogen 3.006 N/A TYR 479.A N MET 474.A O no hydrogen 3.427 N/A TYR 479.A OH LEU 665.A OXT no hydrogen 2.726 N/A ALA 480.A N PRO 445.A O no hydrogen 3.177 N/A VAL 481.A N THR 433.A O no hydrogen 2.983 N/A PHE 482.A N ILE 447.A O no hydrogen 2.850 N/A THR 483.A N LYS 431.A O no hydrogen 3.036 N/A THR 483.A OG1 TYR 449.A O no hydrogen 2.792 N/A ASP 485.A N TYR 429.A O no hydrogen 3.134 N/A ARG 487.A N ASP 511.A OD2 no hydrogen 2.941 N/A ARG 487.A NE ASP 511.A OD1 no hydrogen 3.450 N/A ARG 487.A NE ASP 511.A OD2 no hydrogen 2.850 N/A ARG 487.A NH2 ASP 511.A OD1 no hydrogen 2.862 N/A GLY 488.A N PHE 496.A O no hydrogen 3.059 N/A SER 489.A N SER 486.A O no hydrogen 3.072 N/A SER 489.A OG SER 486.A O no hydrogen 2.635 N/A ALA 490.A N ALA 456.A O no hydrogen 2.945 N/A ASN 491.A ND2 GLN 457.A OE1 no hydrogen 2.980 N/A ARG 492.A NH1 PRO 427.A O no hydrogen 3.124 N/A ARG 492.A NH2 PRO 427.A O no hydrogen 2.861 N/A GLY 493.A N GLU 318.A OE1 no hydrogen 2.928 N/A ALA 494.A N GLY 295.A O no hydrogen 2.858 N/A GLU 497.A N GLY 493.A O no hydrogen 3.400 N/A GLN 498.A N ALA 494.A O no hydrogen 2.671 N/A GLN 498.A NE2 ASP 267.A OD1 no hydrogen 3.284 N/A GLN 498.A NE2 TYR 270.A O no hydrogen 3.613 N/A ILE 500.A N GLU 497.A O no hydrogen 3.347 N/A HIS 501.A N GLN 498.A O no hydrogen 3.090 N/A HIS 501.A NE2 ASP 578.A OD1 no hydrogen 3.047 N/A ARG 502.A N TYR 576.A O no hydrogen 2.761 N/A ARG 502.A NH1 ASP 578.A OD2 no hydrogen 2.693 N/A ARG 502.A NH1 GLU 582.A O no hydrogen 3.239 N/A ARG 502.A NH2 GLU 582.A O no hydrogen 2.879 N/A ARG 503.A N ILE 500.A O no hydrogen 2.843 N/A ARG 503.A NH1 GLN 506.A OE1 no hydrogen 3.253 N/A ARG 503.A NH2 VAL 499.A O no hydrogen 2.856 N/A ARG 503.A NH2 THR 507.A OG1 no hydrogen 2.517 N/A GLY 505.A N GLU 508.A OE1 no hydrogen 2.723 N/A GLN 506.A N ARG 503.A O no hydrogen 3.230 N/A GLU 508.A N GLU 508.A OE2 no hydrogen 2.593 N/A MET 509.A N GLY 505.A O no hydrogen 2.897 N/A ALA 510.A N GLN 506.A O no hydrogen 3.164 N/A ASP 511.A N THR 507.A O no hydrogen 2.953 N/A GLN 512.A N GLU 508.A O no hydrogen 2.936 N/A GLN 512.A NE2 VAL 484.A O no hydrogen 3.113 N/A GLN 512.A NE2 SER 486.A OG no hydrogen 2.861 N/A MET 513.A N MET 509.A O no hydrogen 2.890 N/A CYS 514.A N ALA 510.A O no hydrogen 3.250 N/A CYS 514.A N ASP 511.A O no hydrogen 3.065 N/A CYS 514.A SG MET 420.A O no hydrogen 3.797 N/A CYS 514.A SG ALA 510.A O no hydrogen 3.620 N/A GLY 515.A N ASP 511.A O no hydrogen 3.245 N/A VAL 516.A N GLN 512.A O no hydrogen 3.012 N/A ASP 517.A N MET 513.A O no hydrogen 2.875 N/A PHE 518.A N CYS 514.A O no hydrogen 3.103 N/A LEU 519.A N GLY 515.A O no hydrogen 2.984 N/A LYS 520.A N VAL 516.A O no hydrogen 2.871 N/A SER 521.A N ASP 517.A O no hydrogen 3.199 N/A SER 521.A N PHE 518.A O no hydrogen 3.081 N/A SER 521.A OG ASP 517.A O no hydrogen 3.095 N/A GLN 522.A N LEU 519.A O no hydrogen 2.999 N/A TRP 524.A NE1 GLN 522.A OE1 no hydrogen 3.184 N/A VAL 525.A N GLN 522.A O no hydrogen 3.324 N/A ASP 526.A N TYR 444.A O no hydrogen 2.851 N/A ASP 528.A N ASP 526.A OD1 no hydrogen 2.867 N/A ARG 529.A N ASP 526.A O no hydrogen 2.957 N/A ARG 529.A NE LEU 665.A O no hydrogen 2.970 N/A ARG 529.A NH2 LEU 665.A OXT no hydrogen 2.852 N/A GLY 531.A N VAL 446.A O no hydrogen 2.778 N/A VAL 532.A N VAL 555.A O no hydrogen 2.974 N/A HIS 533.A N VAL 448.A O no hydrogen 2.890 N/A HIS 533.A ND1 VAL 557.A O no hydrogen 2.655 N/A GLY 534.A N VAL 557.A O no hydrogen 3.343 N/A TRP 535.A NE1 HIS 643.A O no hydrogen 2.903 N/A SER 536.A N GLY 559.A O no hydrogen 2.898 N/A SER 536.A OG HIS 643.A NE2 no hydrogen 2.771 N/A TYR 537.A OH GLU 508.A OE1 no hydrogen 2.609 N/A GLY 538.A N TRP 535.A O no hydrogen 2.724 N/A GLY 539.A N SER 536.A O no hydrogen 2.791 N/A PHE 540.A N SER 536.A O no hydrogen 3.023 N/A MET 541.A N TYR 537.A O no hydrogen 2.936 N/A THR 542.A N GLY 538.A O no hydrogen 2.873 N/A THR 542.A OG1 GLY 538.A O no hydrogen 2.813 N/A THR 543.A N GLY 539.A O no hydrogen 3.078 N/A THR 543.A OG1 GLY 539.A O no hydrogen 2.984 N/A ASN 544.A N PHE 540.A O no hydrogen 2.832 N/A LEU 545.A N MET 541.A O no hydrogen 2.798 N/A MET 546.A N THR 542.A O no hydrogen 3.192 N/A LEU 547.A N THR 543.A O no hydrogen 3.053 N/A THR 548.A N ASN 544.A O no hydrogen 2.788 N/A THR 548.A OG1 ASN 544.A O no hydrogen 2.694 N/A THR 548.A OG1 ASN 544.A OD1 no hydrogen 2.962 N/A HIS 549.A N LEU 545.A O no hydrogen 2.756 N/A VAL 552.A N HIS 549.A O no hydrogen 2.996 N/A PHE 553.A N HIS 549.A O no hydrogen 3.198 N/A LYS 554.A N ILE 530.A O no hydrogen 2.977 N/A LYS 554.A NZ ASP 528.A O no hydrogen 3.496 N/A LYS 554.A NZ ASP 551.A O no hydrogen 3.085 N/A GLY 556.A N ARG 602.A O no hydrogen 2.852 N/A VAL 557.A N VAL 532.A O no hydrogen 3.094 N/A ALA 558.A N MET 604.A O no hydrogen 2.896 N/A GLY 559.A N GLY 534.A O no hydrogen 2.996 N/A GLY 560.A N ILE 606.A O no hydrogen 2.758 N/A ILE 563.A N HIS 618.A ND1 no hydrogen 3.057 N/A ASP 564.A N HIS 618.A ND1 no hydrogen 3.448 N/A ASN 566.A N ASP 564.A OD2 no hydrogen 2.902 N/A ASN 566.A ND2 ASN 566.A O no hydrogen 2.604 N/A ARG 567.A N ASP 564.A O no hydrogen 2.849 N/A TYR 568.A N TRP 565.A O no hydrogen 3.025 N/A GLU 569.A N TYR 187.A OH no hydrogen 2.974 N/A ILE 570.A N PRO 188.A O no hydrogen 2.895 N/A TYR 572.A N GLU 569.A OE2 no hydrogen 2.929 N/A GLY 573.A N GLU 569.A O no hydrogen 3.007 N/A GLU 574.A N ILE 570.A O no hydrogen 2.891 N/A ARG 575.A NH1 GLU 141.A OE1 no hydrogen 2.785 N/A ARG 575.A NH1 TYR 576.A OH no hydrogen 3.119 N/A ARG 575.A NH2 GLU 141.A OE1 no hydrogen 2.806 N/A PHE 577.A N GLY 573.A O no hydrogen 2.948 N/A ASP 578.A N GLU 574.A O no hydrogen 2.904 N/A ALA 579.A N GLU 582.A OE1 no hydrogen 2.881 N/A GLN 581.A N GLN 581.A OE1 no hydrogen 2.649 N/A GLN 581.A NE2 GLY 191.A O no hydrogen 2.973 N/A GLU 582.A N ALA 579.A O no hydrogen 2.942 N/A ASN 583.A N PRO 580.A O no hydrogen 3.288 N/A ASN 583.A ND2 ARG 502.A O no hydrogen 2.955 N/A ASN 583.A ND2 PHE 577.A O no hydrogen 3.096 N/A GLY 586.A N ASN 583.A OD1 no hydrogen 2.973 N/A TYR 587.A N ASN 583.A O no hydrogen 3.173 N/A TYR 587.A OH ASP 578.A O no hydrogen 2.616 N/A ASP 588.A N PRO 584.A O no hydrogen 2.884 N/A ALA 589.A N GLU 585.A O no hydrogen 3.081 N/A ALA 590.A N GLY 586.A O no hydrogen 3.177 N/A ALA 590.A N TYR 587.A O no hydrogen 3.114 N/A ASN 591.A N ASP 588.A O no hydrogen 3.355 N/A LEU 592.A N ILE 563.A O no hydrogen 2.926 N/A LEU 593.A N ASN 591.A OD1 no hydrogen 3.076 N/A LYS 594.A N ASN 591.A O no hydrogen 3.121 N/A ARG 595.A N LEU 592.A O no hydrogen 3.111 N/A ARG 595.A NH1 ASN 544.A OD1 no hydrogen 3.431 N/A ARG 595.A NH1 THR 548.A OG1 no hydrogen 3.076 N/A ARG 595.A NH2 ASN 544.A OD1 no hydrogen 2.801 N/A ARG 595.A NH2 ALA 589.A O no hydrogen 2.975 N/A ASP 598.A N ARG 595.A O no hydrogen 2.915 N/A LEU 599.A N ALA 596.A O no hydrogen 3.207 N/A LYS 600.A NZ ASP 551.A OD2 no hydrogen 2.420 N/A ARG 602.A N LYS 554.A O no hydrogen 2.974 N/A ARG 602.A NH2 ASP 634.A OD1 no hydrogen 2.826 N/A MET 604.A N GLY 556.A O no hydrogen 3.023 N/A LEU 605.A N ASP 634.A O no hydrogen 3.018 N/A ILE 606.A N ALA 558.A O no hydrogen 2.836 N/A HIS 607.A N TYR 636.A O no hydrogen 3.138 N/A HIS 607.A ND1 SER 619.A OG no hydrogen 2.864 N/A HIS 607.A NE2 VAL 614.A O no hydrogen 2.662 N/A ALA 609.A N TYR 638.A O no hydrogen 2.948 N/A ILE 610.A N HIS 641.A O no hydrogen 3.230 N/A ASP 611.A N GLY 608.A O no hydrogen 3.220 N/A VAL 613.A N ASP 611.A OD2 no hydrogen 2.705 N/A VAL 614.A N ASP 611.A OD2 no hydrogen 2.825 N/A HIS 618.A N VAL 615.A O no hydrogen 2.904 N/A HIS 618.A NE2 ARG 567.A O no hydrogen 3.189 N/A SER 619.A OG HIS 607.A ND1 no hydrogen 2.864 N/A SER 619.A OG TRP 616.A O no hydrogen 3.360 N/A SER 619.A OG TYR 635.A OH no hydrogen 2.661 N/A LEU 620.A N TRP 616.A O no hydrogen 3.197 N/A LEU 621.A N GLN 617.A O no hydrogen 2.866 N/A PHE 622.A N HIS 618.A O no hydrogen 3.236 N/A LEU 623.A N SER 619.A O no hydrogen 3.095 N/A ASP 624.A N LEU 620.A O no hydrogen 2.959 N/A ALA 625.A N LEU 621.A O no hydrogen 2.781 N/A CYS 626.A N PHE 622.A O no hydrogen 2.879 N/A CYS 626.A SG PHE 622.A O no hydrogen 3.399 N/A CYS 626.A SG THR 631.A OG1 no hydrogen 3.134 N/A VAL 627.A N LEU 623.A O no hydrogen 2.923 N/A LYS 628.A N ASP 624.A O no hydrogen 3.197 N/A LYS 628.A NZ ASP 624.A OD2 no hydrogen 2.886 N/A ALA 629.A N ALA 625.A O no hydrogen 2.918 N/A ARG 630.A N VAL 627.A O no hydrogen 3.207 N/A THR 631.A N CYS 626.A O no hydrogen 2.806 N/A THR 631.A OG1 ALA 596.A O no hydrogen 2.916 N/A THR 631.A OG1 CYS 626.A O no hydrogen 3.508 N/A ASP 634.A N LEU 603.A O no hydrogen 2.606 N/A TYR 635.A OH SER 619.A OG no hydrogen 2.661 N/A TYR 636.A N LEU 605.A O no hydrogen 3.165 N/A TYR 638.A N HIS 607.A O no hydrogen 2.887 N/A TYR 638.A OH HIS 652.A ND1 no hydrogen 2.833 N/A SER 640.A OG HIS 176.A NE2 no hydrogen 2.706 N/A HIS 641.A N TYR 638.A O no hydrogen 3.197 N/A HIS 641.A NE2 ASP 649.A OD1 no hydrogen 2.714 N/A HIS 643.A ND1 ASP 611.A OD1 no hydrogen 2.740 N/A HIS 643.A NE2 SER 536.A OG no hydrogen 2.771 N/A ARG 650.A N GLY 647.A O no hydrogen 2.976 N/A ARG 650.A NE TYR 654.A OH no hydrogen 3.075 N/A ARG 650.A NH1 VAL 645.A O no hydrogen 2.826 N/A ARG 650.A NH2 TYR 654.A OH no hydrogen 3.410 N/A VAL 651.A N PRO 648.A O no hydrogen 3.023 N/A HIS 652.A ND1 TYR 638.A OH no hydrogen 2.833 N/A LEU 653.A N ASP 649.A O no hydrogen 3.152 N/A TYR 654.A N ARG 650.A O no hydrogen 2.997 N/A TYR 654.A OH GLY 468.A O no hydrogen 2.875 N/A GLU 655.A N VAL 651.A O no hydrogen 3.031 N/A THR 656.A N HIS 652.A O no hydrogen 2.936 N/A THR 656.A OG1 HIS 652.A O no hydrogen 2.880 N/A ILE 657.A N LEU 653.A O no hydrogen 2.901 N/A THR 658.A N TYR 654.A O no hydrogen 2.885 N/A THR 658.A OG1 TYR 654.A O no hydrogen 2.865 N/A THR 658.A OG1 GLU 655.A O no hydrogen 3.362 N/A ARG 659.A N GLU 655.A O no hydrogen 2.935 N/A TYR 660.A N THR 656.A O no hydrogen 3.183 N/A TYR 660.A OH ASP 634.A OD1 no hydrogen 2.574 N/A PHE 661.A N ILE 657.A O no hydrogen 3.342 N/A THR 662.A N THR 658.A O no hydrogen 2.902 N/A THR 662.A OG1 THR 658.A O no hydrogen 3.497 N/A THR 662.A OG1 ARG 659.A O no hydrogen 3.084 N/A ASP 663.A N ARG 659.A O no hydrogen 2.811 N/A HIS 664.A N TYR 660.A O no hydrogen 3.000 N/A LEU 665.A N PHE 661.A O no hydrogen 2.758 N/A