Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ki4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N SER 22.A O no hydrogen 3.312 N/A PHE 4.A N ILE 20.A O no hydrogen 3.283 N/A TYR 5.A OH ILE 351.A O no hydrogen 2.628 N/A LEU 6.A N ARG 18.A O no hydrogen 2.655 N/A THR 7.A N ARG 18.A O no hydrogen 3.119 N/A THR 7.A OG1 GLY 265.A O no hydrogen 3.323 N/A GLU 9.A N PHE 16.A O no hydrogen 2.907 N/A GLN 10.A NE2 GLY 12.A O no hydrogen 3.479 N/A ILE 11.A N SER 14.A O no hydrogen 2.773 N/A SER 14.A N ILE 11.A O no hydrogen 3.157 N/A SER 14.A OG GLU 30.A OE2 no hydrogen 2.694 N/A ILE 15.A N VAL 31.A O no hydrogen 2.921 N/A PHE 16.A N GLU 9.A O no hydrogen 2.960 N/A GLU 17.A N ARG 29.A O no hydrogen 3.009 N/A ARG 18.A N THR 7.A O no hydrogen 2.958 N/A ARG 18.A NH1 PRO 210.A O no hydrogen 2.965 N/A ARG 18.A NH1 GLY 265.A O no hydrogen 2.639 N/A ARG 18.A NH2 GLU 26.A OE2 no hydrogen 3.025 N/A ARG 18.A NH2 THR 209.A O no hydrogen 2.976 N/A ARG 18.A NH2 PRO 210.A O no hydrogen 3.550 N/A TYR 19.A N ARG 27.A O no hydrogen 3.006 N/A ILE 20.A N PHE 4.A O no hydrogen 2.873 N/A ASP 21.A N ARG 25.A O no hydrogen 2.990 N/A ASN 23.A N ASP 21.A OD1 no hydrogen 3.098 N/A GLY 24.A N ASP 21.A O no hydrogen 3.052 N/A ARG 25.A N ASP 21.A OD1 no hydrogen 2.763 N/A ARG 27.A N TYR 19.A O no hydrogen 2.778 N/A ARG 27.A NH1 ASP 21.A OD2 no hydrogen 3.290 N/A ARG 29.A N GLU 17.A O no hydrogen 2.965 N/A ARG 29.A NE GLU 17.A OE2 no hydrogen 2.929 N/A ARG 29.A NH2 GLU 17.A OE2 no hydrogen 3.223 N/A VAL 31.A N ILE 15.A O no hydrogen 2.872 N/A TYR 33.A OH ASP 95.A OD2 no hydrogen 2.564 N/A LEU 37.A N LYS 60.A O no hydrogen 3.231 N/A PHE 38.A N LEU 83.A O no hydrogen 2.912 N/A ALA 39.A N THR 58.A O no hydrogen 3.187 N/A HIS 40.A NE2 ASP 51.A OD2 no hydrogen 2.912 N/A CYS 41.A N PRO 56.A O no hydrogen 3.336 N/A CYS 41.A SG PRO 42.A O no hydrogen 3.546 N/A CYS 41.A SG GLN 45.A O no hydrogen 3.452 N/A ASP 51.A N LYS 55.A O no hydrogen 2.748 N/A TYR 53.A N ASP 51.A OD1 no hydrogen 3.051 N/A GLY 54.A N ASP 51.A O no hydrogen 2.869 N/A LYS 55.A N ASP 51.A OD1 no hydrogen 2.635 N/A CYS 57.A N TYR 49.A O no hydrogen 2.964 N/A CYS 57.A SG LYS 55.A O no hydrogen 3.470 N/A THR 58.A N ALA 39.A O no hydrogen 2.804 N/A ARG 59.A NH1 SER 36.A OG no hydrogen 2.998 N/A LYS 60.A N LEU 37.A O no hydrogen 2.829 N/A PHE 62.A N PRO 35.A O no hydrogen 3.194 N/A ARG 66.A N ASP 13.A OD1 no hydrogen 3.245 N/A ASP 67.A N ASN 64.A O no hydrogen 3.196 N/A ASP 67.A N ASN 64.A OD1 no hydrogen 3.105 N/A ALA 68.A N ASN 64.A O no hydrogen 3.407 N/A SER 69.A N MET 65.A O no hydrogen 3.223 N/A SER 69.A OG MET 65.A O no hydrogen 3.197 N/A GLN 70.A N ARG 66.A O no hydrogen 3.114 N/A TRP 71.A N ASP 67.A O no hydrogen 3.092 N/A ILE 72.A N ALA 68.A O no hydrogen 3.186 N/A LYS 73.A N SER 69.A O no hydrogen 3.109 N/A ARG 74.A N GLN 70.A O no hydrogen 2.956 N/A MET 75.A N TRP 71.A O no hydrogen 2.908 N/A GLU 76.A N ILE 72.A O no hydrogen 3.111 N/A ASP 77.A N LYS 73.A O no hydrogen 3.046 N/A ILE 78.A N ARG 74.A O no hydrogen 2.970 N/A GLY 79.A N MET 75.A O no hydrogen 2.822 N/A LEU 80.A N MET 75.A O no hydrogen 2.980 N/A ALA 82.A N GLN 380.A OE1 no hydrogen 3.022 N/A LEU 83.A N PHE 38.A O no hydrogen 2.840 N/A GLY 84.A N ILE 378.A O no hydrogen 3.119 N/A LYS 89.A NZ ASP 87.A OD1 no hydrogen 3.076 N/A LEU 90.A N ASP 87.A O no hydrogen 3.158 N/A TYR 92.A N PHE 88.A O no hydrogen 2.898 N/A TYR 92.A OH GLU 17.A OE2 no hydrogen 2.354 N/A LEU 93.A N LYS 89.A O no hydrogen 2.981 N/A SER 94.A N LEU 90.A O no hydrogen 2.921 N/A SER 94.A OG ASN 369.A OD1 no hydrogen 2.589 N/A ASP 95.A N ALA 91.A O no hydrogen 2.876 N/A THR 96.A N TYR 92.A O no hydrogen 2.806 N/A THR 96.A OG1 TYR 92.A O no hydrogen 2.692 N/A TYR 97.A N LEU 93.A O no hydrogen 3.010 N/A TYR 97.A OH GLU 17.A OE1 no hydrogen 2.505 N/A TYR 99.A OH GLU 3.A O no hydrogen 2.819 N/A TYR 103.A OH ASP 344.A OD1 no hydrogen 2.490 N/A THR 106.A N ASP 104.A OD1 no hydrogen 3.320 N/A THR 106.A OG1 ASP 104.A OD1 no hydrogen 2.934 N/A THR 106.A OG1 ASP 104.A OD2 no hydrogen 2.904 N/A LYS 107.A N ASP 104.A O no hydrogen 3.054 N/A ILE 108.A N HIS 105.A O no hydrogen 2.947 N/A ARG 109.A NH1 ASP 140.A OD2 no hydrogen 2.813 N/A VAL 110.A N SER 141.A OG no hydrogen 2.832 N/A ALA 111.A N ILE 212.A O no hydrogen 2.815 N/A ASN 112.A N.A TYR 139.A O no hydrogen 2.964 N/A ASN 112.A N.B TYR 139.A O no hydrogen 2.978 N/A PHE 113.A N THR 214.A O no hydrogen 3.332 N/A ASP 114.A N THR 137.A O no hydrogen 3.072 N/A GLU 116.A N ALA 135.A O no hydrogen 2.798 N/A THR 118.A N ASP 134.A OD2 no hydrogen 3.080 N/A THR 118.A OG1 ASP 134.A OD2 no hydrogen 2.739 N/A THR 118.A OG1 TYR 318.A OH no hydrogen 3.357 N/A SER 119.A OG ASP 121.A OD1 no hydrogen 3.306 N/A SER 119.A OG GLY 122.A O no hydrogen 2.656 N/A SER 119.A OG HIS 131.A NE2 no hydrogen 3.211 N/A SER 127.A OG SER 257.A O no hydrogen 2.687 N/A GLN 128.A N GLU 125.A O no hydrogen 3.076 N/A ALA 129.A N GLU 125.A O no hydrogen 2.697 N/A HIS 131.A N TYR 225.A OH no hydrogen 3.042 N/A HIS 131.A ND1 TYR 156.A OH no hydrogen 2.844 N/A ILE 133.A N GLU 194.A OE1 no hydrogen 2.980 N/A ASP 134.A N GLU 116.A O no hydrogen 3.102 N/A ILE 136.A N PHE 149.A O no hydrogen 2.902 N/A THR 137.A N ASP 114.A O no hydrogen 3.065 N/A THR 137.A OG1 ASN 322.A OD1 no hydrogen 2.452 N/A HIS 138.A N TYR 147.A O no hydrogen 2.864 N/A HIS 138.A ND1 TYR 201.A OH no hydrogen 2.895 N/A TYR 139.A N ASN 112.A O.A no hydrogen 2.579 N/A TYR 139.A N ASN 112.A O.B no hydrogen 2.797 N/A TYR 139.A OH ASP 144.A OD1 no hydrogen 2.531 N/A ASP 140.A N ARG 145.A O no hydrogen 3.090 N/A SER 141.A N VAL 110.A O no hydrogen 3.059 N/A SER 141.A OG ILE 108.A O no hydrogen 3.446 N/A SER 141.A OG VAL 110.A O no hydrogen 3.265 N/A ASP 143.A N ASP 140.A OD1 no hydrogen 2.771 N/A ARG 145.A N ASP 140.A O no hydrogen 3.360 N/A ARG 145.A NH1 ASP 144.A O no hydrogen 3.056 N/A PHE 146.A N LYS 185.A O no hydrogen 2.689 N/A TYR 147.A N HIS 138.A O no hydrogen 2.837 N/A TYR 147.A OH ASP 143.A OD2 no hydrogen 2.583 N/A VAL 148.A N ILE 187.A O no hydrogen 2.855 N/A PHE 149.A N ILE 136.A O no hydrogen 2.661 N/A ASP 150.A N MET 189.A O no hydrogen 2.962 N/A LEU 151.A N ASP 134.A O no hydrogen 3.036 N/A LEU 152.A N PHE 191.A O no hydrogen 3.131 N/A ASN 153.A ND2 ASN 158.A OD1 no hydrogen 2.939 N/A TYR 156.A N SER 154.A OG no hydrogen 3.031 N/A TYR 156.A OH HIS 131.A ND1 no hydrogen 2.844 N/A GLY 157.A N SER 154.A O no hydrogen 2.950 N/A VAL 159.A N LEU 152.A O no hydrogen 2.840 N/A TRP 162.A N TYR 188.A OH no hydrogen 2.855 N/A TRP 162.A NE1 SER 320.A OG no hydrogen 2.752 N/A SER 163.A N GLN 316.A OE1 no hydrogen 2.844 N/A SER 163.A OG GLU 165.A OE1 no hydrogen 3.465 N/A ILE 166.A N SER 163.A OG no hydrogen 2.886 N/A ALA 167.A N SER 163.A O no hydrogen 2.984 N/A ALA 168.A N ILE 164.A O no hydrogen 3.193 N/A LYS 169.A N ILE 166.A O no hydrogen 3.177 N/A LEU 170.A N GLN 173.A OE1 no hydrogen 3.469 N/A GLN 171.A N GLU 177.A OE2 no hydrogen 3.024 N/A GLU 172.A N GLU 172.A OE2 no hydrogen 2.685 N/A GLN 173.A N LEU 170.A O no hydrogen 2.965 N/A GLY 174.A N GLN 171.A O no hydrogen 2.948 N/A GLY 175.A N LEU 170.A O no hydrogen 2.680 N/A GLU 177.A N LYS 169.A O no hydrogen 2.926 N/A VAL 178.A N ALA 167.A O no hydrogen 2.937 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.708 N/A ILE 182.A N PRO 179.A O no hydrogen 3.107 N/A ILE 183.A N SER 180.A O no hydrogen 3.320 N/A LYS 185.A N ILE 182.A O no hydrogen 2.932 N/A LYS 185.A NZ ASP 144.A OD2 no hydrogen 3.035 N/A ILE 187.A N PHE 146.A O no hydrogen 2.803 N/A TYR 188.A OH ASP 150.A OD2 no hydrogen 2.655 N/A MET 189.A N VAL 148.A O no hydrogen 2.865 N/A ASN 193.A ND2 GLU 196.A OE1 no hydrogen 2.907 N/A GLU 196.A N ASN 193.A OD1 no hydrogen 3.294 N/A LEU 197.A N ASN 193.A O no hydrogen 3.270 N/A LEU 198.A N GLU 194.A O no hydrogen 2.919 N/A MET 199.A N LYS 195.A O no hydrogen 2.897 N/A GLU 200.A N GLU 196.A O no hydrogen 2.946 N/A TYR 201.A N LEU 197.A O no hydrogen 2.820 N/A TYR 201.A OH HIS 138.A ND1 no hydrogen 2.895 N/A LEU 202.A N LEU 198.A O no hydrogen 2.995 N/A ASN 203.A N MET 199.A O no hydrogen 3.295 N/A PHE 204.A N GLU 200.A O no hydrogen 2.988 N/A TRP 205.A N TYR 201.A O no hydrogen 2.798 N/A TRP 205.A NE1 LEU 242.A O no hydrogen 2.992 N/A GLN 206.A N LEU 202.A O no hydrogen 2.937 N/A GLN 207.A N.A ASN 203.A O no hydrogen 3.086 N/A GLN 207.A N.B ASN 203.A O no hydrogen 3.105 N/A LYS 208.A N PHE 204.A O no hydrogen 2.932 N/A LYS 208.A NZ ASP 143.A OD2 no hydrogen 2.677 N/A THR 209.A OG1 TRP 205.A O no hydrogen 2.812 N/A THR 209.A OG1 GLN 206.A O no hydrogen 3.247 N/A VAL 211.A N ARG 109.A O no hydrogen 2.914 N/A ILE 212.A N ARG 109.A O no hydrogen 3.178 N/A LEU 213.A N SER 267.A O no hydrogen 2.953 N/A THR 214.A N ALA 111.A O no hydrogen 2.915 N/A THR 214.A OG1 LEU 269.A O no hydrogen 2.701 N/A GLY 215.A N THR 214.A OG1 no hydrogen 2.573 N/A TRP 216.A NE1 TYR 286.A O no hydrogen 2.892 N/A ASN 217.A ND2 SER 220.A OG no hydrogen 2.797 N/A GLU 219.A N ASP 270.A OD2 no hydrogen 3.102 N/A SER 220.A OG ASN 217.A O no hydrogen 3.474 N/A PHE 221.A N ASN 217.A O no hydrogen 2.821 N/A ILE 223.A N VAL 218.A O no hydrogen 2.636 N/A TYR 225.A N PHE 221.A O no hydrogen 2.825 N/A TYR 225.A OH HIS 131.A O no hydrogen 2.486 N/A VAL 226.A N ALA 222.A O no hydrogen 2.983 N/A TYR 227.A N ILE 223.A O no hydrogen 3.010 N/A TYR 227.A OH THR 248.A OG1 no hydrogen 2.742 N/A ASN 228.A N PRO 224.A O no hydrogen 3.024 N/A ASN 228.A ND2 PRO 126.A O no hydrogen 2.877 N/A ASN 228.A ND2 PRO 224.A O no hydrogen 3.146 N/A ASN 228.A ND2 GLU 259.A OE2 no hydrogen 3.055 N/A ARG 229.A N TYR 225.A O no hydrogen 2.864 N/A ARG 229.A NE GLU 194.A OE1 no hydrogen 2.691 N/A ARG 229.A NH1 ALA 129.A O no hydrogen 2.892 N/A ARG 229.A NH2 GLU 194.A OE1 no hydrogen 3.403 N/A ARG 229.A NH2 GLU 194.A OE2 no hydrogen 2.790 N/A ILE 230.A N VAL 226.A O no hydrogen 3.063 N/A LYS 231.A N TYR 227.A O no hydrogen 2.908 N/A ASN 232.A N ASN 228.A O no hydrogen 2.870 N/A ASN 232.A ND2 GLN 128.A O no hydrogen 3.082 N/A ILE 233.A N ARG 229.A O no hydrogen 3.123 N/A PHE 234.A N ILE 230.A O no hydrogen 2.823 N/A GLY 235.A N LYS 231.A O no hydrogen 2.920 N/A THR 238.A N GLY 235.A O no hydrogen 3.228 N/A ALA 239.A N GLY 235.A O no hydrogen 3.180 N/A LYS 240.A N GLU 236.A O no hydrogen 3.024 N/A ARG 241.A N THR 238.A O no hydrogen 3.081 N/A ARG 241.A NE GLN 206.A OE1 no hydrogen 2.576 N/A ARG 241.A NH2 ASN 203.A OD1 no hydrogen 2.592 N/A ARG 241.A NH2 GLN 206.A OE1 no hydrogen 2.944 N/A LEU 242.A N ALA 239.A O no hydrogen 3.393 N/A SER 243.A N LYS 240.A O no hydrogen 3.175 N/A SER 243.A OG LYS 247.A O no hydrogen 3.030 N/A SER 243.A OG PHE 264.A O no hydrogen 2.574 N/A HIS 245.A N SER 243.A OG no hydrogen 3.246 N/A ARG 246.A N.A SER 243.A O no hydrogen 2.855 N/A ARG 246.A N.B SER 243.A O no hydrogen 2.852 N/A ARG 246.A NH1.A SER 243.A O no hydrogen 2.818 N/A ARG 246.A NH1.B SER 237.A O no hydrogen 2.644 N/A ARG 246.A NH2.B SER 237.A O no hydrogen 3.032 N/A LYS 247.A N SER 243.A OG no hydrogen 3.133 N/A THR 248.A OG1 TYR 227.A OH no hydrogen 2.742 N/A ARG 249.A N THR 262.A O no hydrogen 2.930 N/A LYS 251.A N ILE 260.A O no hydrogen 3.048 N/A ILE 253.A N ARG 258.A O no hydrogen 2.905 N/A ILE 260.A N LYS 251.A O no hydrogen 3.060 N/A THR 262.A N ARG 249.A O no hydrogen 2.783 N/A PHE 264.A N LYS 247.A O no hydrogen 3.087 N/A GLY 265.A N GLU 9.A OE2 no hydrogen 2.966 N/A ILE 266.A N LEU 263.A O no hydrogen 3.261 N/A SER 267.A N VAL 211.A O no hydrogen 2.946 N/A SER 267.A OG GLN 354.A OE1 no hydrogen 2.712 N/A LEU 269.A N LEU 213.A O no hydrogen 2.804 N/A TYR 271.A N GLY 215.A O no hydrogen 2.960 N/A TYR 271.A OH ASP 333.A OD1 no hydrogen 2.677 N/A ILE 272.A N ASP 270.A OD1 no hydrogen 3.403 N/A LEU 274.A N ASP 270.A O no hydrogen 2.984 N/A TYR 275.A N TYR 271.A O no hydrogen 2.695 N/A TYR 275.A OH GLU 295.A OE2 no hydrogen 2.586 N/A LYS 276.A N ILE 272.A O no hydrogen 2.941 N/A LYS 277.A N ASP 273.A O no hydrogen 3.168 N/A LYS 277.A NZ PHE 357.A O no hydrogen 3.124 N/A PHE 278.A N LEU 274.A O no hydrogen 2.930 N/A SER 279.A N TYR 275.A O no hydrogen 2.989 N/A SER 279.A OG TYR 275.A O no hydrogen 2.612 N/A SER 279.A OG THR 281.A OG1 no hydrogen 2.846 N/A THR 281.A OG1 SER 279.A OG no hydrogen 2.846 N/A GLN 283.A N TYR 286.A OH no hydrogen 3.050 N/A GLN 283.A NE2 TYR 275.A OH no hydrogen 2.990 N/A TYR 290.A N SER 287.A OG no hydrogen 3.166 N/A ILE 291.A N SER 287.A O no hydrogen 3.001 N/A SER 292.A N LEU 288.A O no hydrogen 2.801 N/A SER 292.A OG LEU 288.A O no hydrogen 2.784 N/A GLU 293.A N ASP 289.A O no hydrogen 3.116 N/A PHE 294.A N TYR 290.A O no hydrogen 3.061 N/A GLU 295.A N ILE 291.A O no hydrogen 2.836 N/A LEU 296.A N SER 292.A O no hydrogen 2.795 N/A ASN 297.A N.A GLU 293.A O no hydrogen 3.139 N/A ASN 297.A N.B GLU 293.A O no hydrogen 3.136 N/A LEU 301.A N ASP 289.A OD1 no hydrogen 3.385 N/A LYS 309.A N PRO 306.A O no hydrogen 3.126 N/A LEU 310.A N ILE 307.A O no hydrogen 2.978 N/A ARG 311.A NH1 GLY 157.A O no hydrogen 2.752 N/A ARG 311.A NH2 LEU 151.A O no hydrogen 2.708 N/A ARG 311.A NH2 GLY 157.A O no hydrogen 3.279 N/A SER 313.A N LYS 309.A O no hydrogen 3.173 N/A SER 313.A OG LYS 309.A O no hydrogen 2.690 N/A SER 313.A OG LEU 310.A O no hydrogen 3.388 N/A ASN 314.A N LEU 310.A O no hydrogen 2.847 N/A HIS 315.A NE2 ASP 150.A OD1 no hydrogen 2.806 N/A GLN 316.A NE2 SER 163.A O no hydrogen 2.878 N/A GLN 316.A NE2 ASP 176.A OD2 no hydrogen 3.055 N/A ARG 317.A N ASN 314.A OD1 no hydrogen 3.057 N/A ARG 317.A NE ASP 176.A OD1 no hydrogen 3.118 N/A ARG 317.A NH2 GLY 175.A O no hydrogen 2.710 N/A ARG 317.A NH2 ASP 176.A OD1 no hydrogen 3.523 N/A TYR 318.A N ASN 314.A O no hydrogen 2.978 N/A TYR 318.A OH ASP 134.A OD1 no hydrogen 2.618 N/A TYR 318.A OH ASP 134.A OD2 no hydrogen 3.287 N/A ILE 319.A N HIS 315.A O no hydrogen 3.073 N/A SER 320.A N GLN 316.A O no hydrogen 3.276 N/A SER 320.A OG ASP 176.A OD2 no hydrogen 2.697 N/A SER 320.A OG GLN 316.A O no hydrogen 3.182 N/A TYR 321.A N ARG 317.A O no hydrogen 2.788 N/A TYR 321.A OH LYS 302.A O no hydrogen 2.395 N/A ASN 322.A N TYR 318.A O no hydrogen 3.177 N/A ASN 322.A ND2 ASP 114.A O no hydrogen 3.358 N/A ASN 322.A ND2 GLU 116.A OE2 no hydrogen 3.062 N/A ILE 323.A N ILE 319.A O no hydrogen 3.007 N/A ILE 324.A N SER 320.A O no hydrogen 2.914 N/A ALA 325.A N TYR 321.A O no hydrogen 2.874 N/A TYR 327.A N ILE 323.A O no hydrogen 3.134 N/A TYR 327.A OH GLU 181.A OE2 no hydrogen 2.828 N/A ARG 328.A N ILE 324.A O no hydrogen 2.739 N/A ARG 328.A NH2 GLY 299.A O no hydrogen 3.533 N/A LEU 330.A N VAL 326.A O no hydrogen 3.408 N/A GLN 331.A N TYR 327.A O no hydrogen 2.867 N/A ILE 332.A N ARG 328.A O no hydrogen 2.908 N/A ASP 333.A N VAL 329.A O no hydrogen 2.857 N/A ALA 334.A N LEU 330.A O no hydrogen 2.849 N/A LYS 335.A N GLN 331.A O no hydrogen 3.181 N/A LYS 335.A N ILE 332.A O no hydrogen 3.154 N/A LYS 335.A NZ GLU 295.A O no hydrogen 2.813 N/A LYS 335.A NZ GLU 295.A OE1 no hydrogen 3.082 N/A ARG 336.A N ILE 332.A O no hydrogen 2.749 N/A ARG 336.A NE GLU 295.A OE1 no hydrogen 2.899 N/A ARG 336.A NE GLU 295.A OE2 no hydrogen 3.376 N/A ARG 336.A NH1 SER 279.A O no hydrogen 3.193 N/A ARG 336.A NH2 GLU 295.A OE1 no hydrogen 3.557 N/A ARG 336.A NH2 GLU 295.A OE2 no hydrogen 2.777 N/A GLN 337.A N ASP 333.A O no hydrogen 2.648 N/A GLN 337.A NE2 ALA 334.A O no hydrogen 3.336 N/A PHE 338.A N ASP 333.A OD1 no hydrogen 3.083 N/A ILE 339.A N.A ASP 333.A OD1 no hydrogen 3.252 N/A ILE 339.A N.B ASP 333.A OD1 no hydrogen 3.242 N/A LEU 341.A N GLN 337.A O no hydrogen 3.257 N/A SER 342.A N PHE 338.A O no hydrogen 2.848 N/A SER 342.A OG PHE 338.A O no hydrogen 2.834 N/A LEU 343.A N ILE 339.A O.A no hydrogen 2.979 N/A LEU 343.A N ILE 339.A O.B no hydrogen 2.957 N/A ASP 344.A N ASN 340.A O no hydrogen 3.015 N/A MET 345.A N.A LEU 341.A O no hydrogen 3.001 N/A MET 345.A N.B LEU 341.A O no hydrogen 3.008 N/A GLY 346.A N SER 342.A O no hydrogen 2.836 N/A TYR 347.A N LEU 343.A O no hydrogen 3.033 N/A TYR 347.A OH TYR 5.A O no hydrogen 2.647 N/A TYR 348.A N ASP 344.A O no hydrogen 2.977 N/A ALA 349.A N MET 345.A O.A no hydrogen 2.921 N/A ALA 349.A N MET 345.A O.B no hydrogen 2.959 N/A LYS 350.A NZ TYR 97.A O no hydrogen 2.657 N/A LYS 350.A NZ TYR 99.A O no hydrogen 3.034 N/A ILE 351.A N GLY 346.A O no hydrogen 3.139 N/A GLN 352.A NE2 VAL 8.A O no hydrogen 2.726 N/A GLN 352.A NE2 GLU 9.A OE1 no hydrogen 3.512 N/A GLN 354.A N GLN 354.A OE1 no hydrogen 2.904 N/A SER 355.A N GLN 352.A O no hydrogen 2.981 N/A VAL 356.A N ILE 353.A O no hydrogen 3.211 N/A SER 358.A N SER 355.A O no hydrogen 2.981 N/A LYS 361.A N SER 358.A OG no hydrogen 3.158 N/A LYS 361.A NZ ASP 87.A OD2 no hydrogen 2.635 N/A THR 362.A N SER 358.A O no hydrogen 2.940 N/A THR 362.A OG1 SER 355.A O no hydrogen 3.251 N/A THR 362.A OG1 SER 358.A O no hydrogen 2.799 N/A TRP 363.A N PRO 359.A O no hydrogen 2.835 N/A TRP 363.A NE1 LEU 560.A O no hydrogen 2.761 N/A ASP 364.A N ILE 360.A O no hydrogen 2.905 N/A ALA 365.A N LYS 361.A O no hydrogen 3.235 N/A ILE 366.A N THR 362.A O no hydrogen 3.117 N/A ILE 367.A N TRP 363.A O no hydrogen 2.829 N/A PHE 368.A N ASP 364.A O no hydrogen 2.961 N/A ASN 369.A N ALA 365.A O no hydrogen 2.933 N/A ASN 369.A ND2 ALA 365.A O no hydrogen 2.661 N/A SER 370.A N ILE 366.A O no hydrogen 3.057 N/A SER 370.A OG GLU 472.A OE1 no hydrogen 2.767 N/A LEU 371.A N ILE 367.A O no hydrogen 2.938 N/A LYS 372.A N PHE 368.A O no hydrogen 2.829 N/A GLU 373.A N ASN 369.A O no hydrogen 3.151 N/A GLN 374.A N LEU 371.A O no hydrogen 3.197 N/A GLN 374.A NE2 SER 370.A O no hydrogen 3.318 N/A ASN 375.A N LYS 372.A O no hydrogen 3.012 N/A LYS 376.A N LEU 371.A O no hydrogen 2.913 N/A VAL 377.A N PHE 50.A O no hydrogen 2.888 N/A GLN 380.A N GLU 81.A OE2 no hydrogen 3.015 N/A LYS 395.A N GLY 618.A O no hydrogen 2.897 N/A LYS 395.A NZ GLU 596.A OE2 no hydrogen 3.314 N/A ASN 400.A N TRP 700.A O no hydrogen 3.207 N/A ARG 401.A N ASN 400.A OD1 no hydrogen 2.809 N/A ARG 401.A NE ALA 885.A O no hydrogen 2.816 N/A ARG 401.A NH2 ALA 885.A O no hydrogen 2.898 N/A ARG 401.A NH2 LYS 886.A O no hydrogen 2.804 N/A TYR 402.A N GLY 698.A O no hydrogen 2.842 N/A TYR 402.A OH ILE 398.A O no hydrogen 2.481 N/A TYR 404.A N ASP 628.A OD1 no hydrogen 2.961 N/A VAL 405.A N ALA 687.A O no hydrogen 3.128 N/A MET 406.A N VAL 625.A O no hydrogen 2.923 N/A SER 407.A N ALA 685.A O no hydrogen 3.045 N/A PHE 408.A N ILE 623.A O no hydrogen 2.931 N/A ASP 409.A N ASP 682.A O no hydrogen 2.893 N/A LEU 410.A N ASP 621.A O no hydrogen 3.115 N/A THR 411.A N PHE 680.A O no hydrogen 2.969 N/A THR 411.A OG1 PHE 680.A O no hydrogen 3.368 N/A SER 416.A N SER 412.A O.A no hydrogen 2.867 N/A SER 416.A N SER 412.A O.B no hydrogen 2.872 N/A SER 416.A OG THR 411.A O no hydrogen 2.769 N/A SER 416.A OG SER 412.A O.A no hydrogen 2.792 N/A SER 416.A OG SER 412.A O.B no hydrogen 2.774 N/A ILE 417.A N PHE 413.A O no hydrogen 2.884 N/A ILE 418.A N TYR 414.A O no hydrogen 2.983 N/A ARG 419.A N PRO 415.A O no hydrogen 3.025 N/A GLN 420.A N SER 416.A O no hydrogen 2.750 N/A GLN 420.A NE2 ASN 674.A OD1 no hydrogen 2.956 N/A VAL 421.A N ILE 417.A O no hydrogen 2.862 N/A ASN 422.A ND2 TYR 462.A O no hydrogen 2.729 N/A ASN 422.A ND2 ARG 465.A O no hydrogen 2.743 N/A ILE 423.A N ILE 418.A O no hydrogen 2.975 N/A SER 424.A OG GLU 426.A OE1 no hydrogen 2.551 N/A GLU 426.A N GLU 426.A OE1 no hydrogen 2.511 N/A THR 427.A N SER 424.A O no hydrogen 3.286 N/A THR 427.A OG1 ASN 422.A O no hydrogen 2.704 N/A THR 427.A OG1 SER 424.A O no hydrogen 3.273 N/A ALA 429.A N MET 460.A O no hydrogen 2.777 N/A GLY 430.A N MET 460.A O no hydrogen 3.364 N/A PHE 432.A N GLY 458.A O no hydrogen 2.930 N/A ALA 435.A N TYR 440.A OH no hydrogen 3.044 N/A ASP 439.A N PRO 436.A O no hydrogen 2.979 N/A TYR 440.A N LEU 437.A O no hydrogen 3.144 N/A ILE 441.A N LEU 437.A O no hydrogen 3.095 N/A ASN 442.A N HIS 438.A O no hydrogen 2.803 N/A ALA 443.A N TYR 440.A O no hydrogen 3.327 N/A VAL 444.A N ASP 439.A O no hydrogen 2.745 N/A ALA 445.A N ASP 439.A O no hydrogen 3.066 N/A ARG 447.A NE GLU 670.A O no hydrogen 2.926 N/A ARG 447.A NH2 GLU 670.A O no hydrogen 2.811 N/A VAL 451.A N SER 449.A OG no hydrogen 2.993 N/A TYR 452.A N SER 449.A OG no hydrogen 2.837 N/A SER 453.A N TYR 461.A O no hydrogen 2.636 N/A SER 453.A OG VAL 421.A O no hydrogen 2.749 N/A CYS 454.A N MET 672.A O no hydrogen 2.964 N/A CYS 454.A SG TYR 452.A O no hydrogen 3.597 N/A SER 455.A N MET 459.A O no hydrogen 3.093 N/A SER 455.A OG ASN 457.A OD1 no hydrogen 3.227 N/A SER 455.A OG ALA 583.A O no hydrogen 2.594 N/A ASN 457.A ND2 ARG 579.A O no hydrogen 3.136 N/A GLY 458.A N SER 455.A O no hydrogen 3.032 N/A MET 459.A N ASN 457.A OD1 no hydrogen 3.052 N/A MET 460.A N GLY 430.A O no hydrogen 2.862 N/A TYR 461.A N SER 453.A O no hydrogen 2.532 N/A TYR 461.A OH ASN 580.A OD1 no hydrogen 2.793 N/A TYR 462.A N THR 427.A O no hydrogen 3.083 N/A LYS 463.A NZ ASN 673.A OD1 no hydrogen 3.044 N/A ARG 465.A N ASP 464.A OD1.B no hydrogen 2.955 N/A VAL 468.A N GLU 426.A OE2 no hydrogen 2.829 N/A VAL 469.A N SER 424.A OG no hydrogen 3.280 N/A THR 471.A N GLY 467.A O no hydrogen 2.798 N/A THR 471.A OG1 GLY 467.A O no hydrogen 2.810 N/A GLU 472.A N VAL 468.A O no hydrogen 3.051 N/A ILE 473.A N VAL 469.A O no hydrogen 3.013 N/A THR 474.A N PRO 470.A O no hydrogen 3.096 N/A THR 474.A OG1 PRO 470.A O no hydrogen 2.444 N/A LYS 475.A N THR 471.A O no hydrogen 3.446 N/A PHE 477.A N ILE 473.A O no hydrogen 3.094 N/A ASN 478.A N THR 474.A O no hydrogen 2.953 N/A GLN 479.A N LYS 475.A O no hydrogen 3.399 N/A ARG 480.A N VAL 476.A O no hydrogen 2.990 N/A ARG 480.A NE GLN 554.A OE1 no hydrogen 2.986 N/A ARG 480.A NH2 GLN 554.A OE1 no hydrogen 3.105 N/A LYS 481.A N PHE 477.A O no hydrogen 2.869 N/A GLU 482.A N ASN 478.A O no hydrogen 3.274 N/A HIS 483.A N GLN 479.A O no hydrogen 3.176 N/A LYS 484.A N ARG 480.A O no hydrogen 2.971 N/A LYS 484.A NZ GLU 714.A OE1 no hydrogen 2.995 N/A GLY 485.A N LYS 481.A O no hydrogen 3.195 N/A TYR 486.A N GLU 482.A O no hydrogen 3.321 N/A TYR 486.A OH GLU 482.A OE2 no hydrogen 2.650 N/A MET 487.A N HIS 483.A O no hydrogen 3.054 N/A LEU 488.A N LYS 484.A O no hydrogen 2.908 N/A ALA 489.A N GLY 485.A O no hydrogen 3.184 N/A ALA 490.A N TYR 486.A O no hydrogen 3.058 N/A GLN 491.A N MET 487.A O no hydrogen 2.932 N/A GLN 491.A NE2 GLU 547.A OE2 no hydrogen 3.443 N/A ARG 492.A N LEU 488.A O no hydrogen 2.762 N/A ARG 492.A NE ASP 519.A OD1 no hydrogen 2.618 N/A ARG 492.A NH2 ASP 519.A OD1 no hydrogen 3.349 N/A ARG 492.A NH2 ASP 519.A OD2 no hydrogen 3.179 N/A ASN 493.A N ALA 489.A O no hydrogen 2.752 N/A ASN 493.A ND2 TYR 516.A O no hydrogen 2.969 N/A ASN 493.A ND2 PHE 518.A O no hydrogen 2.760 N/A GLY 494.A N ALA 490.A O no hydrogen 2.940 N/A GLU 495.A N GLN 491.A O no hydrogen 3.258 N/A ILE 496.A N ARG 492.A O no hydrogen 3.346 N/A ILE 497.A N ASN 493.A O no hydrogen 3.307 N/A LYS 498.A N GLY 494.A O no hydrogen 3.048 N/A LYS 498.A NZ GLU 495.A OE2 no hydrogen 3.338 N/A GLU 499.A N GLU 495.A O no hydrogen 2.953 N/A ALA 500.A N ILE 496.A O no hydrogen 3.177 N/A LEU 501.A N LYS 498.A O no hydrogen 3.258 N/A HIS 502.A N GLU 499.A O no hydrogen 3.305 N/A ASN 503.A N ALA 500.A O no hydrogen 3.374 N/A ASN 505.A N LEU 531.A O no hydrogen 3.309 N/A ARG 517.A N ASP 515.A OD1 no hydrogen 3.144 N/A ARG 517.A NE ASP 515.A OD1 no hydrogen 2.982 N/A ARG 517.A NH2 ASP 515.A OD2 no hydrogen 2.863 N/A PHE 518.A N ASP 515.A O no hydrogen 3.299 N/A PHE 520.A N ASN 493.A OD1 no hydrogen 2.936 N/A SER 521.A OG GLU 523.A OE1 no hydrogen 3.345 N/A GLU 523.A N GLU 523.A OE1 no hydrogen 2.575 N/A LYS 525.A N SER 521.A O no hydrogen 3.042 N/A GLU 526.A N ASP 522.A O no hydrogen 3.439 N/A LYS 527.A N GLU 523.A O no hydrogen 3.294 N/A ILE 528.A N ILE 524.A O no hydrogen 3.010 N/A LYS 529.A N LYS 525.A O no hydrogen 3.342 N/A LYS 530.A N LYS 527.A O no hydrogen 3.061 N/A LEU 531.A N ILE 528.A O no hydrogen 3.204 N/A SER 532.A N ASP 509.A OD2 no hydrogen 2.763 N/A SER 532.A OG ASP 509.A OD1 no hydrogen 2.501 N/A SER 532.A OG ASP 509.A OD2 no hydrogen 3.446 N/A SER 535.A N SER 532.A OG no hydrogen 3.326 N/A SER 535.A OG ASP 509.A OD1 no hydrogen 2.328 N/A LEU 536.A N SER 532.A O no hydrogen 2.895 N/A ASN 537.A N ALA 533.A O no hydrogen 2.902 N/A GLU 538.A N LYS 534.A O no hydrogen 3.093 N/A MET 539.A N SER 535.A O no hydrogen 3.003 N/A LEU 540.A N LEU 536.A O no hydrogen 2.807 N/A PHE 541.A N ASN 537.A O no hydrogen 3.031 N/A ARG 542.A N GLU 538.A O no hydrogen 3.137 N/A ARG 542.A NE GLU 538.A OE1 no hydrogen 2.832 N/A ARG 542.A NH2 GLU 538.A OE1 no hydrogen 3.250 N/A ALA 543.A N MET 539.A O no hydrogen 2.785 N/A GLN 544.A N LEU 540.A O no hydrogen 3.042 N/A ARG 545.A N PHE 541.A O no hydrogen 3.031 N/A THR 546.A N ARG 542.A O no hydrogen 2.971 N/A THR 546.A OG1 ARG 542.A O no hydrogen 2.981 N/A GLU 547.A N ALA 543.A O no hydrogen 3.038 N/A VAL 548.A N GLN 544.A O no hydrogen 2.896 N/A ALA 549.A N ARG 545.A O no hydrogen 3.043 N/A GLY 550.A N THR 546.A O no hydrogen 2.978 N/A MET 551.A N GLU 547.A O no hydrogen 2.817 N/A THR 552.A N VAL 548.A O no hydrogen 2.939 N/A THR 552.A OG1 ARG 336.A O no hydrogen 2.775 N/A THR 552.A OG1 VAL 548.A O no hydrogen 3.397 N/A ALA 553.A N ALA 549.A O no hydrogen 3.183 N/A GLN 554.A N GLY 550.A O no hydrogen 2.911 N/A ILE 555.A N MET 551.A O no hydrogen 2.813 N/A ASN 556.A ND2 PHE 278.A O no hydrogen 3.368 N/A ASN 556.A ND2 THR 552.A O no hydrogen 2.975 N/A ARG 557.A NE GLN 479.A OE1 no hydrogen 3.077 N/A ARG 557.A NH1 ALA 553.A O no hydrogen 2.886 N/A ARG 557.A NH2 ASP 344.A OD2 no hydrogen 3.355 N/A LYS 558.A N GLN 554.A O no hydrogen 3.026 N/A LEU 559.A N ILE 555.A O no hydrogen 2.960 N/A LEU 560.A N ASN 556.A O no hydrogen 2.960 N/A ILE 561.A N ARG 557.A O no hydrogen 3.062 N/A ASN 562.A N LYS 558.A O no hydrogen 3.034 N/A SER 563.A N LEU 559.A O no hydrogen 2.883 N/A SER 563.A OG LEU 559.A O no hydrogen 2.677 N/A LEU 564.A N LEU 560.A O no hydrogen 3.091 N/A LEU 564.A N ILE 561.A O no hydrogen 3.121 N/A TYR 565.A N ILE 561.A O no hydrogen 3.376 N/A GLY 566.A N ASN 562.A O no hydrogen 3.091 N/A ALA 567.A N SER 563.A O no hydrogen 2.705 N/A LEU 568.A N LEU 564.A O no hydrogen 3.320 N/A LEU 568.A N TYR 565.A O no hydrogen 3.149 N/A GLY 569.A N GLY 566.A O no hydrogen 2.819 N/A ASN 570.A N ALA 567.A O no hydrogen 2.843 N/A TRP 572.A N ASN 570.A OD1 no hydrogen 2.875 N/A PHE 573.A N ASN 570.A O no hydrogen 3.023 N/A ARG 574.A NE ASP 364.A OD1 no hydrogen 2.775 N/A ARG 574.A NH1 ASP 86.A OD1 no hydrogen 3.362 N/A ARG 574.A NH1 PRO 379.A O no hydrogen 2.923 N/A ARG 574.A NH2 ASP 86.A OD1 no hydrogen 3.061 N/A ARG 574.A NH2 ASP 364.A OD2 no hydrogen 3.023 N/A TYR 576.A N PHE 573.A O no hydrogen 3.026 N/A ASP 577.A N LEU 568.A O no hydrogen 3.018 N/A ARG 579.A N ASP 577.A OD1 no hydrogen 3.071 N/A ARG 579.A NE ASP 577.A OD1 no hydrogen 2.878 N/A ARG 579.A NE ASP 577.A OD2 no hydrogen 3.248 N/A ARG 579.A NH2 ASP 577.A OD2 no hydrogen 2.636 N/A ASN 580.A N ASP 577.A O no hydrogen 3.015 N/A ALA 581.A N ASP 577.A O no hydrogen 3.093 N/A THR 582.A N LEU 578.A O no hydrogen 2.917 N/A THR 582.A OG1 LEU 578.A O no hydrogen 3.234 N/A ALA 583.A N ARG 579.A O no hydrogen 3.014 N/A ILE 584.A N ASN 580.A O no hydrogen 3.180 N/A ILE 584.A N ALA 581.A O no hydrogen 3.244 N/A THR 585.A N ALA 581.A O no hydrogen 3.230 N/A THR 585.A OG1 PRO 390.A O no hydrogen 2.941 N/A THR 585.A OG1 THR 582.A O no hydrogen 3.307 N/A THR 586.A N THR 582.A O no hydrogen 2.860 N/A THR 586.A OG1 THR 582.A O no hydrogen 2.687 N/A PHE 587.A N ALA 583.A O no hydrogen 3.313 N/A GLY 588.A N ILE 584.A O no hydrogen 2.925 N/A GLN 589.A N THR 585.A O no hydrogen 2.853 N/A GLN 589.A NE2 GLY 391.A O no hydrogen 2.797 N/A MET 590.A N THR 586.A O no hydrogen 2.968 N/A ALA 591.A N PHE 587.A O no hydrogen 2.730 N/A LEU 592.A N GLY 588.A O no hydrogen 2.988 N/A GLN 593.A N GLN 589.A O no hydrogen 3.305 N/A GLN 593.A NE2 GLN 589.A O no hydrogen 3.102 N/A TRP 594.A N MET 590.A O no hydrogen 2.734 N/A TRP 594.A NE1 GLY 664.A O no hydrogen 2.753 N/A ILE 595.A N ALA 591.A O no hydrogen 3.125 N/A GLU 596.A N LEU 592.A O no hydrogen 3.024 N/A ARG 597.A N GLN 593.A O no hydrogen 3.231 N/A ARG 597.A NE ILE 441.A O no hydrogen 2.952 N/A ARG 597.A NH1 GLU 601.A OE2 no hydrogen 3.098 N/A ARG 597.A NH2 ILE 441.A O no hydrogen 3.308 N/A LYS 598.A N TRP 594.A O no hydrogen 3.102 N/A LYS 598.A NZ GLU 667.A OE1 no hydrogen 2.991 N/A LYS 598.A NZ GLU 667.A OE2 no hydrogen 3.495 N/A VAL 599.A N ILE 595.A O no hydrogen 2.965 N/A ASN 600.A N GLU 596.A O no hydrogen 3.058 N/A GLU 601.A N ARG 597.A O no hydrogen 2.949 N/A TYR 602.A N LYS 598.A O no hydrogen 2.891 N/A LEU 603.A N VAL 599.A O no hydrogen 2.999 N/A ASN 604.A N ASN 600.A O no hydrogen 3.070 N/A ASN 604.A ND2 ASN 600.A O no hydrogen 2.628 N/A ASN 604.A ND2 GLU 612.A O no hydrogen 2.719 N/A GLU 605.A N GLU 601.A O no hydrogen 3.189 N/A VAL 606.A N TYR 602.A O no hydrogen 2.788 N/A CYS 607.A N LEU 603.A O no hydrogen 2.567 N/A CYS 607.A SG LYS 629.A O no hydrogen 3.544 N/A GLY 608.A N GLU 605.A O no hydrogen 2.886 N/A GLU 610.A N THR 609.A OG1 no hydrogen 2.542 N/A GLU 612.A N ASN 604.A OD1 no hydrogen 2.754 N/A PHE 614.A N ASN 600.A OD1 no hydrogen 3.029 N/A VAL 615.A N ASN 600.A OD1 no hydrogen 3.073 N/A LEU 616.A N TYR 624.A O no hydrogen 2.914 N/A ASP 619.A N SER 622.A OG no hydrogen 3.334 N/A THR 620.A N PHE 393.A O no hydrogen 2.950 N/A THR 620.A OG1 ASP 619.A OD1 no hydrogen 2.747 N/A ASP 621.A N ASP 619.A O no hydrogen 2.548 N/A SER 622.A N ASP 619.A O no hydrogen 3.269 N/A SER 622.A OG ASP 619.A O no hydrogen 3.399 N/A ILE 623.A N PHE 408.A O no hydrogen 2.976 N/A TYR 624.A N TYR 617.A O no hydrogen 2.914 N/A VAL 625.A N MET 406.A O no hydrogen 2.785 N/A SER 626.A N PHE 614.A O no hydrogen 2.823 N/A ALA 627.A N TYR 404.A O no hydrogen 2.719 N/A ILE 631.A N ALA 627.A O no hydrogen 3.237 N/A ASP 632.A N ASP 628.A O no hydrogen 2.837 N/A LYS 633.A N LYS 629.A O no hydrogen 3.167 N/A VAL 634.A N ILE 631.A O no hydrogen 3.104 N/A GLY 635.A N ASP 632.A O no hydrogen 3.197 N/A PHE 639.A N GLU 636.A O no hydrogen 3.492 N/A ARG 640.A N HIS 644.A ND1 no hydrogen 3.002 N/A HIS 644.A N ASP 641.A O no hydrogen 3.014 N/A HIS 644.A N ASP 641.A OD1 no hydrogen 3.184 N/A VAL 646.A N THR 642.A O no hydrogen 3.399 N/A ASP 647.A N ASN 643.A O no hydrogen 2.979 N/A PHE 648.A N HIS 644.A O no hydrogen 3.012 N/A LEU 649.A N TRP 645.A O no hydrogen 2.883 N/A ASP 650.A N VAL 646.A O no hydrogen 2.987 N/A LYS 651.A N ASP 647.A O no hydrogen 3.067 N/A PHE 652.A N PHE 648.A O no hydrogen 2.786 N/A ALA 653.A N LEU 649.A O no hydrogen 2.727 N/A ARG 654.A N ASP 650.A O no hydrogen 3.079 N/A ARG 654.A NH2 ASP 650.A OD2 no hydrogen 3.360 N/A GLU 655.A N LYS 651.A O no hydrogen 2.755 N/A ARG 656.A N PHE 652.A O no hydrogen 3.069 N/A MET 657.A N PHE 652.A O no hydrogen 3.212 N/A GLU 658.A N ALA 653.A O no hydrogen 2.938 N/A ALA 660.A N ARG 656.A O no hydrogen 3.442 N/A ILE 661.A N MET 657.A O no hydrogen 2.790 N/A ASP 662.A N GLU 658.A O no hydrogen 2.885 N/A ARG 663.A N PRO 659.A O no hydrogen 3.008 N/A GLY 664.A N ALA 660.A O no hydrogen 3.080 N/A PHE 665.A N ILE 661.A O no hydrogen 3.104 N/A ARG 666.A N ASP 662.A O no hydrogen 2.877 N/A GLU 667.A N ARG 663.A O no hydrogen 3.127 N/A MET 668.A N GLY 664.A O no hydrogen 3.273 N/A CYS 669.A N PHE 665.A O no hydrogen 2.820 N/A GLU 670.A N ARG 666.A O no hydrogen 2.988 N/A TYR 671.A N GLU 667.A O no hydrogen 2.793 N/A TYR 671.A OH ALA 445.A O no hydrogen 2.295 N/A MET 672.A N MET 668.A O no hydrogen 2.915 N/A ASN 673.A N GLU 670.A O no hydrogen 3.039 N/A ASN 673.A ND2 SER 449.A O no hydrogen 3.614 N/A ASN 673.A ND2 TYR 452.A O no hydrogen 3.106 N/A ASN 674.A N CYS 669.A O no hydrogen 2.981 N/A ASN 674.A ND2 SER 453.A OG no hydrogen 3.061 N/A ASN 674.A ND2 CYS 454.A O no hydrogen 3.146 N/A LYS 675.A N GLN 420.A O no hydrogen 3.002 N/A LYS 675.A NZ ASP 466.A OD1 no hydrogen 3.277 N/A LEU 678.A N GLN 420.A OE1 no hydrogen 2.817 N/A ASP 682.A N ASP 409.A O no hydrogen 3.092 N/A ARG 683.A N GLU 658.A OE2 no hydrogen 3.285 N/A ARG 683.A NE GLU 684.A O no hydrogen 3.300 N/A ARG 683.A NH2 GLU 684.A O no hydrogen 2.894 N/A ARG 683.A NH2 ASP 712.A OD1 no hydrogen 2.308 N/A GLU 684.A N SER 407.A O no hydrogen 2.797 N/A ALA 685.A N SER 407.A OG no hydrogen 2.799 N/A ILE 686.A N ASP 712.A O no hydrogen 3.022 N/A ALA 687.A N VAL 405.A O no hydrogen 2.710 N/A GLY 688.A N ASN 709.A O no hydrogen 3.107 N/A LEU 691.A N THR 642.A OG1 no hydrogen 2.613 N/A SER 693.A N PRO 690.A O no hydrogen 3.245 N/A SER 693.A OG PRO 690.A O no hydrogen 2.679 N/A SER 693.A OG GLN 752.A O no hydrogen 3.503 N/A GLY 695.A N SER 693.A OG no hydrogen 3.395 N/A ILE 696.A N MET 750.A O no hydrogen 3.004 N/A GLY 697.A N LEU 751.A O no hydrogen 3.030 N/A GLY 698.A N ILE 696.A O no hydrogen 2.838 N/A PHE 699.A N ALA 707.A O no hydrogen 3.047 N/A TRP 700.A N ASN 400.A O no hydrogen 2.934 N/A THR 701.A N ARG 705.A O no hydrogen 3.099 N/A LYS 703.A NZ VAL 394.A O no hydrogen 3.319 N/A LYS 704.A N TYR 617.A OH no hydrogen 2.906 N/A LYS 704.A NZ ASP 619.A OD2 no hydrogen 2.813 N/A ARG 705.A N GLY 702.A O no hydrogen 3.393 N/A ARG 705.A NH2 GLU 729.A OE1 no hydrogen 2.703 N/A TYR 706.A N MET 726.A O no hydrogen 3.063 N/A TYR 706.A OH TYR 624.A OH no hydrogen 2.653 N/A ALA 707.A N PHE 699.A O no hydrogen 3.068 N/A LEU 708.A N LYS 724.A O no hydrogen 2.918 N/A ASN 709.A N GLY 697.A O no hydrogen 2.821 N/A ASN 709.A ND2 GLY 688.A O no hydrogen 2.943 N/A VAL 710.A N LYS 722.A O no hydrogen 3.023 N/A TRP 711.A N ILE 686.A O no hydrogen 2.900 N/A TRP 711.A NE1 GLY 688.A O no hydrogen 2.748 N/A MET 713.A N THR 716.A O no hydrogen 2.985 N/A GLU 714.A N GLU 684.A O no hydrogen 2.837 N/A GLY 715.A N ASP 712.A OD1 no hydrogen 3.136 N/A THR 716.A N MET 713.A O no hydrogen 3.070 N/A THR 716.A OG1 GLN 491.A OE1 no hydrogen 2.993 N/A ARG 717.A NE ASP 712.A OD2 no hydrogen 2.712 N/A ARG 717.A NH1 ASP 647.A OD1 no hydrogen 3.422 N/A ARG 717.A NH1 ASP 647.A OD2 no hydrogen 3.461 N/A ARG 717.A NH2 ASP 647.A OD1 no hydrogen 3.309 N/A TYR 718.A N TRP 711.A O no hydrogen 3.175 N/A ALA 719.A N GLU 495.A OE1 no hydrogen 2.952 N/A LYS 722.A N VAL 710.A O no hydrogen 3.083 N/A LYS 724.A N LEU 708.A O no hydrogen 2.812 N/A MET 726.A N TYR 706.A O no hydrogen 2.938 N/A GLU 729.A N GLU 729.A OE1 no hydrogen 2.624 N/A THR 730.A OG1 GLN 731.A OE1 no hydrogen 2.727 N/A GLN 731.A N LEU 728.A O no hydrogen 2.867 N/A LYS 732.A N GLU 729.A O no hydrogen 3.170 N/A THR 735.A N LYS 732.A O no hydrogen 3.269 N/A THR 735.A OG1 GLU 729.A O no hydrogen 2.734 N/A LYS 737.A NZ GLN 740.A OE1 no hydrogen 3.316 N/A ALA 738.A N SER 776.A O no hydrogen 2.752 N/A GLN 740.A N PRO 736.A O no hydrogen 2.849 N/A GLN 740.A NE2 LYS 732.A O no hydrogen 2.458 N/A LYS 741.A N LYS 737.A O no hydrogen 3.036 N/A ALA 742.A N ALA 738.A O no hydrogen 2.758 N/A LEU 743.A N VAL 739.A O no hydrogen 2.706 N/A LYS 744.A N GLN 740.A O no hydrogen 2.979 N/A GLU 745.A N LYS 741.A O no hydrogen 3.204 N/A CYS 746.A N ALA 742.A O no hydrogen 3.057 N/A CYS 746.A SG ALA 742.A O no hydrogen 3.395 N/A ILE 747.A N LEU 743.A O no hydrogen 2.912 N/A ARG 748.A N LYS 744.A O no hydrogen 2.695 N/A ARG 748.A NE GLU 745.A OE1 no hydrogen 3.171 N/A ARG 748.A NE GLU 745.A OE2 no hydrogen 2.818 N/A ARG 748.A NH1 GLN 752.A OE1 no hydrogen 2.884 N/A ARG 748.A NH1 GLU 753.A OE2 no hydrogen 3.132 N/A ARG 748.A NH2 GLU 745.A OE1 no hydrogen 2.682 N/A ARG 748.A NH2 GLU 753.A OE2 no hydrogen 3.165 N/A ARG 749.A N GLU 745.A O no hydrogen 2.948 N/A ARG 749.A NE GLU 745.A OE1 no hydrogen 3.079 N/A ARG 749.A NH1 SER 757.A O no hydrogen 3.037 N/A ARG 749.A NH1 SER 757.A OG no hydrogen 2.664 N/A MET 750.A N CYS 746.A O no hydrogen 2.956 N/A LEU 751.A N ILE 747.A O no hydrogen 2.913 N/A GLN 752.A N ARG 748.A O no hydrogen 2.830 N/A GLN 752.A NE2 ASN 709.A OD1 no hydrogen 2.826 N/A GLU 753.A N ARG 749.A O no hydrogen 2.833 N/A GLY 754.A N ARG 749.A O no hydrogen 2.504 N/A SER 757.A OG GLU 753.A OE1 no hydrogen 2.544 N/A LEU 758.A N GLY 754.A O no hydrogen 3.142 N/A GLN 759.A N GLU 755.A O no hydrogen 3.084 N/A GLU 760.A N GLU 756.A O no hydrogen 3.001 N/A TYR 761.A N SER 757.A O no hydrogen 3.119 N/A PHE 762.A N LEU 758.A O no hydrogen 2.849 N/A LYS 763.A N GLN 759.A O no hydrogen 3.054 N/A PHE 765.A N TYR 761.A O no hydrogen 2.982 N/A GLU 766.A N PHE 762.A O no hydrogen 3.020 N/A LYS 767.A N LYS 763.A O no hydrogen 3.262 N/A GLU 768.A N GLU 764.A O no hydrogen 3.088 N/A GLU 768.A N PHE 765.A O no hydrogen 3.331 N/A PHE 769.A N PHE 765.A O no hydrogen 2.940 N/A GLN 771.A N GLU 768.A O no hydrogen 3.103 N/A LEU 772.A N PHE 769.A O no hydrogen 3.067 N/A ILE 775.A N ASN 773.A OD1 no hydrogen 3.003 N/A SER 776.A OG ASN 773.A O no hydrogen 2.550 N/A ILE 777.A N TYR 774.A O no hydrogen 3.346 N/A ALA 778.A N ILE 775.A O no hydrogen 3.191 N/A SER 779.A N VAL 830.A O no hydrogen 3.016 N/A VAL 780.A N SER 734.A O no hydrogen 3.054 N/A SER 781.A N VAL 828.A O no hydrogen 3.075 N/A SER 781.A OG SER 782.A O no hydrogen 3.214 N/A ALA 783.A N GLU 826.A O no hydrogen 2.824 N/A ASN 785.A N GLU 824.A OE2 no hydrogen 2.752 N/A ILE 786.A N GLU 824.A OE1 no hydrogen 3.132 N/A LYS 788.A N ASN 785.A O no hydrogen 3.154 N/A TYR 789.A N ILE 786.A O no hydrogen 3.222 N/A ASP 790.A N ALA 787.A O no hydrogen 3.223 N/A VAL 791.A N PHE 794.A O no hydrogen 2.900 N/A GLY 793.A N ASP 790.A OD1 no hydrogen 2.776 N/A PHE 794.A N VAL 791.A O no hydrogen 3.282 N/A GLY 796.A N TYR 789.A O no hydrogen 2.928 N/A CYS 799.A N GLY 796.A O no hydrogen 3.289 N/A CYS 799.A SG PRO 800.A O no hydrogen 3.544 N/A ARG 804.A N PRO 800.A O no hydrogen 2.936 N/A ARG 804.A NH1 ASP 841.A OD1 no hydrogen 3.028 N/A ARG 804.A NH1 ASP 841.A OD2 no hydrogen 3.101 N/A GLY 805.A N PHE 801.A O no hydrogen 3.178 N/A ILE 806.A N HIS 802.A O no hydrogen 3.161 N/A LEU 807.A N ILE 803.A O no hydrogen 3.064 N/A THR 808.A N ARG 804.A O no hydrogen 2.993 N/A THR 808.A OG1 ARG 804.A O no hydrogen 2.771 N/A THR 808.A OG1 CYS 843.A O no hydrogen 3.021 N/A TYR 809.A N GLY 805.A O no hydrogen 3.115 N/A TYR 809.A OH PRO 820.A O no hydrogen 2.589 N/A ASN 810.A N ILE 806.A O no hydrogen 2.846 N/A ARG 811.A N LEU 807.A O no hydrogen 3.173 N/A ARG 811.A NH1 GLY 793.A O no hydrogen 3.022 N/A ARG 811.A NH2 PHE 839.A O no hydrogen 3.569 N/A ALA 812.A N THR 808.A O no hydrogen 3.163 N/A ILE 813.A N TYR 809.A O no hydrogen 2.980 N/A ASN 816.A N.A ILE 813.A O no hydrogen 3.232 N/A ASN 816.A N.B ILE 813.A O no hydrogen 3.247 N/A ASP 818.A N ASN 816.A OD1.A no hydrogen 3.213 N/A ALA 819.A N ASN 816.A O.A no hydrogen 3.404 N/A ALA 819.A N ASN 816.A O.B no hydrogen 3.316 N/A GLN 821.A NE2 ALA 819.A O no hydrogen 3.186 N/A GLY 825.A N ALA 783.A O no hydrogen 2.811 N/A GLU 826.A N VAL 823.A O no hydrogen 2.993 N/A LYS 827.A NZ ASN 282.A OD1 no hydrogen 2.738 N/A LYS 827.A NZ GLN 283.A O no hydrogen 2.827 N/A VAL 828.A N SER 781.A O no hydrogen 2.848 N/A TYR 829.A N TRP 846.A O no hydrogen 2.814 N/A VAL 830.A N SER 779.A O no hydrogen 2.718 N/A LEU 831.A N ILE 844.A O no hydrogen 2.954 N/A LEU 833.A N LYS 842.A O no hydrogen 2.663 N/A ARG 834.A N TRP 863.A O no hydrogen 2.942 N/A ARG 834.A NH2 HIS 862.A O no hydrogen 2.729 N/A ASN 837.A N ARG 834.A O no hydrogen 3.138 N/A ASN 837.A ND2 ARG 834.A O no hydrogen 2.524 N/A ASN 837.A ND2 ASP 841.A O no hydrogen 2.812 N/A PHE 839.A N ASN 837.A OD1 no hydrogen 2.971 N/A GLY 840.A N ASN 837.A O no hydrogen 3.511 N/A LYS 842.A N ASP 841.A OD1 no hydrogen 2.850 N/A CYS 843.A SG PHE 801.A O no hydrogen 3.259 N/A ILE 844.A N LEU 831.A O no hydrogen 2.884 N/A ALA 845.A N GLY 805.A O no hydrogen 2.737 N/A TRP 846.A N TYR 829.A O no hydrogen 3.103 N/A TRP 846.A NE1 THR 850.A O no hydrogen 3.129 N/A SER 848.A N LYS 827.A O no hydrogen 2.958 N/A SER 848.A OG PRO 284.A O no hydrogen 2.684 N/A SER 848.A OG LYS 827.A O no hydrogen 3.004 N/A THR 850.A OG1 PRO 847.A O no hydrogen 2.745 N/A ILE 852.A N TYR 774.A OH no hydrogen 3.106 N/A LEU 855.A N THR 853.A OG1 no hydrogen 3.415 N/A ILE 856.A N THR 853.A O no hydrogen 3.129 N/A LYS 857.A NZ GLU 851.A OE2 no hydrogen 3.274 N/A VAL 860.A N ILE 856.A O no hydrogen 3.050 N/A LEU 861.A N LYS 857.A O no hydrogen 3.064 N/A HIS 862.A N ASP 858.A O no hydrogen 3.254 N/A TRP 863.A N ASP 859.A O no hydrogen 3.136 N/A TRP 863.A N VAL 860.A O no hydrogen 3.091 N/A ASP 865.A N PRO 832.A O no hydrogen 2.932 N/A VAL 868.A N ASP 865.A OD1 no hydrogen 3.069 N/A LEU 869.A N ASP 865.A O no hydrogen 2.983 N/A LEU 870.A N TYR 866.A O no hydrogen 2.931 N/A GLU 871.A N THR 867.A O no hydrogen 3.181 N/A LYS 872.A N VAL 868.A O no hydrogen 2.868 N/A THR 873.A N LEU 869.A O no hydrogen 3.127 N/A THR 873.A OG1 LEU 869.A O no hydrogen 2.581 N/A PHE 874.A N LEU 870.A O no hydrogen 3.005 N/A ILE 875.A N LEU 870.A O no hydrogen 2.822 N/A LYS 876.A N GLU 871.A O no hydrogen 2.936 N/A LEU 878.A N PHE 874.A O no hydrogen 3.031 N/A GLU 879.A N ILE 875.A O no hydrogen 2.734 N/A GLY 880.A N LYS 876.A O no hydrogen 3.243 N/A PHE 881.A N PRO 877.A O no hydrogen 3.079 N/A THR 882.A N LEU 878.A O no hydrogen 3.042 N/A THR 882.A OG1 LEU 878.A O no hydrogen 2.880 N/A THR 882.A OG1 GLU 879.A O no hydrogen 3.179 N/A SER 883.A N GLU 879.A O no hydrogen 2.883 N/A SER 883.A OG GLU 879.A O no hydrogen 2.908 N/A ALA 884.A N GLY 880.A O no hydrogen 3.408 N/A ALA 885.A N PHE 881.A O no hydrogen 3.138 N/A LYS 886.A N SER 883.A O no hydrogen 3.177 N/A LYS 886.A NZ PRO 399.A O no hydrogen 3.231 N/A LYS 886.A NZ ALA 884.A O no hydrogen 3.048 N/A LEU 887.A N THR 882.A O no hydrogen 2.686 N/A ASP 888.A N GLU 755.A OE1 no hydrogen 3.015 N/A SER 894.A N ASP 897.A OD2 no hydrogen 2.804 N/A PHE 896.A N SER 894.A OG no hydrogen 3.347 N/A ASP 897.A N SER 894.A O no hydrogen 3.285 N/A PHE 899.A N PHE 896.A O no hydrogen 2.984 N/A