Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8rw3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N ASN 19.A OD1 no hydrogen 2.779 N/A TYR 4.A N LYS 80.A O no hydrogen 3.123 N/A TYR 4.A OH HIS 7.A ND1 no hydrogen 2.410 N/A LYS 5.A N THR 17.A O no hydrogen 2.733 N/A GLU 6.A N THR 17.A O no hydrogen 3.257 N/A HIS 7.A ND1 TYR 4.A OH no hydrogen 2.410 N/A LYS 8.A N VAL 15.A O no hydrogen 2.861 N/A ARG 10.A N GLY 13.A O no hydrogen 3.013 N/A GLY 13.A N ARG 10.A O no hydrogen 3.165 N/A LEU 14.A N LEU 25.A O no hydrogen 2.925 N/A VAL 15.A N LYS 8.A O no hydrogen 2.852 N/A ILE 16.A N ILE 23.A O no hydrogen 2.874 N/A THR 17.A N GLU 6.A O no hydrogen 2.708 N/A THR 17.A OG1 ASN 22.A OD1 no hydrogen 2.456 N/A THR 18.A N GLY 21.A O no hydrogen 2.756 N/A THR 18.A OG1 GLY 21.A O no hydrogen 3.130 N/A ASN 19.A N PHE 3.A O no hydrogen 3.355 N/A ASN 19.A ND2 ALA 1.A O no hydrogen 2.819 N/A GLN 20.A N THR 18.A OG1 no hydrogen 3.032 N/A GLY 21.A N THR 18.A OG1 no hydrogen 3.121 N/A ASN 22.A N ASP 40.A OD2 no hydrogen 2.942 N/A ILE 23.A N ILE 16.A O no hydrogen 2.956 N/A ARG 24.A N LEU 36.A O no hydrogen 2.825 N/A ARG 24.A NH2 GLU 34.A OE1 no hydrogen 3.212 N/A LEU 25.A N LEU 14.A O no hydrogen 2.715 N/A GLN 26.A N GLU 34.A O no hydrogen 2.971 N/A LYS 28.A N ALA 32.A O no hydrogen 2.728 N/A LYS 28.A NZ GLN 26.A OE1 no hydrogen 3.147 N/A LYS 28.A NZ GLU 34.A OE1 no hydrogen 3.346 N/A LYS 28.A NZ PRO 52.A O no hydrogen 2.560 N/A LYS 28.A NZ SER 54.A O no hydrogen 2.692 N/A ALA 31.A N SER 29.A OG no hydrogen 3.391 N/A ILE 33.A N LEU 200.A O no hydrogen 2.927 N/A GLU 34.A N GLN 26.A O no hydrogen 2.759 N/A VAL 35.A N TYR 198.A O no hydrogen 2.871 N/A LEU 36.A N ARG 24.A O no hydrogen 3.053 N/A TYR 37.A N SER 196.A O no hydrogen 2.893 N/A TYR 37.A OH GLU 97.A OE2 no hydrogen 2.537 N/A ARG 38.A NE SER 196.A OG no hydrogen 2.878 N/A ARG 38.A NH2 GLN 43.A OE1 no hydrogen 3.065 N/A ARG 38.A NH2 GLY 194.A O no hydrogen 3.086 N/A ARG 38.A NH2 SER 196.A OG no hydrogen 3.356 N/A ALA 39.A N ASN 22.A O no hydrogen 3.010 N/A SER 41.A N ARG 38.A O no hydrogen 2.858 N/A SER 41.A OG ARG 38.A O no hydrogen 2.727 N/A GLN 43.A NE2 TYR 37.A O no hydrogen 3.043 N/A SER 46.A OG ASP 170.A OD2 no hydrogen 2.613 N/A PHE 47.A N ASP 170.A OD1 no hydrogen 3.133 N/A ALA 48.A N ASP 170.A OD1 no hydrogen 3.051 N/A LEU 49.A N SER 46.A OG no hydrogen 3.083 N/A ALA 50.A N VAL 216.A O no hydrogen 2.798 N/A SER 54.A N GLN 51.A O no hydrogen 3.117 N/A SER 54.A OG GLN 51.A O no hydrogen 2.924 N/A ILE 56.A N PHE 27.A O no hydrogen 3.107 N/A GLN 59.A N SER 70.A O no hydrogen 2.813 N/A THR 61.A N GLN 68.A O no hydrogen 3.021 N/A THR 63.A N HIS 66.A O no hydrogen 2.856 N/A THR 63.A OG1 HIS 66.A O no hydrogen 3.351 N/A HIS 66.A N THR 63.A OG1 no hydrogen 3.094 N/A LEU 67.A N ILE 78.A O no hydrogen 2.786 N/A GLN 68.A N THR 61.A O no hydrogen 2.923 N/A PHE 69.A N ALA 76.A O no hydrogen 3.001 N/A SER 70.A N GLN 59.A O no hydrogen 2.815 N/A SER 70.A OG GLY 71.A O no hydrogen 3.386 N/A SER 70.A OG THR 75.A OG1 no hydrogen 2.457 N/A GLY 71.A N LEU 74.A O no hydrogen 2.851 N/A THR 73.A N GLU 30.A O no hydrogen 2.946 N/A THR 73.A OG1 GLU 30.A O no hydrogen 3.244 N/A LEU 74.A N GLU 30.A O no hydrogen 3.187 N/A THR 75.A N TYR 88.A O no hydrogen 2.865 N/A THR 75.A OG1 SER 70.A OG no hydrogen 2.457 N/A ALA 76.A N PHE 69.A O no hydrogen 2.931 N/A ARG 77.A N SER 86.A O no hydrogen 2.750 N/A ARG 77.A NH1 GLN 68.A OE1 no hydrogen 3.527 N/A ILE 78.A N LEU 67.A O no hydrogen 2.699 N/A GLN 79.A N ALA 84.A O no hydrogen 2.855 N/A GLN 79.A NE2 PRO 82.A O no hydrogen 3.008 N/A LYS 80.A N ASN 65.A O no hydrogen 2.792 N/A LYS 80.A NZ GLU 62.A OE2 no hydrogen 3.336 N/A LYS 80.A NZ THR 63.A O no hydrogen 2.715 N/A LYS 80.A NZ GLU 64.A O no hydrogen 3.279 N/A ARG 81.A N ASN 65.A OD1 no hydrogen 3.363 N/A PHE 83.A N VAL 2.A O no hydrogen 3.063 N/A ALA 84.A N GLN 79.A O no hydrogen 3.250 N/A ILE 85.A N GLU 97.A OE1 no hydrogen 2.750 N/A SER 86.A N ARG 77.A O no hydrogen 2.754 N/A TYR 87.A N LEU 95.A O no hydrogen 2.731 N/A TYR 87.A OH TYR 198.A OH no hydrogen 2.647 N/A TYR 88.A N THR 75.A O no hydrogen 2.851 N/A ARG 89.A N.A GLU 92.A O no hydrogen 3.005 N/A ARG 89.A N.B GLU 92.A O no hydrogen 2.985 N/A ARG 89.A NH1.B GLU 92.A OE1 no hydrogen 3.385 N/A ARG 89.A NH1.B LYS 163.A O no hydrogen 2.884 N/A ARG 89.A NH2.B LYS 163.A O no hydrogen 3.253 N/A ARG 89.A NH2.B GLN 164.A O no hydrogen 3.358 N/A GLU 92.A N ARG 89.A O.A no hydrogen 2.913 N/A GLU 92.A N ARG 89.A O.B no hydrogen 2.723 N/A LEU 94.A N TYR 87.A O no hydrogen 2.720 N/A LEU 95.A N TYR 87.A O no hydrogen 3.494 N/A GLU 97.A N ILE 85.A O no hydrogen 2.911 N/A GLU 98.A N ARG 109.A O no hydrogen 2.994 N/A SER 99.A N GLU 98.A OE1 no hydrogen 2.772 N/A SER 99.A OG GLU 98.A OE1 no hydrogen 2.465 N/A GLY 100.A N ARG 109.A O no hydrogen 3.066 N/A GLN 102.A N ASN 107.A O no hydrogen 2.831 N/A ILE 106.A N ALA 191.A O no hydrogen 2.859 N/A PHE 108.A N LEU 189.A O no hydrogen 2.744 N/A ARG 109.A N GLY 100.A O no hydrogen 2.880 N/A ARG 109.A NE GLU 98.A OE1 no hydrogen 2.612 N/A ARG 109.A NH1 GLU 183.A OE2 no hydrogen 2.884 N/A ARG 109.A NH1 GLN 188.A OE1 no hydrogen 2.696 N/A ARG 109.A NH2 GLU 98.A OE1 no hydrogen 3.320 N/A ARG 109.A NH2 GLU 98.A OE2 no hydrogen 3.012 N/A ARG 109.A NH2 GLU 183.A OE1 no hydrogen 3.112 N/A ARG 109.A NH2 GLU 183.A OE2 no hydrogen 3.157 N/A PHE 110.A N LEU 187.A O no hydrogen 2.856 N/A TYR 111.A N ALA 96.A O no hydrogen 2.768 N/A LEU 112.A N ASP 185.A O no hydrogen 2.919 N/A SER 113.A N GLU 116.A OE1 no hydrogen 2.926 N/A SER 113.A OG GLU 116.A OE1 no hydrogen 3.457 N/A GLU 116.A N SER 113.A O no hydrogen 3.283 N/A LYS 117.A N SER 162.A OG no hydrogen 2.771 N/A LYS 117.A NZ ASP 129.A OD2 no hydrogen 2.762 N/A LYS 117.A NZ ASP 568.A OD1 no hydrogen 2.669 N/A LYS 117.A NZ ASP 568.A OD2 no hydrogen 3.349 N/A ILE 118.A N ASP 129.A OD1 no hydrogen 2.813 N/A LEU 119.A N MET 160.A O no hydrogen 2.892 N/A GLY 120.A N GLN 461.A OE1 no hydrogen 2.989 N/A GLY 121.A N ALA 158.A O no hydrogen 2.986 N/A GLN 123.A N PHE 154.A O no hydrogen 2.956 N/A ARG 124.A NE GLY 121.A O no hydrogen 3.026 N/A ARG 124.A NH1 PRO 136.A O no hydrogen 2.780 N/A ARG 124.A NH1 GLY 150.A O no hydrogen 2.694 N/A ARG 124.A NH2 GLY 121.A O no hydrogen 3.037 N/A ARG 124.A NH2 PRO 136.A O no hydrogen 3.096 N/A ILE 125.A N SER 149.A O no hydrogen 2.835 N/A LEU 126.A N GLU 457.A OE2 no hydrogen 3.072 N/A GLY 127.A N GLU 457.A OE2 no hydrogen 2.841 N/A ARG 130.A N ILE 118.A O no hydrogen 2.550 N/A ARG 130.A NE GLY 127.A O no hydrogen 2.843 N/A ARG 130.A NH1 GLY 120.A O no hydrogen 2.659 N/A ARG 130.A NH1 GLY 122.A O no hydrogen 3.019 N/A ARG 130.A NH2 ARG 124.A O no hydrogen 2.665 N/A ARG 130.A NH2 GLU 457.A OE2 no hydrogen 2.768 N/A ARG 131.A N ASP 129.A OD1 no hydrogen 3.070 N/A ARG 131.A NH1 SER 113.A O no hydrogen 2.544 N/A ARG 131.A NH1 GLU 116.A O no hydrogen 3.112 N/A ARG 131.A NH2 SER 184.A O no hydrogen 3.154 N/A GLY 132.A N ILE 179.A O no hydrogen 2.715 N/A GLN 133.A N ARG 130.A O no hydrogen 3.014 N/A ARG 134.A NH1 ASP 178.A OD2 no hydrogen 3.009 N/A ARG 134.A NH1 GLU 190.A OE2 no hydrogen 3.192 N/A ARG 134.A NH2 GLU 190.A OE1 no hydrogen 3.522 N/A ARG 134.A NH2 GLU 190.A OE2 no hydrogen 3.445 N/A PHE 135.A N MET 177.A O no hydrogen 2.804 N/A LEU 137.A N GLY 175.A O no hydrogen 2.932 N/A ASN 139.A N ASN 399.A OD1 no hydrogen 2.908 N/A ASN 139.A ND2 GLY 429.A O no hydrogen 3.477 N/A ARG 140.A N MET 152.A O no hydrogen 3.063 N/A ARG 140.A NH1 GLN 151.A OE1 no hydrogen 3.430 N/A HIS 142.A ND1 SER 149.A OG no hydrogen 2.367 N/A TYR 143.A OH ASP 479.A OD1 no hydrogen 2.567 N/A GLY 144.A N ASP 444.A O no hydrogen 2.975 N/A TYR 145.A N HIS 142.A O no hydrogen 3.292 N/A TYR 145.A OH THR 442.A O no hydrogen 2.589 N/A SER 149.A N ILE 125.A O no hydrogen 3.165 N/A SER 149.A OG HIS 142.A ND1 no hydrogen 2.367 N/A SER 149.A OG GLN 151.A O no hydrogen 3.140 N/A GLN 151.A NE2 TYR 138.A O no hydrogen 2.844 N/A PHE 154.A N GLN 123.A OE1 no hydrogen 3.185 N/A GLY 155.A N ASN 139.A OD1 no hydrogen 2.951 N/A LEU 156.A N GLY 121.A O no hydrogen 3.154 N/A ILE 159.A N LEU 167.A O no hydrogen 2.992 N/A MET 160.A N LEU 119.A O no hydrogen 2.850 N/A SER 161.A N TYR 165.A O no hydrogen 2.970 N/A SER 161.A OG GLU 116.A OE2 no hydrogen 2.669 N/A SER 162.A N LYS 117.A O no hydrogen 3.029 N/A SER 162.A OG LYS 117.A O no hydrogen 3.365 N/A LYS 163.A N SER 161.A OG no hydrogen 2.930 N/A GLN 164.A N SER 161.A O no hydrogen 2.816 N/A GLN 164.A NE2 GLU 561.A OE1 no hydrogen 2.959 N/A TYR 165.A OH GLU 116.A OE2 no hydrogen 2.447 N/A ILE 166.A N VAL 201.A O no hydrogen 2.715 N/A LEU 167.A N ILE 159.A O no hydrogen 3.039 N/A VAL 168.A N ILE 199.A O no hydrogen 2.752 N/A PHE 169.A N PRO 157.A O no hydrogen 2.775 N/A ASP 170.A N ALA 197.A O no hydrogen 3.047 N/A ASN 171.A N PHE 169.A O no hydrogen 2.788 N/A ASN 171.A ND2 SER 193.A O no hydrogen 2.807 N/A ASN 171.A ND2 ARG 195.A O no hydrogen 2.884 N/A SER 172.A OG THR 396.A O no hydrogen 2.722 N/A ALA 173.A N ASN 171.A OD1 no hydrogen 2.765 N/A SER 174.A N ASP 395.A O no hydrogen 2.792 N/A GLY 175.A N LEU 137.A O no hydrogen 2.969 N/A ALA 176.A N GLU 190.A O no hydrogen 2.814 N/A MET 177.A N PHE 135.A O no hydrogen 2.723 N/A ASP 178.A N GLN 188.A O no hydrogen 2.909 N/A ILE 179.A N GLN 133.A O no hydrogen 2.777 N/A LYS 181.A N ASP 178.A OD1 no hydrogen 2.957 N/A THR 182.A N ASP 178.A OD1 no hydrogen 3.059 N/A THR 182.A OG1 ASP 178.A OD2 no hydrogen 2.622 N/A ILE 186.A N GLU 183.A O no hydrogen 3.101 N/A LEU 187.A N PHE 110.A O no hydrogen 2.913 N/A GLN 188.A N ASP 178.A O no hydrogen 2.939 N/A GLN 188.A NE2 GLU 190.A OE2 no hydrogen 2.656 N/A LEU 189.A N PHE 108.A O no hydrogen 2.735 N/A GLU 190.A N ALA 176.A O no hydrogen 3.020 N/A ALA 191.A N ILE 106.A O no hydrogen 3.026 N/A LYS 192.A N SER 174.A O no hydrogen 2.951 N/A SER 193.A OG THR 396.A OG1 no hydrogen 2.755 N/A ARG 195.A NH1 LEU 44.A O no hydrogen 2.764 N/A ARG 195.A NH2 GLU 34.A OE2 no hydrogen 2.938 N/A SER 196.A N GLN 43.A OE1 no hydrogen 2.973 N/A SER 196.A OG TYR 37.A O no hydrogen 2.670 N/A SER 196.A OG GLN 43.A OE1 no hydrogen 3.073 N/A TYR 198.A N VAL 35.A O no hydrogen 3.032 N/A TYR 198.A OH TYR 87.A OH no hydrogen 2.647 N/A TYR 198.A OH GLU 97.A OE2 no hydrogen 2.794 N/A ILE 199.A N VAL 168.A O no hydrogen 2.862 N/A LEU 200.A N ILE 33.A O no hydrogen 3.026 N/A VAL 201.A N ILE 166.A O no hydrogen 2.749 N/A ALA 202.A N ALA 31.A O no hydrogen 2.868 N/A SER 205.A OG ASN 204.A OD1 no hydrogen 3.294 N/A TYR 206.A N GLU 561.A OE2 no hydrogen 2.908 N/A SER 208.A N SER 205.A OG no hydrogen 3.087 N/A SER 208.A OG ASN 204.A OD1 no hydrogen 3.415 N/A SER 208.A OG SER 205.A OG no hydrogen 3.392 N/A LEU 209.A N SER 205.A O no hydrogen 2.781 N/A ILE 210.A N TYR 206.A O no hydrogen 2.979 N/A GLU 211.A N PRO 207.A O no hydrogen 2.848 N/A ASN 212.A N SER 208.A O no hydrogen 2.891 N/A ASN 212.A ND2 ALA 202.A O no hydrogen 2.844 N/A PHE 213.A N LEU 209.A O no hydrogen 2.891 N/A THR 214.A N ILE 210.A O no hydrogen 3.049 N/A THR 214.A OG1 ILE 210.A O no hydrogen 2.947 N/A THR 214.A OG1 GLU 211.A O no hydrogen 3.305 N/A THR 214.A OG1 THR 548.A O no hydrogen 3.541 N/A GLN 215.A N GLU 211.A O no hydrogen 2.847 N/A VAL 216.A N PHE 213.A O no hydrogen 3.341 N/A THR 217.A N PHE 213.A O no hydrogen 2.944 N/A THR 217.A OG1 PHE 213.A O no hydrogen 2.940 N/A GLY 218.A N THR 214.A O no hydrogen 2.890 N/A ARG 219.A NE THR 214.A OG1 no hydrogen 2.915 N/A ARG 219.A NH2 GLU 211.A O no hydrogen 2.827 N/A GLN 220.A NE2 MET 438.A O no hydrogen 3.427 N/A ARG 225.A N GLY 675.A O no hydrogen 3.008 N/A ARG 225.A NH1 GLU 672.A OE1 no hydrogen 3.422 N/A ALA 227.A N PRO 224.A O no hydrogen 2.989 N/A LEU 228.A N ARG 225.A O no hydrogen 2.915 N/A GLY 229.A N TRP 226.A O no hydrogen 3.021 N/A SER 230.A N TYR 532.A OH no hydrogen 2.855 N/A SER 230.A OG PRO 256.A O no hydrogen 2.742 N/A PHE 231.A N TYR 501.A O no hydrogen 3.177 N/A ALA 232.A N THR 259.A O no hydrogen 2.783 N/A SER 233.A OG HIS 504.A ND1 no hydrogen 2.762 N/A ARG 234.A NE GLU 512.A OE2 no hydrogen 2.809 N/A ARG 234.A NH2 GLU 512.A OE1 no hydrogen 3.122 N/A ARG 234.A NH2 GLU 512.A OE2 no hydrogen 3.534 N/A PHE 235.A N GLY 505.A O no hydrogen 2.977 N/A GLY 236.A N ASP 507.A OD2 no hydrogen 3.200 N/A TYR 237.A OH GLU 512.A OE2 no hydrogen 2.733 N/A ARG 238.A N GLU 242.A OE1 no hydrogen 3.009 N/A ARG 238.A NE GLY 236.A O no hydrogen 3.253 N/A ARG 238.A NE ASP 507.A OD2 no hydrogen 2.776 N/A ARG 238.A NH2 ASP 507.A OD1 no hydrogen 3.187 N/A ARG 238.A NH2 ASP 507.A OD2 no hydrogen 3.039 N/A GLU 240.A N ASN 284.A O no hydrogen 2.858 N/A GLU 242.A N SER 239.A OG no hydrogen 3.093 N/A THR 243.A N SER 239.A O no hydrogen 2.976 N/A THR 243.A OG1 SER 239.A O no hydrogen 2.700 N/A ARG 244.A N GLU 240.A O no hydrogen 2.762 N/A ARG 244.A NE GLU 240.A OE2 no hydrogen 2.989 N/A ARG 244.A NH1 ASP 294.A OD2 no hydrogen 2.872 N/A ARG 244.A NH2 GLU 240.A OE2 no hydrogen 3.099 N/A ARG 244.A NH2 ASP 294.A OD2 no hydrogen 3.052 N/A ALA 245.A N ALA 241.A O no hydrogen 2.741 N/A THR 246.A N GLU 242.A O no hydrogen 3.032 N/A THR 246.A N THR 243.A O no hydrogen 3.176 N/A THR 246.A OG1 GLU 242.A O no hydrogen 2.923 N/A VAL 247.A N THR 243.A O no hydrogen 3.123 N/A GLN 248.A N ARG 244.A O no hydrogen 2.875 N/A LYS 249.A N ALA 245.A O no hydrogen 2.790 N/A TYR 250.A N THR 246.A O no hydrogen 3.169 N/A LYS 251.A N VAL 247.A O no hydrogen 3.304 N/A LYS 251.A NZ GLN 298.A O no hydrogen 3.339 N/A THR 252.A N GLN 248.A O no hydrogen 2.819 N/A THR 252.A OG1 GLN 248.A O no hydrogen 3.480 N/A GLU 253.A N LYS 249.A O no hydrogen 2.962 N/A PHE 255.A N TYR 250.A O no hydrogen 3.090 N/A LEU 257.A N SER 643.A O no hydrogen 2.790 N/A ASP 258.A N SER 230.A O no hydrogen 2.802 N/A THR 259.A N SER 230.A O no hydrogen 3.290 N/A ILE 260.A N LYS 301.A O no hydrogen 2.971 N/A VAL 261.A N ALA 232.A O no hydrogen 2.859 N/A LEU 262.A N VAL 303.A O no hydrogen 2.746 N/A LEU 264.A N ASP 263.A OD1 no hydrogen 2.720 N/A TRP 266.A N ASP 263.A O no hydrogen 3.118 N/A TRP 266.A NE1 ILE 305.A O no hydrogen 2.919 N/A PHE 267.A N LEU 264.A O no hydrogen 3.380 N/A GLY 268.A N TYR 265.A O no hydrogen 3.389 N/A HIS 274.A NE2 ASP 270.A OD2 no hydrogen 2.593 N/A ASN 277.A N HIS 274.A O no hydrogen 2.993 N/A ASN 277.A ND2 PHE 267.A O no hydrogen 3.214 N/A TRP 280.A NE1 GLN 368.A OE1 no hydrogen 2.991 N/A ASP 281.A N TRP 266.A O no hydrogen 2.834 N/A GLU 283.A N ASP 281.A OD1 no hydrogen 3.277 N/A ASN 284.A N ASP 281.A O no hydrogen 3.096 N/A PHE 285.A N ASP 281.A O no hydrogen 2.739 N/A THR 287.A N GLU 240.A OE1 no hydrogen 2.712 N/A THR 287.A OG1 GLU 240.A OE1 no hydrogen 3.089 N/A THR 287.A OG1 GLU 240.A OE2 no hydrogen 2.667 N/A MET 291.A N THR 287.A O no hydrogen 2.990 N/A MET 292.A N PRO 288.A O no hydrogen 2.943 N/A ALA 293.A N LEU 289.A O no hydrogen 2.942 N/A ASP 294.A N ASP 290.A O no hydrogen 2.733 N/A PHE 295.A N MET 291.A O no hydrogen 2.941 N/A LYS 296.A N MET 292.A O no hydrogen 2.944 N/A GLN 297.A N ALA 293.A O no hydrogen 2.978 N/A GLN 298.A N PHE 295.A O no hydrogen 2.874 N/A GLY 299.A N LYS 296.A O no hydrogen 2.786 N/A VAL 300.A N PHE 295.A O no hydrogen 2.831 N/A LYS 301.A N ASP 258.A O no hydrogen 2.779 N/A LYS 301.A NZ ASP 258.A O no hydrogen 3.191 N/A LYS 301.A NZ ASP 258.A OD2 no hydrogen 3.009 N/A LYS 301.A NZ GLY 299.A O no hydrogen 2.782 N/A LYS 301.A NZ GLU 646.A OE2 no hydrogen 3.046 N/A VAL 303.A N ILE 260.A O no hydrogen 3.112 N/A ILE 305.A N LEU 262.A O no hydrogen 3.027 N/A THR 306.A N TRP 374.A O no hydrogen 2.698 N/A THR 306.A OG1 TYR 362.A OH no hydrogen 2.682 N/A THR 306.A OG1 TRP 374.A O no hydrogen 3.126 N/A VAL 310.A N GLY 345.A O no hydrogen 3.044 N/A LEU 311.A N MET 275.A O no hydrogen 3.001 N/A THR 312.A N ASN 343.A O no hydrogen 2.924 N/A THR 312.A OG1 ASN 343.A O no hydrogen 3.408 N/A SER 313.A OG GLY 273.A O no hydrogen 2.804 N/A SER 314.A N LEU 311.A O no hydrogen 3.006 N/A SER 314.A OG LEU 311.A O no hydrogen 2.922 N/A LYS 315.A N ASN 277.A OD1 no hydrogen 2.842 N/A ARG 316.A N SER 314.A OG no hydrogen 3.428 N/A ARG 316.A NE ASN 277.A O no hydrogen 2.662 N/A ARG 316.A NH2 LEU 278.A O no hydrogen 2.910 N/A TRP 317.A N SER 314.A O no hydrogen 3.411 N/A ALA 320.A N ARG 316.A O no hydrogen 2.953 N/A VAL 321.A N TRP 317.A O no hydrogen 2.990 N/A LYS 322.A N ASP 318.A O no hydrogen 2.855 N/A ALA 323.A N ASP 319.A O no hydrogen 2.934 N/A LYS 324.A N VAL 321.A O no hydrogen 2.806 N/A ALA 325.A N ALA 320.A O no hydrogen 2.886 N/A ALA 327.A N ILE 346.A O no hydrogen 2.863 N/A LYS 328.A N GLN 388.A O no hydrogen 3.204 N/A ASP 329.A N GLN 333.A O no hydrogen 2.801 N/A GLY 332.A N ASP 329.A O no hydrogen 2.905 N/A GLN 333.A N ASP 329.A OD1 no hydrogen 3.002 N/A LYS 335.A N ALA 327.A O no hydrogen 2.892 N/A LYS 335.A NZ ASP 386.A OD1 no hydrogen 3.287 N/A PHE 337.A N GLY 344.A O no hydrogen 2.853 N/A LEU 339.A N GLY 342.A O no hydrogen 2.712 N/A GLY 342.A N LEU 339.A O no hydrogen 3.001 N/A GLY 344.A N PHE 337.A O no hydrogen 2.901 N/A GLY 345.A N VAL 310.A O no hydrogen 2.911 N/A ILE 347.A N PRO 308.A O no hydrogen 2.835 N/A ASP 348.A N ALA 325.A O no hydrogen 2.864 N/A PHE 350.A N ASP 348.A OD1 no hydrogen 3.153 N/A SER 351.A N ASP 348.A O no hydrogen 3.161 N/A SER 351.A OG ASP 348.A O no hydrogen 2.995 N/A GLY 354.A N SER 351.A OG no hydrogen 2.961 N/A SER 355.A N SER 351.A O no hydrogen 3.142 N/A SER 355.A OG SER 351.A O no hydrogen 2.841 N/A ARG 356.A N LYS 352.A O no hydrogen 2.965 N/A TRP 357.A N GLU 353.A O no hydrogen 2.979 N/A TRP 357.A NE1 ASP 319.A OD2 no hydrogen 2.686 N/A PHE 358.A N GLY 354.A O no hydrogen 2.942 N/A SER 359.A N SER 355.A O no hydrogen 2.902 N/A SER 359.A OG SER 355.A O no hydrogen 2.900 N/A SER 360.A N ARG 356.A O no hydrogen 3.052 N/A ILE 361.A N PHE 358.A O no hydrogen 2.939 N/A TYR 362.A N PHE 358.A O no hydrogen 3.123 N/A TYR 362.A OH THR 306.A OG1 no hydrogen 2.682 N/A LYS 363.A N SER 359.A O no hydrogen 2.914 N/A ASP 364.A N SER 360.A O no hydrogen 3.156 N/A LEU 365.A N ILE 361.A O no hydrogen 3.187 N/A SER 366.A N TYR 362.A O no hydrogen 2.974 N/A SER 366.A OG TYR 362.A O no hydrogen 2.688 N/A SER 366.A OG GLN 413.A OE1 no hydrogen 3.123 N/A LYS 367.A N LYS 363.A O no hydrogen 3.028 N/A GLN 368.A N ASP 364.A O no hydrogen 3.194 N/A GLN 368.A NE2 ASP 364.A O no hydrogen 3.334 N/A GLN 368.A NE2 ASP 364.A OD1 no hydrogen 3.231 N/A GLY 369.A N SER 366.A O no hydrogen 3.038 N/A VAL 370.A N LEU 365.A O no hydrogen 3.487 N/A ALA 371.A N THR 302.A O no hydrogen 2.990 N/A TRP 373.A N PHE 423.A O no hydrogen 2.957 N/A TRP 373.A NE1 SER 366.A OG no hydrogen 3.121 N/A TRP 374.A N LEU 304.A O no hydrogen 2.924 N/A GLY 375.A N MET 425.A O no hydrogen 2.665 N/A ASP 376.A N THR 306.A O no hydrogen 3.019 N/A GLU 381.A N LEU 377.A O no hydrogen 3.098 N/A HIS 383.A ND1 HIS 398.A ND1 no hydrogen 2.918 N/A HIS 383.A NE2 HIS 389.A NE2 no hydrogen 2.789 N/A THR 387.A N PRO 384.A O no hydrogen 2.984 N/A THR 387.A OG1 PRO 384.A O no hydrogen 2.854 N/A GLN 388.A N LYS 328.A O no hydrogen 2.757 N/A GLN 388.A NE2 ASP 386.A O no hydrogen 2.986 N/A HIS 389.A N GLY 392.A O no hydrogen 2.680 N/A HIS 389.A ND1 ASP 348.A OD1 no hydrogen 2.654 N/A HIS 389.A NE2 HIS 383.A NE2 no hydrogen 2.789 N/A ALA 390.A N ASP 348.A OD2 no hydrogen 2.956 N/A GLY 392.A N HIS 389.A O no hydrogen 3.097 N/A ALA 394.A N THR 387.A O no hydrogen 2.944 N/A THR 396.A N ASP 393.A O no hydrogen 2.884 N/A THR 396.A N ASP 393.A OD1 no hydrogen 2.954 N/A THR 396.A OG1 SER 193.A OG no hydrogen 2.755 N/A THR 396.A OG1 ASP 393.A OD1 no hydrogen 2.356 N/A VAL 397.A N ASP 393.A O no hydrogen 3.064 N/A VAL 397.A N ALA 394.A O no hydrogen 3.196 N/A HIS 398.A ND1 HIS 383.A ND1 no hydrogen 2.918 N/A HIS 398.A NE2 ASN 139.A O no hydrogen 2.795 N/A ASN 399.A N SER 172.A O no hydrogen 2.948 N/A ASN 399.A ND2 LEU 137.A O no hydrogen 2.950 N/A ASN 399.A ND2 ALA 173.A O no hydrogen 3.495 N/A ALA 400.A N VAL 397.A O no hydrogen 2.875 N/A TYR 401.A N HIS 398.A O no hydrogen 3.314 N/A TYR 401.A OH ILE 347.A O no hydrogen 2.578 N/A HIS 403.A ND1 SER 433.A OG no hydrogen 2.621 N/A ARG 404.A N ALA 400.A O no hydrogen 2.959 N/A ARG 404.A NE VAL 349.A O no hydrogen 2.785 N/A ARG 404.A NH1 GLU 407.A OE1 no hydrogen 2.807 N/A ARG 404.A NH1 GLN 411.A OE1 no hydrogen 3.168 N/A ARG 404.A NH2 VAL 349.A O no hydrogen 3.545 N/A ARG 404.A NH2 SER 355.A OG no hydrogen 2.785 N/A TRP 405.A N TYR 401.A O no hydrogen 2.927 N/A TRP 405.A NE1 TYR 362.A OH no hydrogen 3.017 N/A ALA 406.A N GLY 402.A O no hydrogen 2.888 N/A GLU 407.A N HIS 403.A O no hydrogen 2.999 N/A MET 408.A N ARG 404.A O no hydrogen 2.947 N/A LEU 409.A N TRP 405.A O no hydrogen 2.999 N/A TYR 410.A N ALA 406.A O no hydrogen 2.759 N/A GLN 411.A N GLU 407.A O no hydrogen 2.927 N/A GLN 412.A N MET 408.A O no hydrogen 3.075 N/A GLN 413.A N LEU 409.A O no hydrogen 2.903 N/A LEU 414.A N TYR 410.A O no hydrogen 2.956 N/A ASP 415.A N GLN 411.A O no hydrogen 3.062 N/A ASP 415.A N GLN 412.A O no hydrogen 3.268 N/A GLN 416.A N GLN 412.A O no hydrogen 2.969 N/A PHE 417.A N GLN 413.A O no hydrogen 2.803 N/A LEU 420.A N PHE 417.A O no hydrogen 3.084 N/A ARG 421.A NE ASP 677.A O no hydrogen 3.023 N/A ARG 421.A NH1 PRO 223.A O no hydrogen 3.051 N/A ARG 421.A NH1 TYR 539.A OH no hydrogen 2.698 N/A ARG 421.A NH2 ASP 673.A OD2 no hydrogen 2.825 N/A ARG 421.A NH2 ASP 677.A O no hydrogen 2.793 N/A MET 425.A N TRP 373.A O no hydrogen 2.835 N/A MET 426.A N ILE 439.A O no hydrogen 3.091 N/A ARG 427.A NE GLU 379.A OE2 no hydrogen 2.891 N/A ARG 427.A NH2 GLU 379.A OE1 no hydrogen 2.858 N/A ARG 427.A NH2 GLU 381.A OE2 no hydrogen 3.154 N/A PHE 430.A N SER 433.A OG no hydrogen 2.753 N/A SER 433.A N PHE 430.A O no hydrogen 3.063 N/A SER 433.A OG HIS 403.A ND1 no hydrogen 2.621 N/A SER 433.A OG PHE 430.A O no hydrogen 2.920 N/A GLN 434.A N GLN 434.A OE1 no hydrogen 2.764 N/A GLN 434.A NE2 THR 217.A OG1 no hydrogen 3.108 N/A GLN 434.A NE2 GLY 218.A O no hydrogen 2.855 N/A ARG 435.A N GLY 432.A O no hydrogen 3.085 N/A ARG 435.A NE TYR 436.A OH no hydrogen 3.050 N/A ARG 435.A NH1 PHE 47.A O no hydrogen 3.330 N/A ARG 435.A NH1 THR 217.A O no hydrogen 2.871 N/A ARG 435.A NH2 PHE 47.A O no hydrogen 3.066 N/A ARG 435.A NH2 TYR 436.A OH no hydrogen 2.896 N/A TYR 436.A N SER 433.A O no hydrogen 3.002 N/A GLY 437.A N GLN 434.A O no hydrogen 2.736 N/A MET 438.A N SER 433.A O no hydrogen 3.436 N/A ILE 439.A N ILE 424.A O no hydrogen 2.881 N/A THR 442.A N HIS 471.A O no hydrogen 3.063 N/A THR 442.A OG1 TYR 145.A OH no hydrogen 3.172 N/A THR 442.A OG1 GLN 455.A OE1 no hydrogen 2.754 N/A ASP 444.A N TYR 153.A OH no hydrogen 3.124 N/A VAL 445.A N GLY 443.A O no hydrogen 2.854 N/A SER 446.A N TYR 145.A O no hydrogen 3.043 N/A SER 446.A OG TYR 145.A O no hydrogen 2.812 N/A SER 446.A OG THR 448.A OG1 no hydrogen 2.731 N/A ARG 447.A N ALA 478.A O no hydrogen 3.270 N/A ARG 447.A NH1 ASP 479.A O no hydrogen 3.066 N/A ARG 447.A NH1 GLN 506.A O no hydrogen 3.070 N/A ARG 447.A NH2 GLN 506.A O no hydrogen 2.927 N/A THR 448.A OG1 SER 446.A OG no hydrogen 2.731 N/A GLY 451.A N THR 448.A OG1 no hydrogen 3.194 N/A LEU 452.A N THR 448.A O no hydrogen 3.097 N/A ALA 453.A N TRP 449.A O no hydrogen 2.698 N/A SER 454.A N GLY 450.A O no hydrogen 3.174 N/A SER 454.A OG SER 146.A O no hydrogen 2.488 N/A SER 454.A OG GLY 450.A O no hydrogen 2.596 N/A GLN 455.A N LEU 452.A O no hydrogen 3.014 N/A GLN 455.A NE2 TYR 145.A OH no hydrogen 3.088 N/A GLN 455.A NE2 GLY 451.A O no hydrogen 2.898 N/A LEU 458.A N SER 454.A O no hydrogen 3.134 N/A ALA 459.A N GLN 455.A O no hydrogen 2.850 N/A LEU 460.A N VAL 456.A O no hydrogen 2.940 N/A GLN 461.A N GLU 457.A O no hydrogen 3.021 N/A GLN 461.A NE2 MET 128.A O no hydrogen 2.891 N/A MET 462.A N LEU 458.A O no hydrogen 3.154 N/A SER 463.A N ALA 459.A O no hydrogen 2.760 N/A SER 463.A OG ALA 459.A O no hydrogen 2.706 N/A LEU 464.A N LEU 460.A O no hydrogen 2.945 N/A LEU 465.A N MET 462.A O no hydrogen 3.213 N/A GLY 466.A N SER 463.A O no hydrogen 3.418 N/A PHE 467.A N MET 462.A O no hydrogen 3.044 N/A ILE 470.A N PHE 467.A O no hydrogen 3.292 N/A HIS 471.A N PRO 440.A O no hydrogen 3.189 N/A HIS 471.A ND1 TYR 469.A O no hydrogen 3.064 N/A LEU 474.A N ARG 502.A O no hydrogen 3.189 N/A GLY 476.A N ASP 473.A O no hydrogen 2.892 N/A PHE 477.A N VAL 445.A O no hydrogen 3.100 N/A ALA 478.A N VAL 445.A O no hydrogen 2.865 N/A ASP 479.A N GLN 506.A OE1 no hydrogen 2.911 N/A LYS 485.A NZ ASP 517.A OD2 no hydrogen 3.124 N/A LYS 485.A NZ GLU 519.A OE1 no hydrogen 2.633 N/A MET 487.A N ASP 484.A OD1 no hydrogen 3.419 N/A TYR 488.A N ASP 484.A O no hydrogen 2.945 N/A TYR 488.A OH SER 511.A O no hydrogen 2.739 N/A ILE 489.A N LYS 485.A O no hydrogen 2.933 N/A ARG 490.A N GLU 486.A O no hydrogen 3.013 N/A ARG 490.A NH1 GLN 493.A OE1 no hydrogen 3.019 N/A ARG 490.A NH1 ASP 622.A O no hydrogen 3.059 N/A ARG 490.A NH1 THR 625.A O no hydrogen 2.752 N/A ARG 490.A NH2 ASP 622.A O no hydrogen 2.917 N/A TRP 491.A N MET 487.A O no hydrogen 2.843 N/A TRP 491.A NE1 SER 472.A OG no hydrogen 3.249 N/A LEU 492.A N TYR 488.A O no hydrogen 2.818 N/A GLN 493.A N ILE 489.A O no hydrogen 2.859 N/A GLN 493.A NE2 LEU 623.A O no hydrogen 2.877 N/A TYR 494.A N ARG 490.A O no hydrogen 3.054 N/A GLY 495.A N TRP 491.A O no hydrogen 2.963 N/A VAL 496.A N GLN 493.A O no hydrogen 3.128 N/A PHE 497.A N TYR 494.A O no hydrogen 2.847 N/A GLN 498.A N GLY 495.A O no hydrogen 3.109 N/A GLN 498.A NE2 GLY 495.A O no hydrogen 3.078 N/A GLN 498.A NE2 VAL 500.A O no hydrogen 2.871 N/A TYR 501.A OH LEU 492.A O no hydrogen 2.952 N/A ARG 502.A NE HIS 471.A NE2 no hydrogen 2.886 N/A ARG 502.A NH1 ASP 473.A OD1 no hydrogen 3.183 N/A ARG 502.A NH2 HIS 471.A NE2 no hydrogen 3.307 N/A ARG 502.A NH2 ASP 473.A OD1 no hydrogen 2.557 N/A HIS 504.A N LEU 474.A O no hydrogen 3.383 N/A GLN 506.A N PHE 477.A O no hydrogen 3.079 N/A GLN 506.A NE2 TYR 143.A OH no hydrogen 2.920 N/A ASP 507.A N PHE 235.A O no hydrogen 2.947 N/A HIS 508.A NE2 ASP 479.A O no hydrogen 2.944 N/A HIS 508.A NE2 GLY 480.A O no hydrogen 2.753 N/A ILE 509.A N GLN 506.A O no hydrogen 3.234 N/A SER 511.A OG SER 233.A O no hydrogen 2.883 N/A SER 511.A OG GLU 512.A OE1 no hydrogen 3.562 N/A GLU 512.A N GLU 512.A OE1 no hydrogen 2.522 N/A PHE 515.A N GLU 512.A O no hydrogen 3.066 N/A GLN 516.A N PRO 513.A O no hydrogen 3.283 N/A THR 520.A N ASP 517.A OD1 no hydrogen 2.900 N/A THR 520.A OG1 ASP 517.A OD1 no hydrogen 2.690 N/A LYS 521.A N ASP 517.A O no hydrogen 2.909 N/A LYS 521.A NZ GLU 253.A OE1 no hydrogen 2.863 N/A LYS 521.A NZ GLU 518.A OE2 no hydrogen 3.046 N/A ALA 522.A N GLU 518.A O no hydrogen 2.843 N/A ILE 523.A N GLU 519.A O no hydrogen 3.087 N/A LEU 524.A N THR 520.A O no hydrogen 2.959 N/A ARG 525.A N LYS 521.A O no hydrogen 2.828 N/A ARG 525.A NE GLU 253.A O no hydrogen 2.845 N/A ARG 525.A NH2 GLU 253.A O no hydrogen 2.870 N/A LEU 527.A N LEU 524.A O no hydrogen 2.898 N/A VAL 528.A N LEU 524.A O no hydrogen 2.842 N/A LYS 529.A N ARG 525.A O no hydrogen 2.975 N/A LYS 529.A NZ ASP 254.A OD2 no hydrogen 2.838 N/A LEU 530.A N PRO 526.A O no hydrogen 2.865 N/A ARG 531.A N LEU 527.A O no hydrogen 2.940 N/A ARG 531.A NE LEU 228.A O no hydrogen 3.034 N/A ARG 531.A NH1 VAL 496.A O no hydrogen 2.957 N/A ARG 531.A NH1 GLN 498.A O no hydrogen 2.909 N/A ARG 531.A NH2 LEU 228.A O no hydrogen 3.523 N/A ARG 531.A NH2 PRO 499.A O no hydrogen 2.896 N/A TYR 532.A N VAL 528.A O no hydrogen 3.296 N/A TYR 532.A OH ASP 258.A OD1 no hydrogen 2.510 N/A ARG 533.A N LYS 529.A O no hydrogen 2.881 N/A MET 534.A N LEU 530.A O no hydrogen 2.880 N/A LEU 535.A N TYR 532.A O no hydrogen 3.096 N/A TYR 537.A N MET 534.A O no hydrogen 2.668 N/A TYR 537.A OH TRP 575.A O no hydrogen 2.679 N/A ILE 538.A N MET 534.A O no hydrogen 3.106 N/A TYR 539.A N LEU 535.A O no hydrogen 2.826 N/A TYR 539.A OH ASP 673.A OD1 no hydrogen 2.617 N/A TYR 539.A OH ASP 673.A OD2 no hydrogen 3.331 N/A THR 540.A N PRO 536.A O no hydrogen 3.171 N/A THR 540.A OG1 PRO 536.A O no hydrogen 2.737 N/A ALA 541.A N TYR 537.A O no hydrogen 3.188 N/A ALA 542.A N ILE 538.A O no hydrogen 2.807 N/A TYR 543.A N TYR 539.A O no hydrogen 2.913 N/A GLN 544.A N THR 540.A O no hydrogen 3.027 N/A GLN 544.A NE2 GLU 669.A OE2 no hydrogen 2.774 N/A ASN 545.A N ALA 541.A O no hydrogen 3.010 N/A ASN 545.A ND2 GLY 549.A O no hydrogen 3.160 N/A ASN 545.A ND2 MET 550.A O no hydrogen 3.025 N/A THR 546.A N ALA 542.A O no hydrogen 2.928 N/A THR 546.A OG1 GLN 220.A O no hydrogen 2.768 N/A LEU 547.A N TYR 543.A O no hydrogen 2.949 N/A THR 548.A N GLN 544.A O no hydrogen 2.807 N/A THR 548.A OG1 GLN 544.A O no hydrogen 2.815 N/A GLY 549.A N ASN 545.A O no hydrogen 2.788 N/A MET 550.A N THR 548.A OG1 no hydrogen 3.009 N/A ARG 554.A N PHE 574.A O no hydrogen 2.772 N/A ARG 554.A NE PRO 551.A O no hydrogen 2.748 N/A ARG 554.A NE LEU 552.A O no hydrogen 3.078 N/A ARG 554.A NH1 ASP 577.A OD1 no hydrogen 3.143 N/A PHE 558.A N PRO 555.A O no hydrogen 2.993 N/A SER 559.A N LEU 556.A O no hydrogen 2.950 N/A SER 559.A OG LEU 556.A O no hydrogen 2.566 N/A ASP 560.A N PHE 557.A O no hydrogen 3.294 N/A LYS 562.A N ASP 560.A OD1 no hydrogen 3.202 N/A ASN 563.A N ASP 560.A O no hydrogen 3.378 N/A LEU 566.A N ASN 563.A O no hydrogen 3.142 N/A ILE 567.A N PRO 564.A O no hydrogen 2.872 N/A ASP 568.A N ALA 565.A O no hydrogen 3.314 N/A ASN 569.A N LEU 566.A O no hydrogen 3.022 N/A THR 571.A N ASN 569.A OD1 no hydrogen 2.947 N/A THR 571.A OG1 ASN 569.A OD1 no hydrogen 3.461 N/A SER 572.A N ASN 569.A OD1 no hydrogen 3.098 N/A SER 572.A OG THR 582.A OG1 no hydrogen 2.547 N/A TYR 573.A N VAL 581.A O no hydrogen 2.988 N/A TYR 573.A OH PHE 497.A O no hydrogen 2.601 N/A PHE 574.A N ARG 554.A O no hydrogen 2.805 N/A TRP 575.A N LEU 579.A O no hydrogen 2.917 N/A GLY 576.A N LEU 552.A O no hydrogen 2.946 N/A SER 578.A N TYR 537.A OH no hydrogen 2.845 N/A LEU 580.A N LEU 629.A O no hydrogen 2.873 N/A VAL 581.A N TYR 573.A O no hydrogen 2.836 N/A THR 582.A N PRO 627.A O no hydrogen 2.947 N/A THR 582.A OG1 SER 572.A OG no hydrogen 2.547 N/A GLY 588.A N GLU 486.A OE2 no hydrogen 2.729 N/A VAL 592.A N LEU 619.A O no hydrogen 2.821 N/A ILE 594.A N LEU 617.A O no hydrogen 2.722 N/A ALA 596.A N ILE 594.A O no hydrogen 2.844 N/A GLY 599.A N THR 612.A O no hydrogen 2.939 N/A TRP 601.A N TYR 610.A O no hydrogen 2.855 N/A TRP 601.A NE1 PRO 597.A O no hydrogen 2.839 N/A PHE 602.A N VAL 630.A O no hydrogen 2.798 N/A ASP 603.A N THR 608.A O no hydrogen 2.765 N/A PHE 604.A N VAL 628.A O no hydrogen 2.973 N/A TRP 605.A N ASP 603.A OD1 no hydrogen 2.959 N/A TRP 605.A NE1 ILE 626.A O no hydrogen 2.745 N/A LYS 606.A N ASP 603.A O no hydrogen 3.365 N/A ASP 607.A N ASP 603.A O no hydrogen 2.755 N/A ARG 609.A NE ASP 660.A OD2 no hydrogen 2.948 N/A ARG 609.A NH2 ASP 660.A OD2 no hydrogen 2.751 N/A TYR 610.A N TRP 601.A O no hydrogen 2.809 N/A GLN 611.A NE2 ASP 613.A OD1 no hydrogen 2.292 N/A THR 612.A N GLY 599.A O no hydrogen 3.040 N/A THR 612.A OG1 ALA 615.A O no hydrogen 2.615 N/A GLY 614.A N THR 612.A OG1 no hydrogen 2.979 N/A LEU 617.A N ILE 594.A O no hydrogen 2.907 N/A LEU 619.A N VAL 592.A O no hydrogen 2.914 N/A THR 621.A N GLU 590.A O no hydrogen 3.289 N/A THR 621.A OG1 VAL 589.A O no hydrogen 2.702 N/A HIS 624.A N.A ASP 622.A OD1 no hydrogen 3.219 N/A HIS 624.A N.B ASP 622.A OD1 no hydrogen 3.195 N/A THR 625.A N ASP 622.A OD1 no hydrogen 2.883 N/A THR 625.A OG1 ASP 622.A OD1 no hydrogen 2.639 N/A THR 625.A OG1 ASP 622.A OD2 no hydrogen 3.233 N/A LEU 629.A N LEU 580.A O no hydrogen 2.943 N/A VAL 630.A N PHE 602.A O no hydrogen 2.748 N/A LYS 631.A N SER 578.A O no hydrogen 2.858 N/A ALA 632.A N VAL 600.A O no hydrogen 2.987 N/A GLY 633.A N TYR 658.A O no hydrogen 2.748 N/A ALA 634.A N LYS 631.A O no hydrogen 3.091 N/A MET 636.A N HIS 656.A O no hydrogen 2.788 N/A TYR 638.A N GLU 654.A O no hydrogen 2.685 N/A VAL 639.A N ARG 533.A O no hydrogen 3.016 N/A THR 644.A OG1 GLY 299.A O no hydrogen 2.728 N/A THR 645.A N ASP 258.A OD1 no hydrogen 2.911 N/A THR 645.A N ASP 258.A OD2 no hydrogen 3.198 N/A THR 645.A OG1 ASP 258.A OD2 no hydrogen 2.552 N/A GLU 646.A N THR 644.A OG1 no hydrogen 3.151 N/A ASP 647.A N THR 644.A O no hydrogen 2.970 N/A TYR 648.A N THR 645.A O no hydrogen 3.199 N/A TYR 648.A OH GLU 672.A OE2 no hydrogen 2.372 N/A LEU 653.A N ALA 719.A O no hydrogen 2.889 N/A GLU 654.A N TYR 638.A O no hydrogen 2.948 N/A ILE 655.A N THR 721.A O no hydrogen 2.880 N/A HIS 656.A N MET 636.A O no hydrogen 2.904 N/A TYR 657.A N VAL 723.A O no hydrogen 2.872 N/A TYR 658.A N ALA 634.A O no hydrogen 3.076 N/A ALA 659.A N HIS 725.A O no hydrogen 3.106 N/A SER 662.A N ASP 660.A OD1 no hydrogen 2.753 N/A SER 662.A OG ASP 660.A OD1 no hydrogen 2.613 N/A VAL 663.A N ASP 660.A O no hydrogen 2.815 N/A ALA 666.A N ALA 693.A O no hydrogen 2.998 N/A GLY 668.A N LEU 691.A O no hydrogen 2.926 N/A ILE 670.A N LEU 689.A O no hydrogen 2.861 N/A PHE 671.A N THR 540.A OG1 no hydrogen 2.875 N/A GLU 672.A N ASP 687.A O no hydrogen 2.932 N/A GLY 675.A N ASP 673.A OD1 no hydrogen 2.595 N/A LYS 676.A N ASP 674.A OD1 no hydrogen 3.142 N/A ASP 677.A N ASP 674.A OD1 no hydrogen 2.945 N/A ASN 679.A N ASP 677.A OD1 no hydrogen 2.824 N/A SER 680.A N ASP 677.A O no hydrogen 3.178 N/A SER 680.A OG ASP 673.A OD2 no hydrogen 2.679 N/A SER 680.A OG ASP 677.A O no hydrogen 3.259 N/A ARG 683.A N ASN 679.A O no hydrogen 2.894 N/A ASN 684.A N ILE 681.A O no hydrogen 3.190 N/A GLN 685.A N SER 680.A O no hydrogen 2.881 N/A GLN 685.A NE2 ARG 683.A O no hydrogen 3.561 N/A ASP 687.A N GLU 672.A O no hydrogen 2.866 N/A LEU 688.A N THR 707.A O no hydrogen 2.979 N/A LEU 689.A N ILE 670.A O no hydrogen 2.807 N/A THR 690.A N ALA 705.A O no hydrogen 2.904 N/A THR 690.A OG1 ALA 705.A O no hydrogen 3.138 N/A LEU 691.A N GLY 668.A O no hydrogen 3.059 N/A GLN 692.A N GLN 703.A O no hydrogen 2.895 N/A ALA 693.A N ALA 666.A O no hydrogen 2.877 N/A THR 694.A N HIS 701.A O no hydrogen 2.698 N/A HIS 695.A N PRO 664.A O no hydrogen 3.050 N/A HIS 695.A ND1 THR 696.A O no hydrogen 3.286 N/A THR 696.A N GLN 699.A O no hydrogen 2.995 N/A THR 696.A OG1 GLN 699.A O no hydrogen 3.427 N/A LEU 700.A N LEU 779.A O no hydrogen 2.972 N/A HIS 701.A N THR 694.A O no hydrogen 2.811 N/A HIS 701.A ND1 LEU 777.A O no hydrogen 3.076 N/A PHE 702.A N LEU 777.A O no hydrogen 2.810 N/A GLN 703.A N GLN 692.A O no hydrogen 2.867 N/A LEU 704.A N LEU 775.A O no hydrogen 2.777 N/A ALA 705.A N THR 690.A O no hydrogen 3.207 N/A ARG 706.A NE ASP 687.A OD1 no hydrogen 2.904 N/A ARG 706.A NH1 GLU 716.A O no hydrogen 2.920 N/A ARG 706.A NH2 ASP 687.A OD2 no hydrogen 3.055 N/A ARG 706.A NH2 PRO 715.A O no hydrogen 2.852 N/A THR 707.A N LEU 688.A O no hydrogen 3.030 N/A LYS 709.A N ASN 684.A O no hydrogen 3.080 N/A GLY 710.A N PHE 686.A O no hydrogen 2.911 N/A MET 714.A N TYR 711.A O no hydrogen 3.153 N/A ARG 718.A N TRP 770.A O no hydrogen 2.833 N/A ARG 718.A NE SER 650.A O no hydrogen 3.122 N/A ARG 718.A NE SER 650.A OG no hydrogen 3.153 N/A ARG 718.A NH1 ASP 687.A OD2 no hydrogen 2.826 N/A ARG 718.A NH2 SER 650.A OG no hydrogen 3.417 N/A ARG 718.A NH2 ASP 687.A OD2 no hydrogen 2.737 N/A ALA 719.A N ASP 651.A O no hydrogen 2.920 N/A THR 720.A N PHE 768.A O no hydrogen 2.924 N/A THR 720.A OG1 ARG 718.A O no hydrogen 3.132 N/A THR 721.A N LEU 653.A O no hydrogen 2.999 N/A LEU 722.A N LEU 766.A O no hydrogen 2.741 N/A VAL 723.A N ILE 655.A O no hydrogen 2.793 N/A ILE 724.A N LEU 764.A O no hydrogen 2.840 N/A HIS 725.A N TYR 657.A O no hydrogen 2.864 N/A ASN 726.A ND2 ALA 659.A O no hydrogen 2.958 N/A ALA 727.A N ARG 762.A O no hydrogen 2.866 N/A GLN 730.A N SER 728.A OG no hydrogen 3.017 N/A GLN 732.A N HIS 780.A O no hydrogen 3.014 N/A HIS 733.A N HIS 780.A O no hydrogen 3.262 N/A LEU 734.A N ILE 741.A O no hydrogen 3.382 N/A ASP 735.A N ARG 778.A O no hydrogen 2.914 N/A ILE 736.A N LYS 739.A O no hydrogen 3.004 N/A ASN 737.A N ASN 776.A O no hydrogen 2.906 N/A GLY 738.A N ASP 735.A OD1 no hydrogen 3.200 N/A LYS 739.A N ILE 736.A O no hydrogen 3.161 N/A ILE 741.A N LEU 734.A O no hydrogen 2.656 N/A ALA 744.A N ALA 755.A O no hydrogen 2.965 N/A GLN 745.A NE2 ILE 743.A O no hydrogen 3.152 N/A SER 750.A N ASP 747.A O no hydrogen 3.016 N/A SER 750.A OG ASP 747.A O no hydrogen 3.528 N/A THR 751.A OG1 ASP 747.A O no hydrogen 2.903 N/A CYS 756.A N GLN 765.A O no hydrogen 2.919 N/A CYS 756.A SG ALA 746.A O no hydrogen 3.098 N/A TYR 757.A N ALA 744.A O no hydrogen 2.887 N/A TYR 757.A OH ALA 727.A O no hydrogen 3.026 N/A ASP 758.A N GLN 763.A O no hydrogen 2.787 N/A GLN 759.A NE2 GLU 760.A OE2 no hydrogen 3.133 N/A ARG 761.A N ASP 758.A O no hydrogen 3.268 N/A ARG 761.A N ASP 758.A OD1 no hydrogen 2.971 N/A ARG 761.A NH1 ASP 758.A OD2 no hydrogen 2.815 N/A ARG 762.A NE ASN 726.A OD1 no hydrogen 3.235 N/A ARG 762.A NH2 ASN 726.A OD1 no hydrogen 3.311 N/A GLN 763.A N ASP 758.A O no hydrogen 3.339 N/A GLN 763.A NE2 ASP 607.A OD2 no hydrogen 3.096 N/A LEU 764.A N ILE 724.A O no hydrogen 2.914 N/A GLN 765.A N CYS 756.A O no hydrogen 2.851 N/A LEU 766.A N LEU 722.A O no hydrogen 2.825 N/A VAL 767.A N LEU 754.A O no hydrogen 2.792 N/A PHE 768.A N THR 720.A O no hydrogen 2.976 N/A TRP 770.A N ARG 718.A O no hydrogen 2.854 N/A LEU 775.A N LEU 704.A O no hydrogen 2.970 N/A ASN 776.A N ASN 737.A OD1 no hydrogen 3.007 N/A LEU 777.A N PHE 702.A O no hydrogen 2.856 N/A ARG 778.A N ASP 735.A O no hydrogen 2.846 N/A LEU 779.A N LEU 700.A O no hydrogen 2.900 N/A HIS 780.A N HIS 733.A O no hydrogen 2.989 N/A LYS 781.A N ASN 698.A O no hydrogen 2.936 N/A LYS 781.A NZ ASP 697.A O no hydrogen 2.913 N/A