Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bga_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE1 no hydrogen 2.694 N/A GLN 5.A N PRO 2.A O no hydrogen 3.020 N/A GLN 5.A NE2 VAL 112.A O no hydrogen 3.046 N/A SER 6.A N GLU 3.A O no hydrogen 3.056 N/A GLN 7.A N GLN 7.A OE1 no hydrogen 2.650 N/A GLN 7.A NE2 THR 420.A OG1 no hydrogen 2.991 N/A TYR 8.A N SER 6.A OG no hydrogen 3.120 N/A VAL 10.A N TYR 8.A O no hydrogen 2.806 N/A ASN 13.A ND2 LEU 157.A O no hydrogen 2.821 N/A LYS 14.A NZ ASN 160.A OD1 no hydrogen 2.606 N/A LEU 15.A N GLU 168.A O no hydrogen 2.890 N/A HIS 18.A ND1 THR 19.A O no hydrogen 2.633 N/A HIS 18.A NE2 GLU 168.A OE2 no hydrogen 2.803 N/A THR 19.A N ASP 221.A OD1 no hydrogen 2.722 N/A TYR 20.A OH GLU 142.A OE1 no hydrogen 2.621 N/A TRP 22.A NE1 TYR 210.A OH no hydrogen 2.989 N/A TYR 24.A N LEU 319.A O no hydrogen 2.821 N/A SER 28.A N ASP 26.A OD1 no hydrogen 2.949 N/A ASP 29.A N ASP 26.A O no hydrogen 3.053 N/A ILE 30.A N ALA 27.A O no hydrogen 3.366 N/A LYS 32.A N ASP 29.A O no hydrogen 3.018 N/A LYS 32.A NZ ASP 29.A OD1 no hydrogen 3.020 N/A GLY 34.A N GLN 390.A OE1 no hydrogen 2.727 N/A GLY 35.A N LYS 32.A O no hydrogen 2.748 N/A GLU 37.A N GLY 34.A O no hydrogen 3.072 N/A GLN 38.A N GLY 35.A O no hydrogen 2.961 N/A SER 39.A N TYR 36.A O no hydrogen 3.192 N/A SER 39.A OG PRO 23.A O no hydrogen 2.723 N/A TYR 41.A N SER 39.A OG no hydrogen 3.097 N/A TYR 42.A N SER 39.A O no hydrogen 2.968 N/A LEU 44.A N VAL 209.A O no hydrogen 2.823 N/A ASN 45.A N SER 43.A OG no hydrogen 3.020 N/A ASN 45.A ND2 ASP 208.A OD1 no hydrogen 2.723 N/A GLY 46.A N VAL 78.A O no hydrogen 2.825 N/A TRP 48.A N ILE 76.A O no hydrogen 3.016 N/A TRP 48.A NE1 LEU 44.A O no hydrogen 2.824 N/A LYS 49.A N ARG 123.A O no hydrogen 2.752 N/A LYS 49.A NZ TRP 73.A O no hydrogen 2.831 N/A LYS 49.A NZ ASP 75.A OD1 no hydrogen 3.021 N/A PHE 50.A N ALA 74.A O no hydrogen 2.919 N/A ASN 51.A N SER 121.A O no hydrogen 3.084 N/A TRP 52.A NE1 GLU 118.A OE1 no hydrogen 2.912 N/A VAL 53.A N VAL 119.A O no hydrogen 3.030 N/A LYS 54.A NZ GLU 116.A O no hydrogen 3.214 N/A ASN 55.A N ASN 117.A O no hydrogen 2.890 N/A ASP 57.A N ASN 55.A OD1 no hydrogen 2.552 N/A ASN 58.A N ASN 55.A O no hydrogen 2.679 N/A ARG 59.A N PRO 56.A O no hydrogen 3.072 N/A ARG 59.A NE GLU 185.A OE1 no hydrogen 3.190 N/A ARG 59.A NE GLU 185.A OE2 no hydrogen 2.823 N/A ARG 59.A NH1 PRO 56.A O no hydrogen 2.870 N/A LYS 61.A N ARG 59.A O no hydrogen 2.964 N/A PHE 63.A N PRO 60.A O no hydrogen 3.103 N/A GLN 65.A N ASP 62.A O no hydrogen 3.013 N/A TYR 68.A N GLN 65.A O no hydrogen 2.854 N/A TRP 73.A N THR 70.A O no hydrogen 2.735 N/A ILE 76.A N TRP 48.A O no hydrogen 2.754 N/A ASN 77.A N GLN 85.A OE1 no hydrogen 2.918 N/A VAL 78.A N GLY 46.A O no hydrogen 2.818 N/A GLY 80.A N ILE 205.A O no hydrogen 2.745 N/A ASN 81.A ND2 SER 203.A O no hydrogen 2.970 N/A ASN 81.A ND2 GLU 206.A OE2 no hydrogen 2.946 N/A TRP 82.A N SER 203.A O no hydrogen 3.066 N/A GLU 83.A N GLU 83.A OE1 no hydrogen 2.842 N/A ARG 84.A N ASN 81.A O no hydrogen 3.229 N/A ARG 84.A NE GLN 355.A O no hydrogen 2.930 N/A ARG 84.A NH1 GLU 548.A OE2 no hydrogen 2.964 N/A GLN 85.A N TRP 82.A O no hydrogen 2.869 N/A GLN 85.A NE2 ASN 77.A O no hydrogen 3.109 N/A GLN 85.A NE2 GLY 80.A O no hydrogen 3.033 N/A GLN 85.A NE2 ASN 81.A O no hydrogen 3.583 N/A TYR 87.A N TRP 82.A O no hydrogen 3.171 N/A TYR 92.A OH ASP 199.A OD1 no hydrogen 2.659 N/A TYR 97.A OH TYR 194.A O no hydrogen 2.692 N/A GLU 98.A N GLU 98.A OE1 no hydrogen 2.735 N/A ASP 100.A N TYR 97.A O no hydrogen 2.911 N/A ASN 104.A N LYS 102.A O no hydrogen 2.922 N/A ASN 104.A ND2 GLU 116.A OE2 no hydrogen 3.340 N/A PHE 105.A N ASP 101.A O no hydrogen 3.507 N/A LYS 107.A N ASP 100.A OD1 no hydrogen 2.783 N/A ASN 108.A N TYR 194.A OH no hydrogen 2.879 N/A LEU 111.A N ASN 108.A O no hydrogen 3.015 N/A VAL 112.A N GLN 5.A OE1 no hydrogen 2.961 N/A ASN 117.A N PHE 114.A O no hydrogen 3.129 N/A ASN 117.A ND2 TRP 189.A O no hydrogen 2.972 N/A GLU 118.A N ASN 117.A OD1 no hydrogen 2.800 N/A VAL 119.A N VAL 53.A O no hydrogen 2.825 N/A GLY 120.A N VAL 186.A O no hydrogen 2.756 N/A SER 121.A N ASN 51.A O no hydrogen 2.844 N/A TYR 122.A N LEU 184.A O no hydrogen 2.780 N/A ARG 123.A N LYS 49.A O no hydrogen 3.038 N/A ARG 123.A NH1 PHE 63.A O no hydrogen 3.135 N/A ARG 123.A NH1 TYR 68.A O no hydrogen 3.141 N/A ARG 123.A NH2 TYR 68.A O no hydrogen 3.045 N/A ARG 123.A NH2 THR 70.A OG1 no hydrogen 3.000 N/A ARG 124.A N VAL 182.A O no hydrogen 3.142 N/A ARG 124.A NE THR 125.A O no hydrogen 2.945 N/A ARG 124.A NH1 LEU 44.A O no hydrogen 3.019 N/A ARG 124.A NH2 THR 125.A O no hydrogen 3.113 N/A THR 125.A OG1 GLU 179.A OE2 no hydrogen 2.795 N/A THR 125.A OG1 ASN 180.A O no hydrogen 3.236 N/A PHE 126.A N ASN 180.A O no hydrogen 2.905 N/A TRP 132.A N PRO 129.A O no hydrogen 3.083 N/A TRP 132.A NE1 PRO 40.A O no hydrogen 2.979 N/A LYS 133.A N ALA 130.A O no hydrogen 3.151 N/A ARG 135.A N TRP 132.A O no hydrogen 2.959 N/A ARG 135.A NE SER 213.A OG no hydrogen 2.594 N/A ARG 135.A NH2 SER 213.A O no hydrogen 2.955 N/A ARG 136.A N THR 214.A O no hydrogen 2.714 N/A ARG 136.A NE ASP 170.A OD2 no hydrogen 3.226 N/A ARG 136.A NH1 THR 214.A OG1 no hydrogen 2.870 N/A VAL 137.A N THR 172.A OG1 no hydrogen 2.928 N/A VAL 138.A N TYR 212.A O no hydrogen 2.889 N/A LEU 139.A N TRP 169.A O no hydrogen 2.870 N/A CYS 140.A N TYR 210.A O no hydrogen 2.874 N/A CYS 140.A SG GLU 168.A OE1 no hydrogen 3.527 N/A CYS 140.A SG TYR 210.A OH no hydrogen 3.463 N/A CYS 141.A N ALA 167.A O no hydrogen 3.046 N/A GLU 142.A N ASP 208.A O no hydrogen 2.990 N/A ILE 145.A N GLY 204.A O no hydrogen 2.869 N/A SER 146.A OG ARG 188.A O no hydrogen 2.774 N/A PHE 147.A N TYR 187.A O no hydrogen 3.409 N/A TYR 148.A N ASN 160.A O no hydrogen 3.402 N/A TYR 149.A N GLU 185.A O no hydrogen 3.230 N/A TYR 149.A OH GLU 3.A OE1 no hydrogen 2.684 N/A VAL 150.A N GLY 158.A O no hydrogen 3.033 N/A TRP 151.A N ALA 183.A O no hydrogen 2.957 N/A VAL 152.A N LYS 155.A O no hydrogen 3.023 N/A ASN 153.A N VAL 181.A O no hydrogen 2.592 N/A ASN 153.A ND2 VAL 174.A O no hydrogen 3.013 N/A ASN 153.A ND2 ASN 180.A OD1 no hydrogen 2.721 N/A LYS 155.A N VAL 152.A O no hydrogen 3.025 N/A LEU 157.A N VAL 150.A O no hydrogen 2.793 N/A ASN 160.A N TYR 148.A O no hydrogen 3.081 N/A ASN 160.A ND2 GLY 162.A O no hydrogen 3.014 N/A GLN 161.A N VAL 10.A O no hydrogen 3.079 N/A GLN 161.A NE2 SER 6.A O no hydrogen 3.018 N/A GLN 161.A NE2 ALA 9.A O no hydrogen 2.818 N/A SER 163.A N GLU 196.A OE2 no hydrogen 3.264 N/A SER 163.A OG GLU 196.A OE1 no hydrogen 2.599 N/A SER 163.A OG GLU 196.A OE2 no hydrogen 3.159 N/A LYS 164.A NZ SER 163.A OG no hydrogen 3.057 N/A LYS 164.A NZ GLU 206.A OE1 no hydrogen 2.913 N/A ALA 167.A N CYS 141.A O no hydrogen 2.996 N/A TRP 169.A N LEU 139.A O no hydrogen 3.071 N/A TRP 169.A NE1 LEU 12.A O no hydrogen 2.947 N/A ILE 171.A N VAL 137.A O no hydrogen 2.977 N/A THR 172.A N ASP 170.A OD1 no hydrogen 2.898 N/A THR 172.A OG1 ASP 170.A OD1 no hydrogen 2.837 N/A VAL 174.A N ILE 171.A O no hydrogen 2.979 N/A LEU 175.A N ILE 171.A O no hydrogen 3.164 N/A LEU 175.A N THR 172.A O no hydrogen 3.382 N/A SER 176.A N ASN 180.A OD1 no hydrogen 2.830 N/A SER 176.A OG ASN 180.A OD1 no hydrogen 3.157 N/A ASN 180.A N PHE 126.A O no hydrogen 2.709 N/A ASN 180.A ND2 SER 176.A O no hydrogen 3.115 N/A VAL 181.A N ASN 153.A OD1 no hydrogen 2.718 N/A VAL 182.A N ARG 124.A O no hydrogen 3.133 N/A ALA 183.A N TRP 151.A O no hydrogen 2.899 N/A LEU 184.A N TYR 122.A O no hydrogen 2.912 N/A GLU 185.A N TYR 149.A O no hydrogen 3.019 N/A VAL 186.A N GLY 120.A O no hydrogen 2.813 N/A TYR 187.A N PHE 147.A O no hydrogen 2.801 N/A TYR 187.A OH GLU 185.A OE1 no hydrogen 2.631 N/A ARG 188.A N GLU 118.A O no hydrogen 2.972 N/A ARG 188.A NH1 THR 89.A O no hydrogen 3.142 N/A ARG 188.A NH1 GLU 118.A OE2 no hydrogen 2.891 N/A ARG 188.A NH2 THR 89.A O no hydrogen 2.978 N/A ARG 188.A NH2 ARG 201.A O no hydrogen 3.095 N/A TRP 189.A N ASN 117.A OD1 no hydrogen 3.052 N/A TRP 189.A NE1 GLU 98.A OE2 no hydrogen 2.784 N/A SER 191.A N TRP 4.A O no hydrogen 2.983 N/A SER 191.A OG TRP 4.A O no hydrogen 3.559 N/A SER 191.A OG PRO 110.A O no hydrogen 2.940 N/A ALA 193.A N SER 190.A O no hydrogen 2.821 N/A TYR 194.A N SER 191.A O no hydrogen 2.911 N/A TYR 194.A OH LEU 111.A O no hydrogen 2.636 N/A LEU 195.A N GLY 192.A O no hydrogen 3.020 N/A GLU 196.A N ALA 193.A O no hydrogen 2.996 N/A CYS 197.A N GLU 405.A O no hydrogen 2.734 N/A CYS 197.A SG THR 96.A O no hydrogen 3.468 N/A GLN 198.A N GLN 198.A OE1 no hydrogen 2.752 N/A GLN 198.A NE2 HIS 381.A O no hydrogen 2.712 N/A GLN 198.A NE2 ASN 403.A OD1 no hydrogen 2.923 N/A TRP 200.A NE1 GLN 544.A O no hydrogen 2.690 N/A ARG 201.A N ILE 91.A O no hydrogen 2.780 N/A ARG 201.A NE GLN 198.A O no hydrogen 3.177 N/A ARG 201.A NH1 THR 96.A O no hydrogen 3.069 N/A ARG 201.A NH1 GLU 98.A OE1 no hydrogen 2.818 N/A ARG 201.A NH2 THR 96.A O no hydrogen 3.118 N/A ARG 201.A NH2 GLN 198.A O no hydrogen 3.026 N/A SER 203.A N GLU 83.A OE1 no hydrogen 2.757 N/A SER 203.A OG GLU 83.A OE2 no hydrogen 2.576 N/A ILE 205.A N TYR 122.A OH no hydrogen 3.113 N/A GLU 206.A N GLY 143.A O no hydrogen 2.856 N/A ARG 207.A N GLY 143.A O no hydrogen 2.966 N/A ARG 207.A NH1 LYS 164.A O no hydrogen 2.718 N/A ARG 207.A NH2 GLU 352.A OE1 no hydrogen 2.639 N/A ARG 207.A NH2 PRO 383.A O no hydrogen 2.803 N/A VAL 209.A N ASN 45.A OD1 no hydrogen 2.977 N/A TYR 210.A N CYS 140.A O no hydrogen 2.939 N/A TYR 210.A OH GLU 142.A OE2 no hydrogen 3.012 N/A TYR 212.A N VAL 138.A O no hydrogen 3.129 N/A TYR 212.A OH GLU 168.A OE2 no hydrogen 3.065 N/A SER 213.A N TYR 41.A O no hydrogen 2.787 N/A SER 213.A OG ARG 136.A O no hydrogen 3.162 N/A THR 214.A N ARG 136.A O no hydrogen 2.919 N/A THR 214.A OG1 PRO 215.A O no hydrogen 3.019 N/A TYR 218.A N GLU 245.A O no hydrogen 2.820 N/A TYR 218.A OH GLU 245.A OE1 no hydrogen 3.111 N/A ILE 219.A N GLU 318.A OE1 no hydrogen 2.688 N/A ALA 220.A N THR 243.A O no hydrogen 2.881 N/A ASP 221.A N THR 243.A O no hydrogen 3.426 N/A LYS 223.A N GLU 241.A O no hydrogen 2.925 N/A LYS 223.A NZ TYR 431.A OH no hydrogen 3.339 N/A LYS 223.A NZ VAL 465.A O no hydrogen 2.645 N/A VAL 224.A N ASN 436.A OD1 no hydrogen 2.601 N/A SER 225.A N ASN 239.A O no hydrogen 3.059 N/A SER 227.A N ILE 237.A O no hydrogen 3.052 N/A ASP 229.A N GLU 235.A O no hydrogen 2.904 N/A GLU 231.A N ASP 229.A OD2 no hydrogen 3.178 N/A LYS 232.A N ASP 229.A OD2 no hydrogen 2.700 N/A TYR 233.A N ASP 229.A O no hydrogen 2.854 N/A TYR 233.A OH GLU 330.A OE2 no hydrogen 2.668 N/A LYS 234.A N ASP 229.A OD1 no hydrogen 2.961 N/A GLU 235.A N ASP 229.A OD1 no hydrogen 2.901 N/A GLY 236.A N ILE 289.A O no hydrogen 2.757 N/A ILE 237.A N SER 227.A O no hydrogen 2.765 N/A PHE 238.A N LYS 287.A O no hydrogen 2.903 N/A ASN 239.A N SER 225.A O no hydrogen 2.866 N/A ASN 239.A ND2 GLU 286.A OE1 no hydrogen 3.103 N/A GLU 241.A N LYS 223.A O no hydrogen 3.233 N/A VAL 242.A N ILE 282.A O no hydrogen 2.779 N/A THR 243.A N ASP 221.A O no hydrogen 2.766 N/A VAL 244.A N ASN 280.A O no hydrogen 2.880 N/A GLU 245.A N TYR 218.A O no hydrogen 2.956 N/A GLY 246.A N LEU 278.A O no hydrogen 2.903 N/A SER 248.A OG THR 250.A O no hydrogen 3.283 N/A THR 250.A OG1 ALA 251.A O no hydrogen 3.450 N/A SER 252.A N ILE 273.A O no hydrogen 3.131 N/A SER 252.A OG GLN 217.A OE1 no hydrogen 3.068 N/A SER 253.A N LYS 310.A O no hydrogen 3.226 N/A ILE 254.A N ILE 271.A O no hydrogen 3.050 N/A ALA 255.A N GLU 308.A O no hydrogen 2.889 N/A TYR 256.A N ASP 269.A O no hydrogen 2.961 N/A THR 257.A N VAL 306.A O no hydrogen 2.994 N/A LEU 258.A N LEU 267.A O no hydrogen 2.752 N/A LYS 259.A N THR 304.A O no hydrogen 2.797 N/A ASP 260.A N LYS 264.A O no hydrogen 3.062 N/A GLY 263.A N ASP 260.A O no hydrogen 3.054 N/A GLY 263.A N ASP 260.A OD1 no hydrogen 2.687 N/A LYS 264.A N ASP 260.A OD1 no hydrogen 2.788 N/A VAL 266.A N LEU 258.A O no hydrogen 2.736 N/A LEU 267.A N LEU 258.A O no hydrogen 3.413 N/A GLN 268.A NE2 THR 257.A OG1 no hydrogen 2.728 N/A ASP 269.A N TYR 256.A O no hydrogen 3.204 N/A ALA 270.A N ASP 269.A OD1 no hydrogen 2.663 N/A ILE 271.A N ILE 254.A O no hydrogen 3.050 N/A ILE 273.A N SER 252.A O no hydrogen 2.788 N/A GLY 277.A N SER 275.A OG no hydrogen 2.791 N/A ASN 280.A N VAL 244.A O no hydrogen 2.675 N/A ILE 282.A N VAL 242.A O no hydrogen 2.721 N/A PHE 284.A N LEU 240.A O no hydrogen 2.945 N/A LYS 287.A N PHE 238.A O no hydrogen 2.902 N/A ILE 289.A N GLY 236.A O no hydrogen 2.980 N/A VAL 292.A N LYS 234.A O no hydrogen 3.341 N/A LYS 293.A N TYR 303.A OH no hydrogen 2.966 N/A TRP 295.A N PHE 326.A O no hydrogen 2.807 N/A TRP 295.A NE1 ASP 393.A O no hydrogen 2.921 N/A ASN 296.A N HIS 299.A O no hydrogen 2.965 N/A ALA 297.A N TYR 398.A OH no hydrogen 3.194 N/A HIS 299.A N ASN 296.A OD1 no hydrogen 2.583 N/A TYR 303.A N VAL 324.A O no hydrogen 2.838 N/A THR 304.A N LYS 259.A O no hydrogen 2.692 N/A THR 304.A OG1 GLU 323.A OE2 no hydrogen 2.884 N/A LEU 305.A N CYS 322.A O no hydrogen 2.905 N/A VAL 306.A N THR 257.A O no hydrogen 2.962 N/A LEU 307.A N THR 320.A O no hydrogen 2.697 N/A GLU 308.A N ALA 255.A O no hydrogen 2.844 N/A LEU 309.A N GLU 318.A O no hydrogen 2.946 N/A LYS 310.A N SER 253.A O no hydrogen 2.834 N/A ASP 311.A N LYS 315.A O no hydrogen 2.701 N/A GLY 314.A N ASP 311.A O no hydrogen 2.972 N/A THR 317.A N LEU 309.A O no hydrogen 2.861 N/A THR 317.A OG1 LEU 309.A O no hydrogen 3.206 N/A GLU 318.A N LEU 309.A O no hydrogen 3.449 N/A THR 320.A N LEU 307.A O no hydrogen 3.103 N/A THR 320.A OG1 TRP 22.A O no hydrogen 2.702 N/A CYS 322.A N LEU 305.A O no hydrogen 3.253 N/A CYS 322.A SG GLU 323.A O no hydrogen 3.500 N/A VAL 324.A N TYR 303.A O no hydrogen 2.712 N/A ARG 327.A N ALA 226.A O no hydrogen 3.253 N/A ARG 327.A NE PRO 438.A O no hydrogen 2.747 N/A ARG 327.A NH1 ARG 327.A O no hydrogen 2.872 N/A ARG 327.A NH2 PRO 438.A O no hydrogen 3.397 N/A ARG 327.A NH2 ILE 440.A O no hydrogen 2.911 N/A SER 329.A OG VAL 441.A O no hydrogen 2.716 N/A GLU 330.A N CYS 337.A O no hydrogen 3.091 N/A LYS 332.A N ARG 335.A O no hydrogen 2.763 N/A LYS 332.A NZ TYR 233.A OH no hydrogen 3.223 N/A ARG 335.A N LYS 332.A O no hydrogen 2.935 N/A PHE 336.A N GLN 534.A OE1 no hydrogen 2.712 N/A CYS 337.A N GLU 330.A O no hydrogen 2.703 N/A CYS 337.A SG ARG 335.A O no hydrogen 3.513 N/A ILE 338.A N VAL 341.A O no hydrogen 2.924 N/A ASN 339.A N THR 328.A O no hydrogen 2.919 N/A ASN 339.A ND2 THR 328.A O no hydrogen 3.563 N/A VAL 341.A N ILE 338.A O no hydrogen 2.837 N/A VAL 343.A N PHE 336.A O no hydrogen 3.337 N/A VAL 345.A N GLN 534.A O no hydrogen 2.670 N/A LYS 346.A N ASN 376.A OD1 no hydrogen 2.807 N/A LYS 346.A NZ TYR 597.A O no hydrogen 3.173 N/A LYS 346.A NZ GLN 598.A O no hydrogen 3.412 N/A GLY 347.A N GLY 536.A O no hydrogen 3.068 N/A THR 348.A OG1 ASN 349.A O no hydrogen 2.780 N/A ASN 349.A N ILE 538.A O no hydrogen 2.865 N/A ASN 349.A ND2 CYS 510.A O no hydrogen 3.023 N/A ASN 349.A ND2 ILE 538.A O no hydrogen 3.335 N/A ARG 350.A N ARG 378.A O no hydrogen 3.049 N/A ARG 350.A NE ASP 367.A OD2 no hydrogen 2.889 N/A ARG 350.A NH2 ASP 367.A OD2 no hydrogen 3.140 N/A GLU 352.A N TYR 382.A OH no hydrogen 2.877 N/A HIS 353.A NE2 ASN 545.A O no hydrogen 2.949 N/A SER 354.A N GLY 357.A O no hydrogen 3.028 N/A SER 354.A OG THR 359.A O no hydrogen 2.553 N/A GLN 355.A NE2 ASN 545.A O no hydrogen 3.263 N/A LEU 356.A N SER 354.A OG no hydrogen 3.075 N/A GLY 357.A N SER 354.A O no hydrogen 2.984 N/A ARG 358.A N ASN 81.A OD1 no hydrogen 2.780 N/A ARG 358.A NE GLU 352.A O no hydrogen 3.393 N/A ARG 358.A NH2 TRP 200.A O no hydrogen 3.026 N/A THR 359.A OG1 GLU 206.A O no hydrogen 2.662 N/A LYS 362.A NZ GLU 37.A OE1 no hydrogen 2.828 N/A LEU 364.A N SER 361.A OG no hydrogen 3.212 N/A GLN 366.A N GLU 363.A O no hydrogen 3.032 N/A ASP 367.A N LEU 364.A O no hydrogen 2.899 N/A ARG 369.A N GLU 365.A O no hydrogen 2.970 N/A LEU 370.A N GLN 366.A O no hydrogen 2.956 N/A LYS 371.A NZ TYR 395.A O no hydrogen 3.125 N/A LYS 371.A NZ GLY 396.A O no hydrogen 2.765 N/A GLN 372.A N ARG 369.A O no hydrogen 2.923 N/A HIS 373.A N LEU 370.A O no hydrogen 2.939 N/A HIS 373.A ND1 LEU 370.A O no hydrogen 2.703 N/A ASN 374.A N LYS 371.A O no hydrogen 3.207 N/A ASN 374.A ND2 LYS 594.A O no hydrogen 3.056 N/A ASN 374.A ND2 VAL 692.A O no hydrogen 2.877 N/A ASN 376.A N LYS 346.A O no hydrogen 2.769 N/A ASN 376.A ND2 LEU 344.A O no hydrogen 3.407 N/A ARG 378.A N THR 348.A O no hydrogen 3.007 N/A ARG 378.A NE GLU 401.A OE2 no hydrogen 2.944 N/A ARG 378.A NH1 ASN 349.A OD1 no hydrogen 3.067 N/A ARG 378.A NH1 CYS 510.A O no hydrogen 3.423 N/A ARG 378.A NH1 GLU 511.A OE2 no hydrogen 2.977 N/A ARG 378.A NH2 GLU 401.A OE2 no hydrogen 2.733 N/A ARG 378.A NH2 ASN 447.A OD1 no hydrogen 2.947 N/A ASN 379.A N ILE 399.A O no hydrogen 2.991 N/A ASN 379.A ND2 ASP 400.A OD1 no hydrogen 2.810 N/A SER 380.A N ARG 378.A O no hydrogen 2.687 N/A HIS 381.A ND1 GLU 401.A OE1 no hydrogen 2.742 N/A TYR 382.A N ASN 379.A O no hydrogen 3.159 N/A THR 384.A N TYR 389.A OH no hydrogen 2.999 N/A THR 384.A OG1 HIS 385.A O no hydrogen 3.434 N/A HIS 385.A N GLU 352.A OE2 no hydrogen 2.901 N/A HIS 385.A NE2 ASP 208.A OD2 no hydrogen 2.682 N/A TYR 387.A N HIS 385.A ND1 no hydrogen 2.971 N/A TYR 387.A OH GLU 365.A OE2 no hydrogen 2.748 N/A TRP 388.A N HIS 385.A O no hydrogen 3.007 N/A TYR 389.A N PRO 386.A O no hydrogen 3.147 N/A TYR 389.A OH ASP 400.A OD1 no hydrogen 2.497 N/A TYR 389.A OH ASP 400.A OD2 no hydrogen 3.378 N/A GLN 390.A N PRO 386.A O no hydrogen 3.295 N/A LEU 391.A N TYR 387.A O no hydrogen 3.013 N/A CYS 392.A N TRP 388.A O no hydrogen 3.122 N/A CYS 392.A SG TRP 388.A O no hydrogen 3.413 N/A ASP 393.A N TYR 389.A O no hydrogen 3.003 N/A ARG 394.A N GLN 390.A O no hydrogen 3.097 N/A ARG 394.A NE TYR 395.A OH no hydrogen 2.825 N/A TYR 395.A N LEU 391.A O no hydrogen 2.842 N/A GLY 396.A N CYS 392.A O no hydrogen 2.968 N/A LEU 397.A N CYS 392.A O no hydrogen 3.190 N/A TYR 398.A N ASN 376.A O no hydrogen 2.897 N/A ASP 400.A N ILE 442.A O no hydrogen 3.083 N/A ALA 402.A N SER 444.A O no hydrogen 2.988 N/A ILE 404.A N ALA 402.A O no hydrogen 2.689 N/A GLU 405.A N LEU 195.A O no hydrogen 2.754 N/A SER 414.A N GLY 411.A O no hydrogen 2.976 N/A SER 414.A OG GLY 409.A O no hydrogen 3.446 N/A ALA 416.A N SER 414.A OG no hydrogen 3.272 N/A LYS 417.A N SER 414.A O no hydrogen 2.911 N/A LYS 417.A NZ ASN 451.A O no hydrogen 3.114 N/A THR 420.A N ASP 418.A OD1 no hydrogen 2.930 N/A THR 420.A OG1 ASP 418.A OD1 no hydrogen 2.683 N/A TRP 421.A N ASP 418.A O no hydrogen 2.941 N/A LEU 422.A N SER 419.A O no hydrogen 3.066 N/A HIS 425.A N TRP 421.A O no hydrogen 3.011 N/A HIS 425.A ND1 TRP 421.A O no hydrogen 2.802 N/A ARG 427.A N ALA 424.A O no hydrogen 3.255 N/A ARG 427.A NH1 GLU 196.A OE2 no hydrogen 3.092 N/A ARG 427.A NH1 ASN 403.A O no hydrogen 2.962 N/A ARG 427.A NH2 GLU 196.A OE2 no hydrogen 3.266 N/A THR 428.A N HIS 425.A O no hydrogen 3.122 N/A THR 428.A OG1 HIS 425.A O no hydrogen 2.784 N/A ARG 430.A N ASP 426.A O no hydrogen 3.018 N/A ARG 430.A NH1 ASN 160.A OD1 no hydrogen 3.148 N/A ARG 430.A NH1 GLN 161.A O no hydrogen 2.881 N/A ARG 430.A NH1 ASP 426.A OD2 no hydrogen 3.034 N/A ARG 430.A NH2 ASN 160.A OD1 no hydrogen 3.058 N/A ARG 430.A NH2 THR 165.A O no hydrogen 3.107 N/A GLU 432.A N HIS 429.A O no hydrogen 2.956 N/A ARG 433.A N ARG 430.A O no hydrogen 3.451 N/A ARG 433.A NH1 THR 384.A O no hydrogen 3.208 N/A ARG 433.A NH2 TYR 20.A OH no hydrogen 3.382 N/A ARG 433.A NH2 THR 384.A O no hydrogen 2.827 N/A SER 434.A N TYR 431.A O no hydrogen 3.222 N/A LYS 435.A NZ ASP 221.A OD1 no hydrogen 2.822 N/A LYS 435.A NZ ASP 221.A OD2 no hydrogen 3.314 N/A LYS 435.A NZ GLU 432.A O no hydrogen 3.283 N/A ASN 436.A ND2 TYR 222.A O no hydrogen 2.813 N/A HIS 437.A N SER 434.A O no hydrogen 3.110 N/A HIS 437.A ND1 ASP 393.A OD2 no hydrogen 2.611 N/A ALA 439.A N ASP 393.A OD1 no hydrogen 2.944 N/A ILE 440.A N HIS 437.A O no hydrogen 3.237 N/A TRP 443.A N PRO 470.A O no hydrogen 3.108 N/A TRP 443.A NE1 GLU 466.A OE1 no hydrogen 2.669 N/A SER 444.A N ASP 400.A O no hydrogen 2.791 N/A SER 444.A OG GLU 401.A OE2 no hydrogen 2.411 N/A SER 444.A OG GLY 446.A O no hydrogen 3.420 N/A GLN 445.A N GLN 472.A O no hydrogen 3.075 N/A GLN 445.A NE2 ASN 481.A O no hydrogen 3.607 N/A ASN 447.A N ILE 404.A O no hydrogen 2.861 N/A ASN 447.A ND2 GLU 405.A OE2 no hydrogen 3.126 N/A ALA 449.A N TYR 473.A OH no hydrogen 3.057 N/A ASN 454.A N ALA 416.A O no hydrogen 3.042 N/A GLU 456.A N GLY 452.A O no hydrogen 3.065 N/A ARG 457.A N ILE 453.A O no hydrogen 2.898 N/A THR 458.A N ASN 454.A O no hydrogen 3.024 N/A THR 458.A OG1 GLN 445.A OE1 no hydrogen 2.707 N/A THR 458.A OG1 ASN 454.A O no hydrogen 3.279 N/A THR 458.A OG1 PHE 455.A O no hydrogen 3.519 N/A TYR 459.A N PHE 455.A O no hydrogen 3.058 N/A TYR 459.A OH ASP 483.A OD1 no hydrogen 2.641 N/A ASP 460.A N GLU 456.A O no hydrogen 2.964 N/A TRP 461.A N ARG 457.A O no hydrogen 2.955 N/A LEU 462.A N THR 458.A O no hydrogen 3.111 N/A LYS 463.A N TYR 459.A O no hydrogen 2.945 N/A LYS 463.A NZ ASP 483.A OD2 no hydrogen 2.818 N/A SER 464.A N ASP 460.A O no hydrogen 3.047 N/A SER 464.A N TRP 461.A O no hydrogen 2.999 N/A SER 464.A OG TRP 461.A O no hydrogen 2.531 N/A VAL 465.A N TRP 461.A O no hydrogen 3.183 N/A VAL 465.A N LEU 462.A O no hydrogen 3.272 N/A GLU 466.A N LEU 462.A O no hydrogen 2.838 N/A LYS 467.A NZ LYS 463.A O no hydrogen 3.037 N/A LYS 467.A NZ SER 464.A O no hydrogen 3.536 N/A GLY 468.A N GLU 466.A OE2 no hydrogen 2.862 N/A ARG 469.A NE ILE 440.A O no hydrogen 2.728 N/A ARG 469.A NH1 LYS 435.A O no hydrogen 2.956 N/A ARG 469.A NH1 GLU 466.A OE1 no hydrogen 2.777 N/A ARG 469.A NH2 LYS 435.A O no hydrogen 2.833 N/A ARG 469.A NH2 HIS 437.A O no hydrogen 2.798 N/A VAL 471.A N ASP 483.A OD2 no hydrogen 2.820 N/A GLN 472.A N TRP 443.A O no hydrogen 2.915 N/A TYR 473.A N THR 482.A OG1 no hydrogen 3.098 N/A TYR 473.A OH GLY 450.A O no hydrogen 2.564 N/A ARG 475.A NE GLU 474.A OE1 no hydrogen 2.690 N/A ARG 475.A NH1 GLU 477.A OE2 no hydrogen 3.438 N/A ARG 475.A NH2 GLU 474.A OE1 no hydrogen 3.264 N/A ARG 475.A NH2 GLU 474.A OE2 no hydrogen 3.021 N/A ARG 475.A NH2 GLU 477.A OE2 no hydrogen 2.985 N/A ALA 476.A N TYR 473.A O no hydrogen 3.200 N/A GLU 477.A N GLU 474.A O no hydrogen 3.115 N/A ASN 479.A N ALA 476.A O no hydrogen 2.806 N/A TYR 480.A OH ASP 460.A OD1 no hydrogen 2.917 N/A ASN 481.A ND2 ASN 451.A OD1 no hydrogen 2.990 N/A THR 482.A N TYR 480.A O no hydrogen 2.810 N/A THR 482.A OG1 ILE 484.A O no hydrogen 2.764 N/A ASP 483.A N VAL 471.A O no hydrogen 2.696 N/A TYR 485.A N PRO 506.A O no hydrogen 2.971 N/A ARG 487.A NH1 GLU 474.A OE2 no hydrogen 3.197 N/A TYR 488.A N GLU 511.A O no hydrogen 2.749 N/A TYR 488.A OH GLU 511.A OE1 no hydrogen 2.724 N/A SER 490.A N GLU 493.A OE1 no hydrogen 2.777 N/A SER 490.A OG GLU 493.A OE1 no hydrogen 3.301 N/A GLU 493.A N SER 490.A OG no hydrogen 3.277 N/A ILE 494.A N SER 490.A O no hydrogen 3.041 N/A LYS 495.A N VAL 491.A O no hydrogen 3.020 N/A ALA 496.A N ASP 492.A O no hydrogen 2.910 N/A TYR 497.A N GLU 493.A O no hydrogen 3.096 N/A TYR 497.A OH ARG 505.A O no hydrogen 2.717 N/A VAL 498.A N ILE 494.A O no hydrogen 3.154 N/A GLY 499.A N LYS 495.A O no hydrogen 3.042 N/A LYS 500.A N TYR 497.A O no hydrogen 2.835 N/A ARG 505.A NH1 ASN 479.A O no hydrogen 2.883 N/A ARG 505.A NH1 THR 482.A O no hydrogen 2.971 N/A ARG 505.A NH2 LEU 478.A O no hydrogen 2.793 N/A ILE 508.A N TYR 485.A O no hydrogen 2.961 N/A LEU 509.A N GLY 535.A O no hydrogen 2.857 N/A CYS 510.A N CYS 486.A O no hydrogen 2.912 N/A TYR 512.A N CYS 537.A O no hydrogen 3.103 N/A TYR 512.A OH TYR 597.A OH no hydrogen 2.816 N/A HIS 514.A ND1 THR 950.A OG1 no hydrogen 2.687 N/A ASN 517.A ND2 TYR 855.A OH no hydrogen 3.075 N/A ASN 517.A ND2 SER 882.A O no hydrogen 2.905 N/A SER 518.A OG HIS 514.A O no hydrogen 2.725 N/A SER 518.A OG GLY 947.A O no hydrogen 3.144 N/A CYS 519.A SG LEU 513.A O no hydrogen 4.038 N/A GLY 520.A N GLY 947.A O no hydrogen 3.049 N/A GLY 521.A N ASP 857.A O no hydrogen 2.811 N/A TYR 524.A OH ARG 489.A O no hydrogen 2.672 N/A TRP 525.A NE1 TYR 512.A OH no hydrogen 2.912 N/A GLU 526.A N LYS 522.A O no hydrogen 3.076 N/A VAL 527.A N TYR 524.A O no hydrogen 3.214 N/A PHE 528.A N TYR 524.A O no hydrogen 3.152 N/A GLU 529.A N TRP 525.A O no hydrogen 2.963 N/A ASN 530.A N VAL 527.A O no hydrogen 3.067 N/A GLU 531.A N VAL 527.A O no hydrogen 2.778 N/A GLN 534.A N PHE 507.A O no hydrogen 3.035 N/A GLN 534.A NE2 PHE 336.A O no hydrogen 3.164 N/A GLY 536.A N VAL 345.A O no hydrogen 3.071 N/A CYS 537.A N LEU 509.A O no hydrogen 2.929 N/A ILE 538.A N GLY 347.A O no hydrogen 3.029 N/A TRP 539.A N TYR 512.A O no hydrogen 2.903 N/A TRP 541.A NE1 ASP 367.A OD1 no hydrogen 2.942 N/A ASP 543.A N VAL 580.A O no hydrogen 3.136 N/A GLN 544.A N CYS 575.A O no hydrogen 3.051 N/A GLN 544.A NE2 ASP 199.A O no hydrogen 3.592 N/A PHE 546.A N THR 558.A OG1 no hydrogen 3.334 N/A ARG 547.A N GLN 355.A OE1 no hydrogen 2.847 N/A GLU 548.A N TYR 556.A O no hydrogen 3.109 N/A ASP 550.A N LYS 554.A O no hydrogen 2.909 N/A ASP 552.A N ASP 550.A OD1 no hydrogen 2.819 N/A GLY 553.A N ASP 550.A O no hydrogen 2.812 N/A LYS 554.A N ASP 550.A OD1 no hydrogen 2.848 N/A LYS 554.A NZ ASN 928.A O no hydrogen 3.238 N/A LYS 554.A NZ LEU 930.A O no hydrogen 2.746 N/A TYR 556.A N GLU 548.A O no hydrogen 3.033 N/A THR 558.A N PHE 546.A O no hydrogen 2.805 N/A THR 558.A OG1 PHE 546.A O no hydrogen 2.834 N/A THR 558.A OG1 TYR 563.A OH no hydrogen 2.695 N/A TYR 559.A N ASP 562.A OD2 no hydrogen 2.668 N/A TYR 559.A OH HIS 925.A O no hydrogen 2.599 N/A GLY 560.A N GLY 572.A O no hydrogen 2.793 N/A ASP 562.A N TYR 559.A O no hydrogen 3.115 N/A TYR 563.A OH GLU 548.A OE2 no hydrogen 2.607 N/A TYR 563.A OH THR 558.A OG1 no hydrogen 2.695 N/A ILE 568.A N PRO 565.A O no hydrogen 3.269 N/A PHE 571.A N TYR 92.A O no hydrogen 3.025 N/A GLY 572.A N SER 570.A OG no hydrogen 3.055 N/A ASN 573.A ND2 THR 879.A OG1 no hydrogen 2.825 N/A CYS 575.A SG GLN 544.A O no hydrogen 3.310 N/A CYS 575.A SG ASN 545.A OD1 no hydrogen 3.997 N/A CYS 575.A SG GLY 572.A O no hydrogen 3.970 N/A GLY 576.A N ASN 573.A O no hydrogen 3.432 N/A ASN 577.A ND2 PHE 574.A O no hydrogen 3.062 N/A GLY 578.A N ASP 543.A OD1 no hydrogen 2.752 N/A LEU 579.A N TRP 541.A O no hydrogen 2.759 N/A VAL 580.A N TRP 541.A O no hydrogen 3.029 N/A ASN 581.A N GLU 585.A O no hydrogen 2.821 N/A ASN 581.A ND2 GLU 585.A OE1 no hydrogen 2.883 N/A ARG 584.A N ASN 581.A O no hydrogen 2.831 N/A ARG 584.A NE ASP 367.A OD1 no hydrogen 2.678 N/A ARG 584.A NH1 HIS 353.A O no hydrogen 2.784 N/A ARG 584.A NH1 ALA 582.A O no hydrogen 2.867 N/A ARG 584.A NH2 HIS 353.A O no hydrogen 3.009 N/A ARG 584.A NH2 ASP 367.A OD1 no hydrogen 3.545 N/A ARG 584.A NH2 ASP 367.A OD2 no hydrogen 3.002 N/A GLU 585.A N ASN 581.A OD1 no hydrogen 2.673 N/A HIS 587.A N LEU 579.A O no hydrogen 3.001 N/A HIS 587.A ND1 HIS 875.A NE2 no hydrogen 2.699 N/A HIS 587.A NE2 ASP 543.A OD2 no hydrogen 2.593 N/A HIS 589.A NE2 GLY 578.A O no hydrogen 3.072 N/A LEU 590.A N HIS 587.A O no hydrogen 3.044 N/A LEU 591.A N PRO 588.A O no hydrogen 3.027 N/A GLU 592.A N HIS 589.A O no hydrogen 3.003 N/A VAL 593.A N HIS 589.A O no hydrogen 3.129 N/A LYS 594.A N LEU 590.A O no hydrogen 2.915 N/A LYS 594.A NZ GLU 691.A O no hydrogen 2.772 N/A LYS 595.A N LEU 591.A O no hydrogen 3.267 N/A LYS 595.A NZ GLN 860.A O no hydrogen 2.757 N/A ILE 596.A N GLU 592.A O no hydrogen 2.938 N/A TYR 597.A N VAL 593.A O no hydrogen 2.814 N/A TYR 597.A OH GLY 347.A O no hydrogen 2.914 N/A TYR 597.A OH TYR 512.A OH no hydrogen 2.816 N/A GLN 598.A N LYS 595.A O no hydrogen 3.401 N/A GLN 598.A NE2 TYR 694.A O no hydrogen 2.947 N/A ASN 599.A ND2 TRP 617.A O no hydrogen 3.475 N/A LYS 601.A N LYS 615.A O no hydrogen 3.184 N/A LYS 601.A NZ GLU 529.A OE2 no hydrogen 2.706 N/A LYS 601.A NZ ILE 596.A O no hydrogen 2.707 N/A ALA 602.A N ASP 695.A OD2 no hydrogen 3.016 N/A THR 603.A N CYS 613.A O no hydrogen 3.321 N/A SER 605.A N LYS 611.A O no hydrogen 2.749 N/A ASP 606.A N LYS 611.A O no hydrogen 3.034 N/A ARG 607.A NH2 VAL 698.A O no hydrogen 2.732 N/A LYS 608.A N ASP 606.A OD2 no hydrogen 3.254 N/A LYS 608.A NZ ASP 606.A OD1 no hydrogen 3.144 N/A LYS 608.A NZ ASP 606.A OD2 no hydrogen 3.099 N/A ASN 609.A ND2 ASP 606.A OD1 no hydrogen 3.275 N/A LYS 611.A N ASP 606.A O no hydrogen 2.940 N/A VAL 612.A N VAL 657.A O no hydrogen 3.092 N/A CYS 613.A N THR 603.A O no hydrogen 2.939 N/A CYS 613.A SG ASP 656.A OD1 no hydrogen 3.618 N/A ILE 614.A N VAL 655.A O no hydrogen 2.765 N/A LYS 615.A N LYS 601.A O no hydrogen 2.823 N/A LYS 615.A NZ HIS 652.A O no hydrogen 3.191 N/A ASN 616.A N ALA 653.A O no hydrogen 2.925 N/A ASN 616.A ND2 SER 621.A O no hydrogen 2.793 N/A ASN 616.A ND2 CYS 649.A O no hydrogen 3.290 N/A TRP 617.A N ASN 599.A O no hydrogen 2.630 N/A TYR 618.A N ASN 616.A OD1 no hydrogen 2.939 N/A ASP 619.A N GLU 298.A OE2 no hydrogen 2.805 N/A PHE 620.A N GLU 298.A OE1 no hydrogen 2.909 N/A SER 621.A OG GLU 298.A OE1 no hydrogen 2.629 N/A SER 621.A OG HIS 299.A NE2 no hydrogen 2.902 N/A ASN 622.A N GLU 625.A OE2 no hydrogen 3.403 N/A LEU 623.A N CYS 649.A O no hydrogen 3.158 N/A ASN 624.A N ASN 622.A OD1 no hydrogen 3.042 N/A ASN 624.A ND2 ASP 648.A OD1 no hydrogen 3.105 N/A GLU 625.A N ASN 622.A O no hydrogen 3.104 N/A TYR 626.A N LEU 623.A O no hydrogen 2.790 N/A ILE 627.A N SER 678.A O no hydrogen 2.767 N/A LEU 628.A N LYS 645.A O no hydrogen 2.925 N/A ARG 629.A N SER 676.A O no hydrogen 2.792 N/A TRP 630.A N GLY 643.A O no hydrogen 2.985 N/A ASN 631.A N ASN 674.A O no hydrogen 3.090 N/A VAL 632.A N ALA 641.A O no hydrogen 2.754 N/A LYS 633.A N TYR 672.A O no hydrogen 3.142 N/A GLY 634.A N THR 638.A O no hydrogen 3.075 N/A GLY 637.A N GLY 634.A O no hydrogen 2.791 N/A THR 638.A N ASP 636.A OD2 no hydrogen 3.359 N/A THR 638.A OG1 ASP 636.A OD1 no hydrogen 3.336 N/A THR 638.A OG1 ASP 636.A OD2 no hydrogen 2.925 N/A LEU 640.A N VAL 632.A O no hydrogen 2.668 N/A GLY 643.A N TRP 630.A O no hydrogen 2.998 N/A LYS 645.A N LEU 628.A O no hydrogen 2.833 N/A CYS 649.A N ASN 622.A OD1 no hydrogen 2.688 N/A CYS 649.A SG GLU 650.A O no hydrogen 3.703 N/A CYS 649.A SG ALA 653.A O no hydrogen 3.102 N/A HIS 652.A N ASN 616.A O no hydrogen 2.777 N/A HIS 652.A NE2 ASP 619.A OD1 no hydrogen 2.734 N/A ALA 653.A N GLU 650.A O no hydrogen 2.892 N/A VAL 655.A N ILE 614.A O no hydrogen 2.762 N/A VAL 657.A N VAL 612.A O no hydrogen 3.000 N/A LEU 659.A N LEU 610.A O no hydrogen 2.712 N/A GLY 660.A N ASN 609.A O no hydrogen 2.663 N/A ARG 669.A N GLU 635.A OE2 no hydrogen 2.941 N/A ARG 669.A NE GLU 635.A OE1 no hydrogen 3.405 N/A ARG 669.A NE GLU 635.A OE2 no hydrogen 3.006 N/A ARG 669.A NH2 GLU 635.A OE1 no hydrogen 3.015 N/A ALA 671.A N LEU 699.A O no hydrogen 2.826 N/A TYR 672.A N LYS 633.A O no hydrogen 2.815 N/A TYR 672.A OH GLU 670.A OE2 no hydrogen 2.463 N/A LEU 673.A N PHE 697.A O no hydrogen 2.765 N/A ASN 674.A N ASN 631.A O no hydrogen 2.830 N/A LEU 675.A N ASP 695.A O no hydrogen 2.948 N/A SER 676.A N ARG 629.A O no hydrogen 3.263 N/A SER 676.A OG GLU 691.A OE2 no hydrogen 2.698 N/A TRP 677.A N ALA 693.A O no hydrogen 2.870 N/A SER 678.A N ILE 627.A O no hydrogen 3.194 N/A ARG 679.A NE GLU 681.A O no hydrogen 2.992 N/A ARG 679.A NH2 TYR 626.A OH no hydrogen 3.077 N/A LYS 680.A N GLU 625.A O no hydrogen 3.142 N/A THR 683.A N VAL 686.A O no hydrogen 2.957 N/A ASP 689.A N ASP 687.A OD1 no hydrogen 2.752 N/A TRP 690.A N ASP 687.A O no hydrogen 3.426 N/A TRP 690.A N ASP 687.A OD1 no hydrogen 3.144 N/A TRP 690.A NE1 GLN 372.A O no hydrogen 2.852 N/A VAL 692.A N TRP 677.A O no hydrogen 2.899 N/A TYR 694.A N GLN 598.A OE1 no hydrogen 2.820 N/A ASP 695.A N LEU 675.A O no hydrogen 2.901 N/A GLN 696.A NE2 ILE 864.A O no hydrogen 2.930 N/A PHE 697.A N LEU 673.A O no hydrogen 2.998 N/A LEU 699.A N ALA 671.A O no hydrogen 2.760 N/A GLY 701.A N ARG 669.A O no hydrogen 2.923 N/A ASN 702.A N VAL 668.A O no hydrogen 2.868 N/A ASN 702.A ND2 ASN 666.A O no hydrogen 2.970 N/A ASN 704.A N ASN 702.A OD1 no hydrogen 2.952 N/A THR 705.A N ASN 702.A O no hydrogen 3.292 N/A ALA 707.A N THR 705.A OG1 no hydrogen 3.326 N/A TYR 708.A OH GLU 904.A OE1 no hydrogen 2.628 N/A TYR 708.A OH GLU 904.A OE2 no hydrogen 3.135 N/A ARG 709.A N THR 706.A O no hydrogen 3.236 N/A ARG 709.A NE TYR 708.A OH no hydrogen 3.239 N/A LYS 712.A NZ GLU 715.A OE2 no hydrogen 3.469 N/A GLU 715.A N ASP 733.A OD1 no hydrogen 2.921 N/A THR 716.A OG1 GLY 812.A O no hydrogen 2.839 N/A ALA 717.A N THR 731.A O no hydrogen 3.069 N/A VAL 719.A N SER 729.A O no hydrogen 2.922 N/A ASP 721.A N ALA 726.A O no hydrogen 2.963 N/A ASN 723.A N ASP 721.A OD2 no hydrogen 3.075 N/A THR 724.A N ASP 721.A OD2 no hydrogen 2.820 N/A THR 724.A OG1 ASP 721.A OD2 no hydrogen 2.983 N/A GLY 725.A N ASP 721.A O no hydrogen 2.779 N/A ALA 726.A N THR 724.A OG1 no hydrogen 3.360 N/A LEU 727.A N ILE 742.A O no hydrogen 3.302 N/A SER 728.A N VAL 719.A O no hydrogen 3.116 N/A SER 728.A OG VAL 719.A O no hydrogen 3.345 N/A SER 729.A N VAL 719.A O no hydrogen 3.282 N/A SER 729.A OG GLU 736.A OE1 no hydrogen 2.496 N/A SER 729.A OG GLU 736.A OE2 no hydrogen 3.410 N/A LEU 730.A N GLU 736.A OE2 no hydrogen 2.983 N/A THR 731.A N ALA 717.A O no hydrogen 2.802 N/A THR 731.A OG1 ALA 717.A O no hydrogen 3.526 N/A LEU 732.A N LYS 735.A O no hydrogen 3.025 N/A ASP 733.A N GLU 715.A O no hydrogen 2.693 N/A LYS 735.A N LEU 732.A O no hydrogen 3.288 N/A LEU 737.A N LEU 730.A O no hydrogen 2.930 N/A LEU 738.A N GLU 736.A OE2 no hydrogen 3.246 N/A ALA 739.A N ARG 837.A O no hydrogen 2.808 N/A ILE 742.A N LEU 727.A O no hydrogen 2.819 N/A THR 743.A N THR 835.A O no hydrogen 2.884 N/A THR 743.A OG1 THR 835.A O no hydrogen 3.527 N/A SER 745.A N GLY 833.A O no hydrogen 2.880 N/A ARG 748.A NE ASP 754.A OD2 no hydrogen 2.817 N/A ARG 748.A NH1 ALA 944.A O no hydrogen 3.021 N/A ARG 748.A NH2 ASP 754.A OD1 no hydrogen 2.898 N/A ARG 748.A NH2 ASP 754.A OD2 no hydrogen 3.328 N/A ARG 748.A NH2 GLY 945.A O no hydrogen 2.919 N/A ALA 750.A N GLU 922.A OE1 no hydrogen 2.896 N/A THR 751.A N ASP 754.A OD2 no hydrogen 2.975 N/A ASN 753.A ND2 SER 518.A OG no hydrogen 2.643 N/A ASN 753.A ND2 VAL 946.A O no hydrogen 3.101 N/A ASP 754.A N THR 751.A OG1 no hydrogen 2.951 N/A ASN 755.A N THR 751.A O no hydrogen 3.276 N/A ASN 755.A N ASP 752.A O no hydrogen 3.256 N/A ARG 756.A N ASN 753.A O no hydrogen 2.955 N/A ASP 757.A N ASN 753.A O no hydrogen 2.724 N/A ASN 759.A N ASP 757.A OD1 no hydrogen 2.700 N/A GLY 760.A N ASP 757.A O no hydrogen 2.799 N/A ALA 761.A N ASP 754.A O no hydrogen 2.836 N/A LEU 763.A N GLY 760.A O no hydrogen 3.109 N/A TRP 764.A N GLY 760.A O no hydrogen 3.285 N/A TRP 764.A NE1 SER 829.A OG no hydrogen 2.999 N/A ARG 765.A N ALA 761.A O no hydrogen 2.801 N/A LYS 766.A N ARG 762.A O no hydrogen 3.126 N/A ALA 767.A N LEU 763.A O no hydrogen 3.094 N/A GLY 768.A N ARG 765.A O no hydrogen 3.119 N/A LEU 769.A N TRP 764.A O no hydrogen 2.862 N/A ASN 771.A N GLY 768.A O no hydrogen 3.051 N/A THR 773.A N LEU 793.A O no hydrogen 2.716 N/A THR 773.A OG1 LEU 793.A O no hydrogen 2.963 N/A LYS 775.A N GLU 791.A O no hydrogen 2.870 N/A VAL 776.A N ASN 723.A O no hydrogen 3.136 N/A VAL 777.A N ARG 789.A O no hydrogen 2.856 N/A SER 778.A N ARG 789.A O no hydrogen 3.133 N/A LYS 780.A N THR 787.A O no hydrogen 2.806 N/A LYS 780.A NZ LYS 780.A O no hydrogen 3.023 N/A ALA 786.A N TYR 806.A O no hydrogen 2.760 N/A THR 787.A N LYS 780.A O no hydrogen 2.772 N/A VAL 788.A N PHE 804.A O no hydrogen 2.867 N/A ARG 789.A N SER 778.A O no hydrogen 2.844 N/A ALA 790.A N ALA 802.A O no hydrogen 2.935 N/A GLU 791.A N LYS 775.A O no hydrogen 2.676 N/A ILE 792.A N GLY 801.A O no hydrogen 2.967 N/A LEU 793.A N THR 773.A O no hydrogen 2.741 N/A ASN 794.A N GLN 798.A O no hydrogen 3.320 N/A ASN 794.A ND2 ALA 767.A O no hydrogen 3.101 N/A LYS 796.A N ASN 794.A OD1 no hydrogen 2.732 N/A GLY 797.A N ASN 794.A O no hydrogen 3.058 N/A VAL 800.A N ILE 792.A O no hydrogen 2.748 N/A GLY 801.A N ILE 792.A O no hydrogen 3.284 N/A ASP 803.A N THR 819.A O no hydrogen 2.902 N/A PHE 804.A N VAL 788.A O no hydrogen 2.825 N/A VAL 805.A N ARG 817.A O no hydrogen 2.954 N/A TYR 806.A N ALA 786.A O no hydrogen 2.884 N/A TYR 806.A OH GLY 725.A O no hydrogen 2.943 N/A ALA 807.A N LYS 815.A O no hydrogen 2.974 N/A LEU 808.A N THR 784.A O no hydrogen 2.746 N/A ASP 809.A N ALA 813.A O no hydrogen 2.707 N/A ASN 811.A N ASP 809.A OD2 no hydrogen 2.901 N/A ASN 811.A ND2 ASP 809.A OD2 no hydrogen 3.419 N/A GLY 812.A N ASP 809.A O no hydrogen 2.925 N/A LEU 814.A N LEU 972.A O no hydrogen 2.832 N/A LYS 815.A N ALA 807.A O no hydrogen 2.840 N/A VAL 816.A N PHE 970.A O no hydrogen 2.917 N/A ARG 817.A N VAL 805.A O no hydrogen 3.114 N/A ARG 817.A NH1 GLU 969.A OE2 no hydrogen 3.085 N/A THR 818.A N PHE 968.A O no hydrogen 2.824 N/A THR 819.A N ASP 803.A O no hydrogen 2.915 N/A THR 819.A OG1 SER 967.A OG no hydrogen 3.032 N/A PHE 820.A N GLN 966.A O no hydrogen 2.932 N/A ASP 823.A N VAL 800.A O no hydrogen 2.978 N/A ALA 825.A N ASP 823.A OD1 no hydrogen 2.936 N/A ILE 826.A N ASP 823.A O no hydrogen 2.873 N/A VAL 827.A N ASP 823.A O no hydrogen 2.865 N/A LYS 828.A NZ THR 824.A O no hydrogen 2.955 N/A SER 829.A OG ASN 759.A O no hydrogen 2.829 N/A ALA 830.A N LEU 746.A O no hydrogen 2.956 N/A ARG 831.A N LEU 746.A O no hydrogen 3.331 N/A ARG 831.A NE PHE 747.A O no hydrogen 2.934 N/A ARG 831.A NH1 ASP 940.A OD1 no hydrogen 2.987 N/A LEU 832.A N GLU 942.A O no hydrogen 2.851 N/A GLY 833.A N SER 745.A O no hydrogen 3.323 N/A LEU 834.A N LEU 939.A O no hydrogen 2.871 N/A THR 835.A N THR 743.A O no hydrogen 2.908 N/A THR 835.A OG1 ILE 937.A O no hydrogen 2.680 N/A PHE 836.A N ILE 937.A O no hydrogen 3.147 N/A ARG 837.A NH1 ASP 933.A OD2 no hydrogen 2.838 N/A ARG 837.A NH2 ASP 933.A OD2 no hydrogen 3.076 N/A ASP 839.A N GLY 934.A O no hydrogen 2.787 N/A TYR 841.A N ALA 838.A O no hydrogen 3.216 N/A GLN 843.A N THR 895.A O no hydrogen 2.932 N/A VAL 844.A N THR 869.A O no hydrogen 2.786 N/A SER 845.A N LYS 893.A O no hydrogen 2.909 N/A SER 845.A OG TYR 867.A O no hydrogen 3.525 N/A SER 845.A OG ASP 868.A OD1 no hydrogen 2.981 N/A TYR 846.A N TYR 867.A O no hydrogen 2.912 N/A TYR 846.A OH GLY 850.A O no hydrogen 2.502 N/A LEU 847.A N TRP 891.A O no hydrogen 2.915 N/A GLY 848.A N GLY 865.A O no hydrogen 3.189 N/A ARG 849.A N THR 887.A O no hydrogen 2.977 N/A ARG 849.A NE ASP 888.A OD2 no hydrogen 2.908 N/A ARG 849.A NH1 SER 861.A O no hydrogen 3.184 N/A ARG 849.A NH2 ASP 888.A OD2 no hydrogen 3.190 N/A GLY 850.A N ARG 863.A O no hydrogen 2.511 N/A HIS 852.A NE2 SER 861.A OG no hydrogen 2.687 N/A THR 854.A N ASN 885.A O no hydrogen 3.222 N/A THR 854.A OG1 THR 887.A OG1 no hydrogen 2.985 N/A TYR 855.A N ARG 858.A O no hydrogen 3.259 N/A ARG 858.A N TYR 855.A O no hydrogen 2.922 N/A ARG 858.A NH1 ASN 517.A OD1 no hydrogen 2.953 N/A ARG 858.A NH1 SER 518.A O no hydrogen 2.729 N/A ARG 858.A NH2 GLU 853.A O no hydrogen 3.339 N/A ARG 858.A NH2 GLU 853.A OE1 no hydrogen 3.000 N/A ASN 859.A ND2 THR 887.A OG1 no hydrogen 3.169 N/A GLN 860.A N GLU 592.A OE2 no hydrogen 2.950 N/A SER 861.A N GLU 592.A OE1 no hydrogen 3.010 N/A SER 861.A OG GLU 592.A OE1 no hydrogen 2.929 N/A SER 861.A OG HIS 852.A NE2 no hydrogen 2.687 N/A GLY 862.A N TYR 694.A OH no hydrogen 3.087 N/A ARG 863.A NH1 GLU 691.A OE1 no hydrogen 3.191 N/A ARG 863.A NH1 GLU 691.A OE2 no hydrogen 2.649 N/A ARG 863.A NH2 GLU 691.A OE1 no hydrogen 2.656 N/A ILE 864.A N GLN 696.A OE1 no hydrogen 2.959 N/A GLY 865.A N GLY 848.A O no hydrogen 3.090 N/A TYR 867.A N TYR 846.A O no hydrogen 2.875 N/A TYR 867.A OH ARG 863.A O no hydrogen 2.692 N/A THR 869.A N VAL 844.A O no hydrogen 2.804 N/A THR 870.A N THR 869.A OG1 no hydrogen 2.703 N/A VAL 871.A N ASN 842.A O no hydrogen 3.175 N/A ARG 873.A N THR 870.A OG1 no hydrogen 3.327 N/A HIS 875.A N THR 883.A OG1 no hydrogen 3.210 N/A HIS 875.A NE2 HIS 587.A ND1 no hydrogen 2.699 N/A TYR 877.A N HIS 875.A O no hydrogen 3.135 N/A TYR 877.A OH GLU 853.A OE1 no hydrogen 2.538 N/A SER 882.A N PRO 749.A O no hydrogen 3.104 N/A SER 882.A OG PRO 749.A O no hydrogen 2.659 N/A THR 883.A OG1 GLU 853.A OE2 no hydrogen 2.580 N/A ALA 884.A N GLU 853.A OE2 no hydrogen 2.907 N/A ASN 885.A ND2 PHE 911.A O no hydrogen 3.218 N/A ARG 886.A N PHE 911.A O no hydrogen 3.000 N/A ARG 886.A NE TYR 846.A OH no hydrogen 2.777 N/A ARG 886.A NH1 ASN 885.A O no hydrogen 2.957 N/A THR 887.A OG1 THR 854.A OG1 no hydrogen 2.985 N/A VAL 889.A N PHE 909.A O no hydrogen 2.839 N/A ARG 890.A N LEU 847.A O no hydrogen 2.722 N/A ARG 890.A NE GLU 670.A OE2 no hydrogen 2.768 N/A ARG 890.A NH2 GLU 670.A OE1 no hydrogen 3.241 N/A ARG 890.A NH2 GLU 670.A OE2 no hydrogen 3.316 N/A TRP 891.A N LEU 847.A O no hydrogen 3.473 N/A LYS 893.A N SER 845.A O no hydrogen 2.774 N/A LYS 893.A NZ GLU 977.A OE2 no hydrogen 2.825 N/A LEU 894.A N VAL 902.A O no hydrogen 3.126 N/A THR 895.A N GLN 843.A O no hydrogen 2.915 N/A ASP 896.A N GLU 900.A O no hydrogen 2.793 N/A GLY 899.A N ASP 896.A O no hydrogen 2.884 N/A GLU 900.A N ASP 896.A OD1 no hydrogen 3.029 N/A GLY 901.A N VAL 975.A O no hydrogen 3.119 N/A VAL 902.A N LEU 894.A O no hydrogen 2.930 N/A PHE 903.A N TYR 973.A O no hydrogen 2.746 N/A SER 905.A OG ASN 906.A OD1 no hydrogen 3.181 N/A SER 905.A OG GLU 969.A O no hydrogen 2.698 N/A ASN 906.A N SER 905.A OG no hydrogen 2.657 N/A ARG 907.A NH2 ALA 941.A O no hydrogen 3.007 N/A ARG 907.A NH2 GLU 942.A OE2 no hydrogen 2.732 N/A PHE 909.A N VAL 889.A O no hydrogen 2.868 N/A GLN 910.A N ASP 940.A O no hydrogen 2.997 N/A GLN 910.A NE2 GLN 943.A O no hydrogen 3.477 N/A PHE 911.A N ARG 886.A O no hydrogen 3.200 N/A SER 912.A N HIS 938.A O no hydrogen 3.264 N/A ILE 914.A N THR 936.A O no hydrogen 3.225 N/A LEU 920.A N SER 917.A OG no hydrogen 3.172 N/A LEU 921.A N SER 917.A O no hydrogen 2.936 N/A GLU 922.A N ASP 918.A O no hydrogen 2.955 N/A LYS 923.A N VAL 919.A O no hydrogen 3.062 N/A ALA 924.A N LEU 920.A O no hydrogen 2.900 N/A HIS 925.A N GLU 929.A OE1 no hydrogen 2.784 N/A HIS 926.A N GLU 929.A OE1 no hydrogen 3.019 N/A HIS 926.A NE2 ASP 562.A OD2 no hydrogen 2.852 N/A ASN 928.A ND2 ASP 550.A OD2 no hydrogen 3.101 N/A GLU 929.A N HIS 926.A O no hydrogen 3.014 N/A LEU 930.A N ILE 927.A O no hydrogen 3.047 N/A ARG 932.A NE GLU 872.A OE2 no hydrogen 2.886 N/A ARG 932.A NH2 GLU 872.A OE1 no hydrogen 3.018 N/A THR 936.A N ILE 914.A O no hydrogen 2.896 N/A THR 936.A OG1 PHE 916.A O no hydrogen 2.664 N/A ILE 937.A N PHE 836.A O no hydrogen 2.845 N/A HIS 938.A N SER 912.A O no hydrogen 3.118 N/A LEU 939.A N LEU 834.A O no hydrogen 2.859 N/A ASP 940.A N GLN 910.A O no hydrogen 2.845 N/A ALA 941.A N LEU 832.A O no hydrogen 2.902 N/A GLU 942.A N LEU 832.A O no hydrogen 3.202 N/A ALA 944.A N ALA 830.A O no hydrogen 3.003 N/A GLY 945.A N TYR 959.A O no hydrogen 3.157 N/A VAL 946.A N ASP 857.A OD1 no hydrogen 2.853 N/A GLY 947.A N ASP 857.A OD2 no hydrogen 2.759 N/A THR 948.A N PRO 953.A O no hydrogen 2.991 N/A THR 948.A OG1 PRO 953.A O no hydrogen 2.835 N/A THR 950.A N ASN 753.A OD1 no hydrogen 3.075 N/A THR 950.A OG1 HIS 514.A ND1 no hydrogen 2.687 N/A THR 950.A OG1 ASN 753.A OD1 no hydrogen 2.842 N/A CYS 951.A N THR 948.A O no hydrogen 3.252 N/A VAL 955.A N ASP 757.A OD2 no hydrogen 2.812 N/A TYR 959.A N LEU 956.A O no hydrogen 2.857 N/A TYR 959.A OH GLU 523.A OE2 no hydrogen 2.820 N/A LEU 960.A N PRO 957.A O no hydrogen 3.045 N/A GLN 966.A N PHE 820.A O no hydrogen 3.031 N/A SER 967.A OG THR 819.A OG1 no hydrogen 3.032 N/A PHE 968.A N THR 818.A O no hydrogen 2.919 N/A PHE 970.A N VAL 816.A O no hydrogen 3.184 N/A THR 971.A N GLU 904.A O no hydrogen 2.843 N/A LEU 972.A N LEU 814.A O no hydrogen 2.895 N/A TYR 973.A N PHE 903.A O no hydrogen 2.730 N/A TYR 973.A OH GLU 904.A OE2 no hydrogen 2.954 N/A VAL 975.A N GLY 901.A O no hydrogen 3.255 N/A GLU 977.A N GLY 899.A O no hydrogen 2.883 N/A HIS 980.A NE2 GLU 977.A O no hydrogen 2.966 N/A HIS 982.A ND1 HIS 983.A O no hydrogen 3.255 N/A