Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7rpk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 7.A OH VAL 472.A O no hydrogen 2.639 N/A ALA 9.A N SER 6.A OG no hydrogen 3.239 N/A LEU 10.A N SER 6.A O no hydrogen 2.899 N/A LEU 11.A N TYR 7.A O no hydrogen 3.068 N/A ALA 12.A N ALA 8.A O no hydrogen 3.051 N/A ASP 13.A N ALA 9.A O no hydrogen 2.799 N/A TRP 14.A N LEU 10.A O no hydrogen 2.866 N/A VAL 17.A N TRP 14.A O no hydrogen 3.142 N/A VAL 18.A N TRP 14.A O no hydrogen 3.440 N/A LEU 19.A N PRO 15.A O no hydrogen 3.013 N/A GLY 20.A N VAL 16.A O no hydrogen 2.875 N/A MET 21.A N VAL 17.A O no hydrogen 2.878 N/A CYS 22.A N VAL 18.A O no hydrogen 2.967 N/A CYS 22.A SG VAL 18.A O no hydrogen 3.184 N/A THR 23.A N LEU 19.A O no hydrogen 2.885 N/A THR 23.A OG1 LEU 19.A O no hydrogen 2.667 N/A LEU 24.A N GLY 20.A O no hydrogen 2.894 N/A LEU 25.A N MET 21.A O no hydrogen 3.072 N/A ILE 26.A N CYS 22.A O no hydrogen 2.909 N/A VAL 27.A N THR 23.A O no hydrogen 2.956 N/A VAL 28.A N LEU 24.A O no hydrogen 2.991 N/A CYS 29.A N LEU 25.A O no hydrogen 2.969 N/A CYS 29.A SG LEU 25.A O no hydrogen 3.162 N/A ALA 30.A N ILE 26.A O no hydrogen 2.941 N/A LEU 31.A N VAL 27.A O no hydrogen 2.888 N/A VAL 32.A N VAL 28.A O no hydrogen 3.041 N/A GLY 33.A N CYS 29.A O no hydrogen 2.915 N/A VAL 34.A N ALA 30.A O no hydrogen 3.142 N/A LEU 35.A N LEU 31.A O no hydrogen 2.974 N/A VAL 36.A N VAL 32.A O no hydrogen 2.956 N/A PHE 42.A N GLN 320.A OE1 no hydrogen 2.943 N/A SER 43.A N ASP 41.A OD1 no hydrogen 2.864 N/A SER 43.A OG ASP 41.A OD1 no hydrogen 2.554 N/A SER 43.A OG ASP 41.A OD2 no hydrogen 3.250 N/A LEU 46.A N ASP 44.A OD1 no hydrogen 2.856 N/A PHE 49.A N LEU 46.A O no hydrogen 3.184 N/A ARG 52.A N ASN 449.A O no hydrogen 2.976 N/A ARG 52.A NE ASP 605.A OD2 no hydrogen 2.764 N/A ARG 52.A NH1 GLU 50.A OE2 no hydrogen 2.769 N/A ARG 52.A NH1 ASN 611.A O no hydrogen 3.169 N/A ARG 52.A NH2 ASP 605.A OD2 no hydrogen 2.963 N/A ARG 52.A NH2 SER 614.A O no hydrogen 2.715 N/A THR 54.A OG1 ASP 783.A OD1 no hydrogen 3.536 N/A THR 54.A OG1 ASP 783.A OD2 no hydrogen 2.718 N/A GLY 57.A N THR 54.A OG1 no hydrogen 3.051 N/A GLN 58.A N THR 54.A O no hydrogen 2.947 N/A ARG 59.A N THR 55.A O no hydrogen 3.311 N/A ARG 59.A NH1 ASP 756.A OD1 no hydrogen 2.849 N/A ARG 59.A NH1 PHE 775.A O no hydrogen 3.020 N/A ARG 59.A NH2 ASP 756.A OD1 no hydrogen 3.346 N/A LEU 60.A N ILE 56.A O no hydrogen 2.892 N/A VAL 61.A N GLY 57.A O no hydrogen 2.855 N/A THR 62.A N GLN 58.A O no hydrogen 2.977 N/A THR 62.A OG1 GLN 58.A O no hydrogen 2.701 N/A THR 62.A OG1 GLU 604.A O no hydrogen 3.211 N/A TRP 63.A N ARG 59.A O no hydrogen 3.007 N/A ASN 64.A N LEU 60.A O no hydrogen 3.029 N/A ASN 64.A ND2 LEU 60.A O no hydrogen 2.850 N/A ASN 65.A N VAL 61.A O no hydrogen 2.898 N/A ASN 65.A ND2 LYS 615.A O no hydrogen 3.047 N/A MET 66.A N THR 62.A O no hydrogen 2.938 N/A MET 67.A N TRP 63.A O no hydrogen 3.068 N/A ARG 68.A N ASN 64.A O no hydrogen 2.969 N/A ARG 68.A NE ASN 65.A OD1 no hydrogen 3.453 N/A ARG 68.A NH1 ASN 65.A OD1 no hydrogen 2.808 N/A ASN 69.A N ASN 65.A O no hydrogen 3.252 N/A ASN 69.A N MET 66.A O no hydrogen 3.184 N/A ASN 69.A ND2 ASN 65.A O no hydrogen 2.829 N/A THR 70.A OG1 MET 66.A O no hydrogen 2.727 N/A GLY 71.A N LEU 76.A O no hydrogen 2.963 N/A TYR 72.A OH GLU 85.A OE2 no hydrogen 2.632 N/A LYS 73.A NZ GLU 85.A OE1 no hydrogen 2.887 N/A LYS 73.A NZ GLU 85.A OE2 no hydrogen 3.176 N/A ALA 74.A N GLY 71.A O no hydrogen 3.242 N/A LEU 76.A N ASN 69.A O no hydrogen 3.041 N/A ALA 77.A N PHE 722.A O no hydrogen 2.825 N/A ASN 78.A ND2 ASN 714.A O no hydrogen 2.941 N/A TYR 79.A OH ASP 706.A OD1 no hydrogen 2.768 N/A LYS 82.A N ASP 726.A OD1 no hydrogen 3.212 N/A LYS 82.A NZ GLU 86.A OE1 no hydrogen 2.763 N/A TYR 83.A N ASP 726.A OD2 no hydrogen 2.707 N/A ALA 84.A N PRO 80.A O no hydrogen 2.961 N/A GLU 85.A N TYR 81.A O no hydrogen 2.888 N/A GLU 86.A N LYS 82.A O no hydrogen 2.944 N/A GLN 87.A N TYR 83.A O no hydrogen 2.829 N/A ALA 88.A N ALA 84.A O no hydrogen 2.945 N/A ARG 89.A N GLU 85.A O no hydrogen 2.897 N/A SER 90.A N GLU 86.A O no hydrogen 2.885 N/A SER 90.A OG GLU 86.A O no hydrogen 2.682 N/A HIS 91.A N GLN 87.A O no hydrogen 3.027 N/A ARG 92.A N ALA 88.A O no hydrogen 2.818 N/A ASP 93.A N ARG 89.A O no hydrogen 2.892 N/A ASP 94.A N SER 90.A O no hydrogen 2.955 N/A ARG 95.A N HIS 91.A O no hydrogen 2.854 N/A ARG 95.A NE ASP 99.A OD2 no hydrogen 3.156 N/A SER 97.A N ARG 92.A O no hydrogen 3.048 N/A ASP 98.A N ARG 95.A O no hydrogen 2.989 N/A ASP 99.A N ARG 95.A O no hydrogen 2.912 N/A HIS 100.A N TRP 96.A O no hydrogen 2.859 N/A VAL 105.A N VAL 169.A O no hydrogen 3.207 N/A TRP 107.A NE1 ASP 112.A O no hydrogen 3.058 N/A PHE 109.A N SER 188.A O no hydrogen 2.884 N/A GLN 110.A N ASN 108.A OD1 no hydrogen 2.872 N/A GLN 110.A NE2 ASN 186.A O no hydrogen 2.813 N/A LYS 111.A N ASN 108.A OD1 no hydrogen 3.031 N/A ASP 112.A N ASN 108.A O no hydrogen 2.861 N/A SER 113.A OG PHE 109.A O no hydrogen 2.644 N/A SER 113.A OG GLN 110.A O no hydrogen 3.551 N/A PHE 114.A N ASP 112.A O no hydrogen 2.825 N/A VAL 118.A N ASP 117.A OD1 no hydrogen 2.829 N/A GLY 122.A N SER 120.A OG no hydrogen 3.316 N/A TYR 123.A N SER 120.A O no hydrogen 3.379 N/A TYR 123.A OH GLN 164.A OE1 no hydrogen 2.653 N/A SER 124.A N THR 281.A O no hydrogen 2.928 N/A SER 124.A OG THR 281.A O no hydrogen 3.127 N/A ARG 125.A N GLU 311.A O no hydrogen 3.027 N/A ARG 125.A NE TYR 572.A OH no hydrogen 3.088 N/A ARG 125.A NH1 ASP 121.A O no hydrogen 2.783 N/A ARG 125.A NH1 TYR 123.A O no hydrogen 2.860 N/A ARG 125.A NH2 GLU 583.A OE2 no hydrogen 2.791 N/A VAL 126.A N LEU 277.A O no hydrogen 3.048 N/A VAL 127.A N GLY 309.A O no hydrogen 2.828 N/A PHE 128.A N SER 275.A O no hydrogen 2.845 N/A ALA 129.A N THR 306.A O no hydrogen 2.884 N/A SER 130.A OG GLU 134.A O no hydrogen 2.621 N/A ALA 131.A N ILE 304.A O no hydrogen 3.102 N/A THR 135.A OG1 PRO 270.A O no hydrogen 2.785 N/A LEU 136.A N LEU 272.A O no hydrogen 2.891 N/A TRP 137.A N THR 135.A OG1 no hydrogen 3.386 N/A ASN 138.A N LEU 136.A O no hydrogen 2.833 N/A ASN 138.A ND2 THR 135.A O no hydrogen 2.873 N/A ALA 141.A N ASN 138.A OD1 no hydrogen 2.909 N/A ILE 142.A N ASN 138.A O no hydrogen 2.975 N/A LYS 143.A N LEU 139.A O no hydrogen 2.944 N/A SER 144.A N PRO 140.A O no hydrogen 2.881 N/A SER 144.A OG ASP 302.A OD1 no hydrogen 3.244 N/A SER 144.A OG ASP 302.A OD2 no hydrogen 2.586 N/A SER 144.A OG THR 305.A OG1 no hydrogen 2.688 N/A MET 145.A N ALA 141.A O no hydrogen 3.073 N/A CYS 146.A N ILE 142.A O no hydrogen 3.367 N/A CYS 146.A SG ILE 142.A O no hydrogen 3.564 N/A ASP 147.A N LYS 143.A O no hydrogen 2.825 N/A VAL 148.A N SER 144.A O no hydrogen 2.876 N/A ASP 149.A N MET 145.A O no hydrogen 3.201 N/A ASN 150.A N CYS 146.A O no hydrogen 2.982 N/A SER 151.A N ASP 147.A O no hydrogen 2.899 N/A SER 151.A OG ASP 147.A O no hydrogen 2.640 N/A ARG 152.A N VAL 148.A O no hydrogen 2.808 N/A ARG 152.A NH1 ASN 294.A O no hydrogen 2.911 N/A ILE 153.A N ASP 149.A O no hydrogen 2.988 N/A ARG 154.A N ASP 149.A O no hydrogen 3.042 N/A ARG 154.A NH1 CYS 172.A O no hydrogen 3.150 N/A ARG 154.A NH2 CYS 172.A O no hydrogen 2.822 N/A SER 155.A OG SER 151.A O no hydrogen 2.636 N/A HIS 156.A N ILE 153.A O no hydrogen 3.085 N/A HIS 156.A NE2 ASP 293.A OD2 no hydrogen 2.796 N/A GLN 158.A N HIS 156.A ND1 no hydrogen 3.095 N/A PHE 159.A N HIS 156.A O no hydrogen 2.965 N/A SER 160.A OG GLU 104.A OE2 no hydrogen 2.552 N/A ASP 161.A N GLN 158.A O no hydrogen 3.053 N/A LEU 162.A N GLN 158.A O no hydrogen 3.271 N/A LEU 162.A N PHE 159.A O no hydrogen 3.011 N/A CYS 163.A N PHE 159.A O no hydrogen 2.872 N/A CYS 163.A SG SER 160.A O no hydrogen 3.702 N/A CYS 163.A SG GLN 164.A O no hydrogen 3.769 N/A GLN 164.A N PRO 280.A O no hydrogen 2.897 N/A ARG 165.A NH1 GLU 104.A OE1 no hydrogen 2.704 N/A ARG 165.A NH2 GLU 104.A OE1 no hydrogen 3.181 N/A ARG 165.A NH2 GLU 104.A OE2 no hydrogen 2.789 N/A ARG 165.A NH2 SER 160.A O no hydrogen 2.807 N/A THR 166.A OG1 THR 167.A OG1 no hydrogen 3.166 N/A THR 167.A OG1 THR 166.A OG1 no hydrogen 3.166 N/A CYS 171.A SG GLU 104.A OE1 no hydrogen 3.482 N/A CYS 172.A N GLN 164.A O no hydrogen 2.936 N/A SER 174.A OG ASP 149.A OD2 no hydrogen 2.570 N/A TRP 175.A N PHE 278.A O no hydrogen 3.037 N/A TRP 175.A NE1 ASP 117.A O no hydrogen 2.802 N/A ASN 179.A N THR 176.A O no hydrogen 3.003 N/A ASN 179.A ND2 SER 174.A O no hydrogen 2.818 N/A TYR 180.A N THR 176.A O no hydrogen 3.220 N/A TYR 180.A OH GLN 249.A OE1 no hydrogen 2.626 N/A ILE 181.A N LEU 177.A O no hydrogen 2.892 N/A ALA 182.A N GLY 178.A O no hydrogen 2.966 N/A ILE 183.A N ASN 179.A O no hydrogen 3.083 N/A LEU 184.A N TYR 180.A O no hydrogen 3.031 N/A ASN 185.A N ILE 181.A O no hydrogen 2.917 N/A ARG 187.A N ALA 182.A O no hydrogen 3.143 N/A ARG 187.A N ASN 185.A O no hydrogen 2.783 N/A ARG 187.A NE ASP 197.A OD2 no hydrogen 2.807 N/A ARG 187.A NH2 ASP 197.A OD1 no hydrogen 2.769 N/A ARG 187.A NH2 ASP 197.A OD2 no hydrogen 3.363 N/A CYS 190.A SG GLN 191.A OE1 no hydrogen 3.920 N/A GLN 191.A N SER 189.A OG no hydrogen 3.330 N/A GLN 191.A NE2 ASP 147.A OD1 no hydrogen 2.828 N/A LYS 192.A N SER 189.A O no hydrogen 3.070 N/A ILE 193.A N CYS 190.A O no hydrogen 3.482 N/A VAL 194.A N ASP 197.A OD2 no hydrogen 2.866 N/A ASP 197.A N VAL 194.A O no hydrogen 2.847 N/A VAL 198.A N VAL 194.A O no hydrogen 3.175 N/A SER 199.A N GLU 195.A O no hydrogen 2.909 N/A SER 199.A OG GLU 195.A O no hydrogen 2.736 N/A HIS 200.A N ARG 196.A O no hydrogen 2.818 N/A THR 201.A N ASP 197.A O no hydrogen 2.892 N/A THR 201.A OG1 ASP 197.A O no hydrogen 2.721 N/A LEU 202.A N VAL 198.A O no hydrogen 2.978 N/A LYS 203.A N SER 199.A O no hydrogen 2.950 N/A LEU 204.A N HIS 200.A O no hydrogen 2.960 N/A LEU 205.A N THR 201.A O no hydrogen 2.929 N/A ARG 206.A N LEU 202.A O no hydrogen 2.870 N/A ARG 206.A NH1 ALA 265.A O no hydrogen 2.824 N/A THR 207.A N LYS 203.A O no hydrogen 2.958 N/A THR 207.A OG1 LYS 203.A O no hydrogen 2.719 N/A CYS 208.A N LEU 204.A O no hydrogen 2.887 N/A CYS 208.A SG LEU 204.A O no hydrogen 3.324 N/A ALA 209.A N LEU 205.A O no hydrogen 2.879 N/A HIS 211.A N CYS 208.A O no hydrogen 2.977 N/A HIS 211.A ND1 THR 216.A OG1 no hydrogen 2.910 N/A TYR 212.A OH HIS 252.A ND1 no hydrogen 2.846 N/A GLN 213.A N ALA 209.A O no hydrogen 2.845 N/A GLN 213.A NE2 MET 260.A O no hydrogen 2.819 N/A ASN 214.A N LYS 210.A O no hydrogen 3.055 N/A GLY 215.A N TYR 212.A O no hydrogen 3.113 N/A THR 216.A N HIS 211.A O no hydrogen 2.969 N/A THR 216.A OG1 HIS 211.A ND1 no hydrogen 2.910 N/A THR 216.A OG1 HIS 211.A O no hydrogen 3.079 N/A LEU 217.A N HIS 211.A O no hydrogen 3.098 N/A ASP 223.A N ASP 220.A O no hydrogen 3.273 N/A ALA 225.A N CYS 221.A O no hydrogen 3.136 N/A ALA 226.A N TRP 222.A O no hydrogen 2.827 N/A ARG 227.A N LYS 224.A O no hydrogen 3.074 N/A ARG 228.A N LYS 224.A O no hydrogen 3.066 N/A ARG 228.A NE ASP 230.A OD1 no hydrogen 3.153 N/A ARG 228.A NH2 ASP 230.A OD2 no hydrogen 3.441 N/A GLN 231.A N ASP 230.A OD1 no hydrogen 2.865 N/A GLN 231.A NE2 ASP 230.A OD2 no hydrogen 2.861 N/A LYS 233.A NZ GLN 231.A OE1 no hydrogen 2.895 N/A CYS 234.A SG CYS 221.A O no hydrogen 3.217 N/A VAL 237.A N THR 235.A OG1 no hydrogen 3.154 N/A CYS 241.A N PRO 238.A O no hydrogen 3.016 N/A THR 242.A N ARG 239.A O no hydrogen 3.334 N/A THR 242.A OG1 ARG 239.A O no hydrogen 3.128 N/A ASN 245.A N THR 242.A O no hydrogen 3.113 N/A ASN 245.A ND2 PRO 219.A O no hydrogen 2.846 N/A GLN 249.A N ASN 245.A O no hydrogen 3.000 N/A ILE 250.A N ALA 246.A O no hydrogen 2.847 N/A LEU 251.A N VAL 247.A O no hydrogen 3.099 N/A HIS 252.A N TYR 248.A O no hydrogen 2.831 N/A HIS 252.A ND1 TYR 212.A OH no hydrogen 2.846 N/A TYR 253.A N GLN 249.A O no hydrogen 3.075 N/A LEU 254.A N ILE 250.A O no hydrogen 2.943 N/A ASP 256.A N TYR 274.A O no hydrogen 3.096 N/A LYS 257.A N LEU 579.A O no hydrogen 2.792 N/A LYS 257.A NZ ASP 258.A OD1 no hydrogen 2.798 N/A ASP 258.A N ASP 256.A OD1 no hydrogen 2.936 N/A PHE 259.A N ASP 256.A O no hydrogen 3.140 N/A THR 261.A OG1 LYS 263.A O no hydrogen 2.657 N/A THR 264.A OG1 ASP 266.A OD1 no hydrogen 2.613 N/A THR 264.A OG1 ASP 266.A OD2 no hydrogen 3.244 N/A ASP 266.A N THR 264.A O no hydrogen 2.919 N/A LEU 272.A N THR 135.A OG1 no hydrogen 2.965 N/A LEU 272.A N PRO 270.A O no hydrogen 3.091 N/A LYS 273.A N ASP 256.A OD2 no hydrogen 2.834 N/A TYR 274.A N ASP 256.A OD2 no hydrogen 2.946 N/A SER 275.A N PHE 128.A O no hydrogen 3.138 N/A SER 275.A OG LEU 254.A O no hydrogen 2.730 N/A MET 276.A N LEU 254.A O no hydrogen 2.938 N/A LEU 277.A N VAL 126.A O no hydrogen 2.956 N/A PHE 278.A N TRP 175.A O no hydrogen 3.009 N/A SER 279.A N SER 124.A O no hydrogen 2.838 N/A SER 279.A OG THR 281.A OG1 no hydrogen 3.190 N/A THR 281.A N SER 279.A O no hydrogen 2.783 N/A THR 281.A OG1 SER 279.A OG no hydrogen 3.190 N/A LYS 283.A N GLY 122.A O no hydrogen 2.999 N/A LYS 283.A NZ GLU 311.A OE2 no hydrogen 2.825 N/A GLY 284.A N PHE 312.A O no hydrogen 2.923 N/A MET 287.A N GLY 284.A O no hydrogen 2.891 N/A MET 288.A N GLU 285.A O no hydrogen 3.279 N/A ASN 289.A ND2 GLN 158.A OE1 no hydrogen 2.884 N/A TYR 291.A N MET 287.A O no hydrogen 3.055 N/A LEU 292.A N MET 288.A O no hydrogen 2.927 N/A ASP 293.A N ASN 289.A O no hydrogen 2.882 N/A ASN 294.A N ILE 290.A O no hydrogen 2.980 N/A ASN 294.A ND2 ARG 152.A O no hydrogen 2.793 N/A PHE 295.A N TYR 291.A O no hydrogen 2.885 N/A GLU 296.A N TYR 291.A O no hydrogen 2.871 N/A SER 301.A OG THR 305.A O no hydrogen 2.734 N/A SER 301.A OG THR 306.A OG1 no hydrogen 3.225 N/A ASP 302.A N THR 305.A O no hydrogen 3.352 N/A GLY 303.A N SER 301.A OG no hydrogen 3.047 N/A ILE 304.A N ASP 302.A OD1 no hydrogen 2.784 N/A THR 305.A N ASP 302.A OD1 no hydrogen 2.838 N/A THR 305.A OG1 SER 144.A OG no hydrogen 2.688 N/A THR 306.A N ALA 129.A O no hydrogen 2.842 N/A THR 306.A OG1 SER 301.A OG no hydrogen 3.225 N/A VAL 307.A N SER 300.A O no hydrogen 2.833 N/A THR 308.A N VAL 127.A O no hydrogen 2.915 N/A THR 308.A OG1 VAL 127.A O no hydrogen 3.464 N/A GLY 309.A N VAL 127.A O no hydrogen 3.507 N/A ILE 310.A N PRO 568.A O no hydrogen 3.441 N/A GLU 311.A N ARG 125.A O no hydrogen 2.866 N/A GLY 313.A N GLU 311.A OE1 no hydrogen 3.020 N/A LYS 315.A NZ GLU 570.A OE1 no hydrogen 3.079 N/A LEU 318.A N ILE 314.A O no hydrogen 2.999 N/A PHE 319.A N HIS 316.A O no hydrogen 3.210 N/A TYR 322.A N LEU 318.A O no hydrogen 3.106 N/A TYR 322.A OH GLU 296.A OE2 no hydrogen 2.613 N/A LEU 323.A N PHE 319.A O no hydrogen 2.871 N/A LEU 324.A N GLN 320.A O no hydrogen 3.237 N/A MET 325.A N ASP 321.A O no hydrogen 2.905 N/A ASP 326.A N TYR 322.A O no hydrogen 2.963 N/A THR 327.A N LEU 324.A O no hydrogen 3.196 N/A THR 327.A OG1 LEU 324.A O no hydrogen 2.618 N/A VAL 328.A N MET 325.A O no hydrogen 3.431 N/A TYR 329.A N ASP 326.A O no hydrogen 3.174 N/A ALA 331.A N THR 327.A O no hydrogen 3.463 N/A ILE 332.A N VAL 328.A O no hydrogen 3.138 N/A ALA 333.A N TYR 329.A O no hydrogen 3.040 N/A ILE 334.A N PRO 330.A O no hydrogen 2.914 N/A ALA 335.A N ALA 331.A O no hydrogen 3.211 N/A ILE 336.A N ILE 332.A O no hydrogen 3.084 N/A VAL 337.A N ALA 333.A O no hydrogen 2.915 N/A LEU 338.A N ILE 334.A O no hydrogen 2.892 N/A LEU 339.A N ALA 335.A O no hydrogen 3.105 N/A ILE 340.A N ILE 336.A O no hydrogen 2.982 N/A MET 341.A N VAL 337.A O no hydrogen 3.032 N/A CYS 342.A N LEU 338.A O no hydrogen 2.846 N/A VAL 343.A N LEU 339.A O no hydrogen 3.141 N/A TYR 344.A N ILE 340.A O no hydrogen 2.991 N/A TYR 344.A OH ASP 402.A OD1 no hydrogen 2.596 N/A THR 345.A N MET 341.A O no hydrogen 2.830 N/A THR 345.A OG1 MET 341.A O no hydrogen 2.731 N/A THR 345.A OG1 SER 347.A O no hydrogen 3.141 N/A THR 345.A OG1 THR 351.A OG1 no hydrogen 3.046 N/A LYS 346.A NZ VAL 343.A O no hydrogen 2.833 N/A SER 347.A N THR 345.A OG1 no hydrogen 3.333 N/A ILE 350.A N SER 347.A OG no hydrogen 3.084 N/A THR 351.A N SER 347.A O no hydrogen 3.191 N/A THR 351.A OG1 THR 345.A OG1 no hydrogen 3.046 N/A THR 351.A OG1 SER 347.A O no hydrogen 2.706 N/A LEU 352.A N MET 348.A O no hydrogen 2.901 N/A MET 353.A N PHE 349.A O no hydrogen 3.056 N/A THR 354.A N ILE 350.A O no hydrogen 2.975 N/A THR 354.A OG1 ILE 350.A O no hydrogen 2.698 N/A MET 355.A N THR 351.A O no hydrogen 3.093 N/A PHE 356.A N LEU 352.A O no hydrogen 2.963 N/A ALA 357.A N MET 353.A O no hydrogen 3.287 N/A ILE 358.A N THR 354.A O no hydrogen 3.092 N/A ILE 359.A N MET 355.A O no hydrogen 3.061 N/A SER 360.A N PHE 356.A O no hydrogen 2.935 N/A SER 360.A OG PHE 356.A O no hydrogen 2.715 N/A SER 361.A N ALA 357.A O no hydrogen 3.027 N/A SER 361.A N ILE 358.A O no hydrogen 3.258 N/A SER 361.A OG ILE 358.A O no hydrogen 2.652 N/A SER 361.A OG ASN 467.A OD1 no hydrogen 3.483 N/A LEU 362.A N ILE 359.A O no hydrogen 3.153 N/A ILE 363.A N ILE 359.A O no hydrogen 3.364 N/A VAL 364.A N SER 360.A O no hydrogen 2.934 N/A SER 365.A N SER 361.A O no hydrogen 3.077 N/A SER 365.A OG SER 361.A O no hydrogen 2.632 N/A TYR 366.A N LEU 362.A O no hydrogen 3.067 N/A PHE 367.A N ILE 363.A O no hydrogen 3.134 N/A LEU 368.A N VAL 364.A O no hydrogen 2.984 N/A TYR 369.A N SER 365.A O no hydrogen 2.846 N/A TYR 369.A OH PHE 377.A O no hydrogen 2.670 N/A ARG 370.A N TYR 366.A O no hydrogen 2.938 N/A ARG 370.A NE PHE 375.A O no hydrogen 2.839 N/A ARG 370.A NH1 GLU 38.A O no hydrogen 2.909 N/A ARG 370.A NH2 GLU 38.A O no hydrogen 2.844 N/A VAL 371.A N PHE 367.A O no hydrogen 2.865 N/A VAL 372.A N LEU 368.A O no hydrogen 3.067 N/A PHE 373.A N LEU 368.A O no hydrogen 2.779 N/A ASN 374.A ND2 VAL 372.A O no hydrogen 3.038 N/A PHE 375.A N TYR 369.A O no hydrogen 3.002 N/A ASN 382.A N PRO 379.A O no hydrogen 3.151 N/A LEU 383.A N PHE 380.A O no hydrogen 3.012 N/A THR 384.A N MET 381.A O.A no hydrogen 3.132 N/A THR 384.A N MET 381.A O.B no hydrogen 3.370 N/A THR 384.A OG1 MET 381.A O.A no hydrogen 2.706 N/A THR 384.A OG1 MET 381.A O.B no hydrogen 2.672 N/A ALA 385.A N ASN 382.A O no hydrogen 3.106 N/A ILE 387.A N THR 384.A O no hydrogen 3.068 N/A ILE 388.A N THR 384.A O no hydrogen 3.402 N/A LEU 389.A N ALA 385.A O no hydrogen 2.900 N/A VAL 390.A N LEU 386.A O no hydrogen 2.932 N/A GLY 391.A N ILE 387.A O no hydrogen 2.997 N/A ILE 392.A N ILE 388.A O no hydrogen 2.874 N/A GLY 393.A N LEU 389.A O no hydrogen 2.770 N/A ASP 395.A N ILE 392.A O no hydrogen 3.064 N/A PHE 398.A N ALA 394.A O no hydrogen 3.493 N/A LEU 400.A N ASP 396.A O no hydrogen 2.914 N/A CYS 401.A N ALA 397.A O no hydrogen 2.980 N/A CYS 401.A SG ALA 397.A O no hydrogen 3.193 N/A ASP 402.A N PHE 398.A O no hydrogen 3.146 N/A VAL 403.A N VAL 399.A O no hydrogen 2.974 N/A TRP 404.A N LEU 400.A O no hydrogen 2.882 N/A TRP 404.A NE1 GLU 483.A OE1 no hydrogen 2.845 N/A ASN 405.A N CYS 401.A O no hydrogen 2.978 N/A TYR 406.A N ASP 402.A O no hydrogen 2.873 N/A TYR 406.A OH ARG 886.A O no hydrogen 3.039 N/A THR 407.A N VAL 403.A O no hydrogen 2.897 N/A THR 407.A OG1 VAL 403.A O no hydrogen 2.731 N/A THR 407.A OG1 THR 423.A OG1 no hydrogen 3.316 N/A LYS 408.A N TRP 404.A O no hydrogen 2.887 N/A LYS 408.A NZ GLU 483.A OE2 no hydrogen 2.777 N/A PHE 409.A N ASN 405.A O no hydrogen 3.020 N/A ASP 410.A N TYR 406.A O no hydrogen 2.825 N/A LYS 411.A N THR 407.A O no hydrogen 3.116 N/A ALA 414.A N LYS 411.A O no hydrogen 3.131 N/A GLU 415.A N GLU 418.A OE1 no hydrogen 2.921 N/A ALA 419.A N GLU 415.A O no hydrogen 2.911 N/A VAL 420.A N THR 416.A O no hydrogen 2.891 N/A SER 421.A N SER 417.A O no hydrogen 2.965 N/A VAL 422.A N GLU 418.A O no hydrogen 2.860 N/A THR 423.A N ALA 419.A O no hydrogen 2.994 N/A THR 423.A OG1 THR 407.A OG1 no hydrogen 3.316 N/A THR 423.A OG1 ALA 419.A O no hydrogen 2.704 N/A LEU 424.A N VAL 420.A O no hydrogen 2.863 N/A GLN 425.A N SER 421.A O no hydrogen 2.930 N/A GLN 425.A NE2 SER 421.A OG no hydrogen 2.977 N/A HIS 426.A N VAL 422.A O no hydrogen 3.078 N/A ALA 427.A N THR 423.A O no hydrogen 2.879 N/A ALA 428.A N LEU 424.A O no hydrogen 2.951 N/A MET 431.A N ALA 427.A O no hydrogen 3.064 N/A PHE 432.A N ALA 428.A O no hydrogen 3.084 N/A VAL 433.A N LEU 429.A O no hydrogen 2.938 N/A THR 434.A N SER 430.A O no hydrogen 3.191 N/A THR 434.A OG1 SER 430.A O no hydrogen 3.372 N/A THR 434.A OG1 MET 431.A O no hydrogen 3.290 N/A SER 435.A N MET 431.A O no hydrogen 3.318 N/A SER 435.A OG ILE 464.A O no hydrogen 3.469 N/A PHE 436.A N PHE 432.A O no hydrogen 2.728 N/A THR 437.A N VAL 433.A O no hydrogen 3.007 N/A THR 437.A OG1 VAL 433.A O no hydrogen 2.706 N/A THR 437.A OG1 THR 434.A O no hydrogen 2.785 N/A THR 437.A OG1 GLY 855.A O no hydrogen 3.378 N/A THR 438.A N SER 435.A O no hydrogen 3.024 N/A THR 438.A OG1 THR 434.A O no hydrogen 3.202 N/A ALA 439.A N SER 435.A O no hydrogen 2.968 N/A ALA 440.A N PHE 436.A O no hydrogen 2.841 N/A ALA 441.A N THR 437.A O no hydrogen 3.378 N/A PHE 442.A N THR 438.A O no hydrogen 3.150 N/A TYR 443.A N ALA 439.A O no hydrogen 2.822 N/A TYR 443.A OH THR 462.A OG1 no hydrogen 2.831 N/A ALA 444.A N ALA 440.A O no hydrogen 2.828 N/A ASN 445.A N PHE 442.A O no hydrogen 3.041 N/A ASN 445.A ND2 ALA 441.A O no hydrogen 2.972 N/A ASN 445.A ND2 PHE 442.A O no hydrogen 3.562 N/A ASN 445.A ND2 SER 851.A OG no hydrogen 2.873 N/A TYR 446.A N TYR 443.A O no hydrogen 2.933 N/A VAL 447.A N ALA 444.A O no hydrogen 3.362 N/A SER 448.A N ASN 445.A O no hydrogen 3.099 N/A ILE 450.A N SER 448.A OG no hydrogen 3.308 N/A THR 451.A N GLU 50.A O no hydrogen 3.290 N/A THR 451.A OG1 PRO 609.A O no hydrogen 2.857 N/A ALA 452.A N GLY 48.A O no hydrogen 3.009 N/A ILE 453.A N ILE 450.A O no hydrogen 3.073 N/A ARG 454.A N ILE 450.A O no hydrogen 3.248 N/A ARG 454.A NE TYR 446.A O no hydrogen 2.879 N/A ARG 454.A NH2 TYR 446.A O no hydrogen 3.290 N/A CYS 455.A N THR 451.A O no hydrogen 3.130 N/A CYS 455.A SG THR 451.A O no hydrogen 3.263 N/A CYS 455.A SG LEU 610.A O no hydrogen 4.022 N/A PHE 456.A N ALA 452.A O no hydrogen 3.116 N/A GLY 457.A N ILE 453.A O no hydrogen 3.115 N/A VAL 458.A N ARG 454.A O no hydrogen 3.285 N/A TYR 459.A N CYS 455.A O no hydrogen 3.202 N/A TYR 459.A OH LEU 362.A O no hydrogen 3.054 N/A ALA 460.A N PHE 456.A O no hydrogen 3.054 N/A GLY 461.A N GLY 457.A O no hydrogen 2.955 N/A THR 462.A N VAL 458.A O no hydrogen 3.149 N/A THR 462.A OG1 TYR 443.A OH no hydrogen 2.831 N/A THR 462.A OG1 VAL 458.A O no hydrogen 2.637 N/A ALA 463.A N TYR 459.A O no hydrogen 3.105 N/A ILE 464.A N ALA 460.A O no hydrogen 3.241 N/A LEU 465.A N GLY 461.A O no hydrogen 3.301 N/A VAL 466.A N THR 462.A O no hydrogen 2.906 N/A ASN 467.A N ALA 463.A O no hydrogen 2.911 N/A ASN 467.A ND2 GLY 393.A O no hydrogen 3.504 N/A TYR 468.A N ILE 464.A O no hydrogen 3.195 N/A TYR 468.A OH ALA 428.A O no hydrogen 2.901 N/A VAL 469.A N LEU 465.A O no hydrogen 3.142 N/A LEU 470.A N VAL 466.A O no hydrogen 3.229 N/A MET 471.A N ASN 467.A O no hydrogen 3.008 N/A VAL 472.A N TYR 468.A O no hydrogen 3.270 N/A VAL 472.A N VAL 469.A O no hydrogen 3.366 N/A THR 473.A N LEU 470.A O no hydrogen 3.358 N/A THR 473.A OG1 VAL 469.A O no hydrogen 2.687 N/A TRP 474.A N THR 473.A OG1 no hydrogen 2.825 N/A TRP 474.A NE1 MET 353.A O no hydrogen 2.857 N/A LEU 475.A N LEU 470.A O no hydrogen 3.128 N/A ALA 477.A N THR 473.A O no hydrogen 3.388 N/A VAL 478.A N TRP 474.A O no hydrogen 2.964 N/A ILE 479.A N LEU 475.A O no hydrogen 2.936 N/A VAL 480.A N PRO 476.A O no hydrogen 2.987 N/A LEU 481.A N ALA 477.A O no hydrogen 3.019 N/A HIS 482.A N VAL 478.A O no hydrogen 2.982 N/A GLU 483.A N ILE 479.A O no hydrogen 3.113 N/A ARG 484.A N VAL 480.A O no hydrogen 2.956 N/A ARG 484.A NH1 ALA 12.A O no hydrogen 2.910 N/A ARG 484.A NH2 ALA 12.A O no hydrogen 2.845 N/A TYR 485.A N LEU 481.A O no hydrogen 3.011 N/A LEU 487.A N HIS 482.A O no hydrogen 3.041 N/A ASN 488.A N TYR 485.A O no hydrogen 2.906 N/A ASN 488.A ND2 TYR 485.A O no hydrogen 2.984 N/A PHE 490.A N ASN 488.A O no hydrogen 2.999 N/A LYS 498.A N VAL 494.A O no hydrogen 2.810 N/A ARG 500.A N LEU 495.A O no hydrogen 2.858 N/A ARG 501.A NE GLN 497.A O no hydrogen 2.827 N/A ARG 501.A NH2 GLN 497.A O no hydrogen 2.989 N/A VAL 502.A N LYS 498.A O no hydrogen 2.864 N/A LEU 503.A N CYS 499.A O no hydrogen 2.893 N/A PHE 504.A N ARG 500.A O no hydrogen 2.989 N/A ALA 505.A N ARG 501.A O no hydrogen 2.827 N/A VAL 506.A N VAL 502.A O no hydrogen 2.861 N/A SER 507.A N LEU 503.A O no hydrogen 2.920 N/A SER 507.A OG GLU 508.A OE2 no hydrogen 2.621 N/A GLU 508.A N PHE 504.A O no hydrogen 2.979 N/A ALA 509.A N ALA 505.A O no hydrogen 2.929 N/A SER 510.A N VAL 506.A O no hydrogen 2.990 N/A SER 510.A OG VAL 506.A O no hydrogen 2.621 N/A ARG 511.A N SER 507.A O no hydrogen 2.844 N/A ARG 511.A NE GLU 508.A OE1 no hydrogen 2.873 N/A ARG 511.A NH1 GLU 515.A OE1 no hydrogen 3.099 N/A ARG 511.A NH2 GLU 508.A OE1 no hydrogen 2.962 N/A ILE 512.A N GLU 508.A O no hydrogen 2.881 N/A PHE 513.A N ALA 509.A O no hydrogen 3.065 N/A PHE 514.A N SER 510.A O no hydrogen 3.016 N/A GLU 515.A N ARG 511.A O no hydrogen 2.941 N/A LYS 516.A N ILE 512.A O no hydrogen 2.871 N/A VAL 517.A N ILE 512.A O no hydrogen 3.408 N/A LEU 518.A N PHE 513.A O no hydrogen 2.873 N/A CYS 520.A N LYS 516.A O no hydrogen 3.373 N/A ILE 521.A N VAL 517.A O no hydrogen 3.107 N/A VAL 522.A N LEU 518.A O no hydrogen 3.016 N/A ILE 523.A N PRO 519.A O no hydrogen 3.027 N/A LYS 524.A N CYS 520.A O no hydrogen 2.869 N/A ARG 526.A N ILE 523.A O no hydrogen 3.494 N/A ARG 526.A NH1 ILE 523.A O no hydrogen 3.080 N/A TRP 529.A N PHE 525.A O no hydrogen 3.009 N/A TRP 529.A NE1 ILE 521.A O no hydrogen 3.012 N/A LEU 530.A N ARG 526.A O no hydrogen 3.028 N/A ILE 531.A N TYR 527.A O no hydrogen 3.152 N/A TRP 532.A N LEU 528.A O no hydrogen 2.922 N/A PHE 533.A N TRP 529.A O no hydrogen 2.945 N/A LEU 534.A N LEU 530.A O no hydrogen 3.140 N/A ALA 535.A N ILE 531.A O no hydrogen 2.983 N/A LEU 536.A N TRP 532.A O no hydrogen 2.946 N/A THR 537.A N PHE 533.A O no hydrogen 3.095 N/A THR 537.A OG1 PHE 533.A O no hydrogen 2.707 N/A VAL 538.A N LEU 534.A O no hydrogen 3.025 N/A GLY 539.A N ALA 535.A O no hydrogen 2.981 N/A GLY 540.A N LEU 536.A O no hydrogen 2.901 N/A ALA 541.A N THR 537.A O no hydrogen 2.913 N/A TYR 542.A N VAL 538.A O no hydrogen 2.939 N/A ILE 543.A N GLY 539.A O no hydrogen 3.066 N/A VAL 544.A N GLY 540.A O no hydrogen 3.088 N/A CYS 545.A N ALA 541.A O no hydrogen 2.853 N/A VAL 546.A N TYR 542.A O no hydrogen 2.913 N/A ASN 547.A N TYR 542.A O no hydrogen 3.138 N/A LYS 549.A NZ VAL 546.A O no hydrogen 2.926 N/A SER 554.A OG GLU 841.A OE1 no hydrogen 3.138 N/A SER 554.A OG GLU 841.A OE2 no hydrogen 3.240 N/A GLU 559.A N GLU 556.A O no hydrogen 2.911 N/A PHE 560.A N LEU 557.A O no hydrogen 3.070 N/A GLN 561.A NE2 PHE 563.A O no hydrogen 2.900 N/A GLN 561.A NE2 SER 565.A OG no hydrogen 3.271 N/A VAL 562.A N GLU 570.A OE2 no hydrogen 3.276 N/A ARG 564.A N THR 909.A O no hydrogen 2.753 N/A ARG 564.A NE SER 908.A O no hydrogen 3.154 N/A ARG 564.A NH2 SER 908.A O no hydrogen 2.913 N/A HIS 567.A N ARG 564.A O no hydrogen 3.067 N/A GLU 570.A N HIS 567.A O no hydrogen 3.029 N/A ARG 571.A N HIS 567.A O no hydrogen 2.912 N/A ARG 571.A NE GLU 575.A OE1 no hydrogen 3.100 N/A ARG 571.A NH2 GLU 575.A OE1 no hydrogen 3.261 N/A TYR 572.A N PRO 568.A O no hydrogen 2.874 N/A TYR 572.A OH GLU 583.A OE2 no hydrogen 2.844 N/A ASP 573.A N PHE 569.A O no hydrogen 3.348 N/A ALA 574.A N GLU 570.A O no hydrogen 2.950 N/A GLU 575.A N ARG 571.A O no hydrogen 3.081 N/A PHE 576.A N ARG 571.A O no hydrogen 3.230 N/A PHE 576.A N TYR 572.A O no hydrogen 3.243 N/A LYS 577.A N TYR 572.A O no hydrogen 3.033 N/A LYS 577.A NZ GLU 583.A OE1 no hydrogen 2.844 N/A LEU 579.A N PHE 576.A O no hydrogen 2.876 N/A PHE 582.A N HIS 252.A O no hydrogen 3.061 N/A GLU 583.A N PHE 580.A O no hydrogen 3.094 N/A ARG 584.A N PHE 580.A O no hydrogen 3.174 N/A ARG 584.A NE GLU 589.A OE2 no hydrogen 3.202 N/A ARG 584.A NH1 LYS 578.A O no hydrogen 2.924 N/A ARG 584.A NH2 GLU 589.A OE2 no hydrogen 2.857 N/A VAL 585.A N MET 581.A O no hydrogen 3.100 N/A HIS 587.A N GLU 583.A O no hydrogen 3.398 N/A HIS 587.A N ARG 584.A O no hydrogen 3.207 N/A GLY 588.A N VAL 585.A O no hydrogen 3.094 N/A LEU 591.A N GLY 588.A O no hydrogen 3.441 N/A MET 593.A N PHE 739.A O no hydrogen 2.837 N/A ILE 595.A N PHE 735.A O no hydrogen 2.761 N/A THR 596.A N VAL 776.A O no hydrogen 3.083 N/A THR 596.A OG1 VAL 776.A O no hydrogen 3.302 N/A VAL 597.A N LEU 733.A O no hydrogen 2.851 N/A ILE 598.A N TRP 774.A O no hydrogen 2.898 N/A TRP 599.A N VAL 731.A O no hydrogen 3.012 N/A TRP 599.A NE1 LEU 770.A O no hydrogen 2.816 N/A SER 602.A N THR 619.A O no hydrogen 2.858 N/A SER 602.A OG THR 619.A O no hydrogen 2.992 N/A GLU 604.A N THR 62.A OG1 no hydrogen 3.015 N/A ASP 605.A N GLN 58.A OE1 no hydrogen 3.122 N/A GLY 607.A N ASP 605.A OD1 no hydrogen 2.894 N/A ASP 608.A N SER 614.A OG no hydrogen 3.042 N/A LEU 610.A N ASP 608.A OD1 no hydrogen 2.981 N/A ASN 611.A N ASP 608.A O no hydrogen 3.070 N/A ASN 611.A ND2 GLU 376.A OE1 no hydrogen 2.782 N/A LYS 613.A N ASN 611.A OD1 no hydrogen 2.967 N/A SER 614.A N ASN 611.A O no hydrogen 3.294 N/A LYS 615.A NZ GLU 50.A OE1 no hydrogen 2.802 N/A LYS 615.A NZ GLU 50.A OE2 no hydrogen 3.148 N/A LYS 615.A NZ PRO 612.A O no hydrogen 2.812 N/A GLU 617.A N SER 606.A OG no hydrogen 3.298 N/A LEU 618.A N GLU 617.A OE2 no hydrogen 2.902 N/A THR 619.A OG1 GLU 604.A OE2 no hydrogen 2.608 N/A ASP 621.A N GLY 600.A O no hydrogen 2.833 N/A THR 623.A N ASP 621.A OD1 no hydrogen 2.841 N/A THR 623.A OG1 ASP 621.A OD1 no hydrogen 2.633 N/A THR 623.A OG1 ASP 621.A OD2 no hydrogen 3.384 N/A PHE 624.A N ASP 621.A O no hydrogen 3.372 N/A ASN 625.A N GLY 769.A O no hydrogen 3.131 N/A SER 628.A N ASN 625.A OD1 no hydrogen 2.898 N/A SER 631.A OG ASN 625.A O no hydrogen 2.658 N/A GLN 632.A N SER 628.A O no hydrogen 2.936 N/A GLN 632.A NE2 ALA 627.A O no hydrogen 2.798 N/A GLN 632.A NE2 TYR 689.A O no hydrogen 2.863 N/A ALA 633.A N PRO 629.A O no hydrogen 2.951 N/A TRP 634.A N ALA 630.A O no hydrogen 2.959 N/A TRP 634.A NE1 SER 765.A OG no hydrogen 2.968 N/A ILE 635.A N SER 631.A O no hydrogen 2.978 N/A LEU 636.A N GLN 632.A O no hydrogen 3.343 N/A HIS 637.A N ALA 633.A O no hydrogen 3.155 N/A PHE 638.A N TRP 634.A O no hydrogen 2.841 N/A CYS 639.A N ILE 635.A O no hydrogen 3.255 N/A CYS 639.A SG ILE 635.A O no hydrogen 3.524 N/A GLN 640.A N LEU 636.A O no hydrogen 3.253 N/A GLN 640.A NE2 GLU 662.A OE1 no hydrogen 2.882 N/A LYS 641.A N HIS 637.A O no hydrogen 2.889 N/A LYS 641.A NZ GLU 762.A OE1 no hydrogen 2.788 N/A LEU 642.A N PHE 638.A O no hydrogen 2.919 N/A ARG 643.A N CYS 639.A O no hydrogen 3.140 N/A ARG 643.A NH1 GLU 662.A OE2 no hydrogen 2.875 N/A ARG 643.A NH2 GLU 662.A OE1 no hydrogen 3.119 N/A ARG 643.A NH2 GLU 662.A OE2 no hydrogen 3.421 N/A ASN 644.A N LYS 641.A O no hydrogen 3.114 N/A GLN 645.A N LEU 642.A O no hydrogen 3.098 N/A GLN 645.A NE2 LYS 641.A O no hydrogen 2.898 N/A PHE 648.A N GLN 645.A O no hydrogen 3.147 N/A HIS 649.A N GLN 736.A O no hydrogen 2.948 N/A THR 651.A N HIS 649.A O no hydrogen 2.955 N/A GLN 653.A NE2 GLN 654.A O no hydrogen 2.911 N/A ASP 655.A N GLN 654.A OE1 no hydrogen 2.908 N/A THR 657.A N ASP 655.A OD1 no hydrogen 2.837 N/A THR 657.A OG1 ASP 655.A OD1 no hydrogen 2.592 N/A THR 657.A OG1 ASP 655.A OD2 no hydrogen 3.209 N/A SER 658.A N ASP 655.A O no hydrogen 3.129 N/A SER 658.A OG GLU 734.A O no hydrogen 2.814 N/A GLU 662.A N CYS 659.A O no hydrogen 3.057 N/A THR 663.A OG1 PHE 656.A O no hydrogen 2.669 N/A PHE 664.A N PHE 660.A O no hydrogen 2.884 N/A LYS 665.A N ILE 661.A O no hydrogen 2.951 N/A LYS 665.A NZ GLU 669.A OE1 no hydrogen 2.782 N/A GLN 666.A N GLU 662.A O no hydrogen 2.931 N/A TRP 667.A N THR 663.A O no hydrogen 2.900 N/A TRP 667.A NE1 GLU 704.A OE2 no hydrogen 2.836 N/A MET 668.A N PHE 664.A O no hydrogen 2.851 N/A GLU 669.A N LYS 665.A O no hydrogen 3.009 N/A ASN 670.A N TRP 667.A O no hydrogen 3.041 N/A ASN 670.A ND2 GLN 666.A O no hydrogen 2.835 N/A GLN 671.A N MET 668.A O no hydrogen 3.012 N/A GLN 671.A NE2 TRP 667.A O no hydrogen 2.859 N/A CYS 673.A SG GLN 671.A O no hydrogen 3.748 N/A CYS 673.A SG LEU 678.A O no hydrogen 3.885 N/A LEU 678.A N GLU 675.A O no hydrogen 3.467 N/A TYR 679.A N PRO 676.A O no hydrogen 2.985 N/A CYS 681.A N LEU 678.A O no hydrogen 2.831 N/A CYS 682.A SG LEU 678.A O no hydrogen 3.505 N/A CYS 682.A SG TYR 679.A O no hydrogen 3.097 N/A SER 683.A N GLN 671.A O no hydrogen 2.900 N/A SER 683.A OG GLN 671.A O no hydrogen 2.723 N/A CYS 685.A N CYS 682.A O no hydrogen 3.086 N/A CYS 685.A SG PRO 680.A O no hydrogen 3.435 N/A CYS 685.A SG CYS 682.A O no hydrogen 3.437 N/A TYR 689.A N GLN 632.A OE1 no hydrogen 3.027 N/A GLN 691.A NE2 GLU 695.A OE2 no hydrogen 2.806 N/A PHE 694.A N LYS 690.A O no hydrogen 3.036 N/A GLU 695.A N GLN 691.A O no hydrogen 2.954 N/A LEU 696.A N GLU 692.A O no hydrogen 2.969 N/A CYS 697.A N VAL 693.A O no hydrogen 2.910 N/A CYS 697.A SG VAL 693.A O no hydrogen 3.361 N/A ILE 698.A N PHE 694.A O no hydrogen 2.995 N/A LYS 699.A N LEU 696.A O no hydrogen 3.072 N/A LYS 700.A N LEU 696.A O no hydrogen 3.371 N/A LYS 700.A NZ ALA 677.A O no hydrogen 3.063 N/A ALA 701.A N CYS 697.A O no hydrogen 2.894 N/A ILE 702.A N ILE 698.A O no hydrogen 2.995 N/A MET 703.A N LYS 699.A O no hydrogen 3.019 N/A GLU 704.A N LYS 700.A O no hydrogen 2.906 N/A LEU 705.A N ALA 701.A O no hydrogen 3.007 N/A ASP 706.A N ILE 702.A O no hydrogen 3.271 N/A ARG 707.A N MET 703.A O no hydrogen 3.012 N/A SER 708.A N GLU 704.A O no hydrogen 2.832 N/A SER 708.A OG GLU 704.A O no hydrogen 2.621 N/A THR 709.A N LEU 705.A O no hydrogen 3.022 N/A LEU 713.A N TYR 79.A OH no hydrogen 3.258 N/A ASN 714.A N THR 717.A OG1 no hydrogen 2.980 N/A ASN 715.A ND2 MET 67.A O no hydrogen 3.092 N/A LYS 716.A N ASN 714.A OD1 no hydrogen 3.128 N/A LYS 716.A NZ ASN 715.A OD1 no hydrogen 2.955 N/A THR 717.A N ASN 714.A O no hydrogen 2.970 N/A THR 717.A OG1 ASN 714.A O no hydrogen 3.331 N/A GLY 719.A N VAL 732.A O no hydrogen 2.868 N/A ARG 721.A N ALA 730.A O no hydrogen 2.852 N/A ARG 721.A NH1 THR 717.A O no hydrogen 3.097 N/A ARG 721.A NH2 ASN 715.A O no hydrogen 3.217 N/A ARG 721.A NH2 THR 717.A O no hydrogen 3.005 N/A PHE 722.A N ALA 77.A O no hydrogen 2.881 N/A ASP 723.A N THR 727.A O no hydrogen 2.952 N/A ASN 725.A N ASP 723.A OD1 no hydrogen 3.212 N/A ASP 726.A N ASP 723.A O no hydrogen 2.898 N/A THR 727.A N ASP 723.A OD1 no hydrogen 2.908 N/A THR 727.A OG1 ASP 723.A OD1 no hydrogen 2.911 N/A THR 727.A OG1 ASP 723.A OD2 no hydrogen 3.033 N/A ARG 729.A N ARG 721.A O no hydrogen 2.909 N/A ARG 729.A NE ASP 723.A OD2 no hydrogen 2.962 N/A ARG 729.A NH2 ASP 723.A OD2 no hydrogen 3.466 N/A VAL 731.A N TRP 599.A O no hydrogen 3.012 N/A VAL 732.A N GLY 719.A O no hydrogen 2.980 N/A LEU 733.A N VAL 597.A O no hydrogen 2.891 N/A GLU 734.A N SER 658.A O no hydrogen 3.234 N/A PHE 735.A N ILE 595.A O no hydrogen 3.005 N/A GLN 736.A NE2 GLU 734.A OE1 no hydrogen 2.841 N/A SER 737.A N MET 593.A O no hydrogen 2.829 N/A SER 737.A OG PHE 647.A O no hydrogen 2.682 N/A THR 738.A N PHE 647.A O no hydrogen 2.903 N/A THR 738.A OG1 THR 646.A O no hydrogen 3.020 N/A PHE 739.A N SER 737.A OG no hydrogen 3.215 N/A PHE 741.A N LEU 591.A O no hydrogen 2.854 N/A ALA 744.A N THR 742.A OG1 no hydrogen 3.228 N/A TYR 745.A OH ASP 786.A OD1 no hydrogen 2.628 N/A LYS 747.A NZ GLN 750.A OE1 no hydrogen 2.865 N/A MET 748.A N ALA 744.A O no hydrogen 3.137 N/A GLN 749.A N TYR 745.A O no hydrogen 2.898 N/A GLN 750.A N GLU 746.A O no hydrogen 3.047 N/A PHE 751.A N LYS 747.A O no hydrogen 3.221 N/A TYR 752.A N MET 748.A O no hydrogen 3.057 N/A LYS 753.A N GLN 749.A O no hydrogen 2.991 N/A GLU 754.A N GLN 750.A O no hydrogen 3.077 N/A VAL 755.A N PHE 751.A O no hydrogen 3.051 N/A ASP 756.A N TYR 752.A O no hydrogen 2.894 N/A SER 757.A N LYS 753.A O no hydrogen 3.254 N/A SER 757.A OG LYS 753.A O no hydrogen 2.670 N/A TRP 758.A N GLU 754.A O no hydrogen 3.375 N/A ILE 759.A N VAL 755.A O no hydrogen 2.989 N/A SER 760.A N ASP 756.A O no hydrogen 2.921 N/A SER 760.A OG ASP 756.A O no hydrogen 2.636 N/A HIS 761.A N SER 757.A O no hydrogen 2.992 N/A GLU 762.A N TRP 758.A O no hydrogen 2.897 N/A LEU 763.A N ILE 759.A O no hydrogen 2.912 N/A SER 764.A N HIS 761.A O no hydrogen 3.137 N/A SER 764.A OG HIS 761.A O no hydrogen 2.627 N/A SER 765.A N GLU 762.A O no hydrogen 2.968 N/A SER 765.A OG GLU 762.A O no hydrogen 2.625 N/A ALA 766.A N LEU 763.A O no hydrogen 3.131 N/A LEU 770.A N PRO 767.A O no hydrogen 2.879 N/A SER 771.A OG ALA 766.A O no hydrogen 3.501 N/A SER 771.A OG PRO 767.A O no hydrogen 3.172 N/A ARG 772.A NH2 GLU 768.A OE2 no hydrogen 3.342 N/A TRP 774.A N ILE 598.A O no hydrogen 2.959 N/A TRP 774.A NE1 VAL 601.A O no hydrogen 2.857 N/A VAL 776.A N THR 596.A O no hydrogen 2.885 N/A SER 777.A OG PRO 594.A O no hydrogen 2.596 N/A LEU 779.A N SER 777.A O no hydrogen 2.837 N/A ASP 783.A N LEU 779.A O no hydrogen 3.001 N/A LEU 784.A N GLU 780.A O no hydrogen 3.136 N/A GLN 785.A N PHE 781.A O no hydrogen 2.962 N/A GLN 785.A NE2 PRO 553.A O no hydrogen 3.106 N/A GLN 785.A NE2 LEU 743.A O no hydrogen 3.005 N/A ASP 786.A N TYR 782.A O no hydrogen 2.983 N/A SER 787.A N ASP 783.A O no hydrogen 2.998 N/A SER 787.A OG ASP 783.A O no hydrogen 2.755 N/A LEU 788.A N LEU 784.A O no hydrogen 2.897 N/A SER 789.A N GLN 785.A O no hydrogen 3.149 N/A SER 789.A OG ASP 786.A O no hydrogen 2.737 N/A ASP 790.A N ASP 786.A O no hydrogen 3.061 N/A GLY 791.A N SER 787.A O no hydrogen 2.945 N/A THR 792.A N LEU 788.A O no hydrogen 3.282 N/A THR 792.A OG1 LEU 788.A O no hydrogen 2.671 N/A THR 792.A OG1 SER 847.A OG no hydrogen 2.686 N/A LEU 793.A N SER 789.A O no hydrogen 3.352 N/A ILE 794.A N ASP 790.A O no hydrogen 3.193 N/A ALA 795.A N GLY 791.A O no hydrogen 2.996 N/A MET 796.A N THR 792.A O no hydrogen 3.010 N/A GLY 797.A N LEU 793.A O no hydrogen 2.985 N/A LEU 798.A N ILE 794.A O no hydrogen 2.996 N/A SER 799.A N ALA 795.A O no hydrogen 3.120 N/A SER 799.A OG ALA 795.A O no hydrogen 2.710 N/A VAL 800.A N MET 796.A O no hydrogen 2.969 N/A ALA 801.A N GLY 797.A O no hydrogen 3.053 N/A VAL 802.A N LEU 798.A O no hydrogen 3.130 N/A ALA 803.A N SER 799.A O no hydrogen 2.986 N/A PHE 804.A N VAL 800.A O no hydrogen 3.021 N/A SER 805.A N ALA 801.A O no hydrogen 3.101 N/A SER 805.A OG ALA 801.A O no hydrogen 2.747 N/A SER 805.A OG VAL 802.A O no hydrogen 3.245 N/A VAL 806.A N VAL 802.A O no hydrogen 3.021 N/A MET 807.A N ALA 803.A O no hydrogen 3.292 N/A LEU 808.A N PHE 804.A O no hydrogen 3.218 N/A LEU 809.A N SER 805.A O no hydrogen 3.310 N/A THR 810.A N VAL 806.A O no hydrogen 2.830 N/A THR 810.A N MET 807.A O no hydrogen 3.192 N/A THR 810.A OG1 VAL 806.A O no hydrogen 2.641 N/A THR 811.A N MET 807.A O no hydrogen 2.955 N/A THR 811.A OG1 MET 807.A O no hydrogen 3.086 N/A ASN 813.A N THR 811.A O no hydrogen 2.723 N/A ASN 813.A ND2 CYS 948.A O no hydrogen 2.862 N/A ILE 814.A N GLY 949.A O no hydrogen 2.897 N/A ILE 815.A N ASN 813.A OD1 no hydrogen 2.967 N/A ILE 816.A N ASN 813.A OD1 no hydrogen 3.199 N/A SER 817.A N ASN 813.A O no hydrogen 3.213 N/A SER 817.A OG ASN 813.A O no hydrogen 2.739 N/A LEU 818.A N ILE 814.A O no hydrogen 2.990 N/A TYR 819.A N ILE 815.A O no hydrogen 2.964 N/A TYR 819.A OH LEU 942.A O no hydrogen 2.707 N/A ALA 820.A N ILE 816.A O no hydrogen 2.969 N/A ILE 821.A N SER 817.A O no hydrogen 3.108 N/A VAL 822.A N LEU 818.A O no hydrogen 3.060 N/A SER 823.A N TYR 819.A O no hydrogen 3.045 N/A SER 823.A OG PHE 930.A O no hydrogen 2.902 N/A ILE 824.A N ALA 820.A O no hydrogen 2.896 N/A ALA 825.A N ILE 821.A O no hydrogen 2.825 N/A GLY 826.A N VAL 822.A O no hydrogen 3.118 N/A THR 827.A N SER 823.A O no hydrogen 2.964 N/A THR 827.A OG1 SER 823.A O no hydrogen 2.799 N/A ILE 828.A N ILE 824.A O no hydrogen 2.956 N/A PHE 829.A N ALA 825.A O no hydrogen 2.987 N/A VAL 830.A N GLY 826.A O no hydrogen 3.002 N/A THR 831.A N THR 827.A O no hydrogen 2.943 N/A THR 831.A OG1 THR 827.A O no hydrogen 2.680 N/A VAL 832.A N ILE 828.A O no hydrogen 2.847 N/A GLY 833.A N PHE 829.A O no hydrogen 2.896 N/A SER 834.A N VAL 830.A O no hydrogen 3.139 N/A SER 834.A OG VAL 830.A O no hydrogen 2.640 N/A LEU 835.A N THR 831.A O no hydrogen 3.165 N/A VAL 836.A N VAL 832.A O no hydrogen 2.972 N/A LEU 837.A N GLY 833.A O no hydrogen 3.012 N/A LEU 838.A N SER 834.A O no hydrogen 2.881 N/A GLY 839.A N VAL 836.A O no hydrogen 2.940 N/A TRP 840.A N LEU 835.A O no hydrogen 2.948 N/A LEU 842.A N LYS 551.A O no hydrogen 2.830 N/A ASN 843.A N GLU 841.A O no hydrogen 2.819 N/A VAL 844.A N ASN 843.A OD1 no hydrogen 3.062 N/A SER 847.A N ASN 843.A O no hydrogen 3.121 N/A SER 847.A OG THR 792.A OG1 no hydrogen 2.686 N/A THR 849.A N LEU 845.A O no hydrogen 3.199 N/A THR 849.A OG1 LEU 845.A O no hydrogen 3.517 N/A THR 849.A OG1 GLU 846.A O no hydrogen 2.899 N/A ILE 850.A N SER 847.A O no hydrogen 3.309 N/A SER 851.A OG VAL 848.A O no hydrogen 3.076 N/A VAL 852.A N VAL 848.A O no hydrogen 3.173 N/A ALA 853.A N THR 849.A O no hydrogen 2.875 N/A VAL 854.A N SER 851.A O no hydrogen 3.162 N/A LEU 856.A N VAL 852.A O no hydrogen 3.065 N/A SER 857.A N ALA 853.A O no hydrogen 3.054 N/A SER 857.A OG ALA 853.A O no hydrogen 2.718 N/A VAL 858.A N VAL 854.A O no hydrogen 3.385 N/A ASP 859.A N LEU 856.A O no hydrogen 3.051 N/A VAL 862.A N VAL 858.A O no hydrogen 3.116 N/A HIS 863.A N ASP 859.A O no hydrogen 3.277 N/A TYR 864.A N PHE 860.A O no hydrogen 3.036 N/A TYR 864.A OH THR 932.A OG1 no hydrogen 2.852 N/A GLY 865.A N ALA 861.A O no hydrogen 2.889 N/A VAL 866.A N VAL 862.A O no hydrogen 2.934 N/A ALA 867.A N HIS 863.A O no hydrogen 3.259 N/A TYR 868.A N TYR 864.A O no hydrogen 2.983 N/A TYR 868.A OH PRO 944.A O no hydrogen 2.739 N/A ARG 869.A N GLY 865.A O no hydrogen 3.401 N/A LEU 870.A N VAL 866.A O no hydrogen 2.992 N/A ALA 871.A N TYR 868.A O no hydrogen 3.444 N/A ARG 876.A NH1 GLY 943.A O no hydrogen 3.101 N/A GLY 878.A N ASP 875.A OD2 no hydrogen 2.905 N/A LYS 879.A N ASP 875.A O no hydrogen 3.051 N/A LYS 879.A NZ ASP 873.A O no hydrogen 2.815 N/A VAL 880.A N ARG 876.A O no hydrogen 3.112 N/A ILE 881.A N GLU 877.A O no hydrogen 2.973 N/A PHE 882.A N GLY 878.A O no hydrogen 2.880 N/A SER 883.A N LYS 879.A O no hydrogen 2.998 N/A SER 883.A OG TYR 864.A O no hydrogen 2.785 N/A LEU 884.A N VAL 880.A O no hydrogen 2.942 N/A SER 885.A N ILE 881.A O no hydrogen 3.010 N/A SER 885.A OG ILE 881.A O no hydrogen 2.988 N/A SER 885.A OG PHE 882.A O no hydrogen 3.166 N/A ARG 886.A N PHE 882.A O no hydrogen 2.890 N/A MET 887.A N SER 883.A O no hydrogen 3.082 N/A GLY 888.A N LEU 884.A O no hydrogen 2.856 N/A ILE 891.A N MET 887.A O no hydrogen 3.075 N/A ALA 892.A N GLY 888.A O no hydrogen 2.985 N/A MET 893.A N SER 889.A O no hydrogen 3.019 N/A ALA 894.A N ALA 890.A O no hydrogen 2.934 N/A ALA 895.A N ILE 891.A O no hydrogen 2.994 N/A LEU 896.A N ALA 892.A O no hydrogen 2.866 N/A THR 897.A N MET 893.A O no hydrogen 3.001 N/A THR 897.A OG1 GLY 391.A O no hydrogen 3.333 N/A THR 897.A OG1 ASP 395.A OD1 no hydrogen 3.112 N/A THR 897.A OG1 MET 893.A O no hydrogen 2.900 N/A THR 897.A OG1 ALA 894.A O no hydrogen 2.836 N/A THR 898.A N ALA 894.A O no hydrogen 3.355 N/A THR 898.A OG1 GLY 391.A O no hydrogen 2.966 N/A THR 898.A OG1 ASP 395.A OD2 no hydrogen 3.401 N/A THR 898.A OG1 ALA 894.A O no hydrogen 3.053 N/A PHE 899.A N ALA 895.A O no hydrogen 2.883 N/A VAL 900.A N LEU 896.A O no hydrogen 2.905 N/A ALA 901.A N THR 897.A O no hydrogen 3.175 N/A GLY 902.A N THR 898.A O no hydrogen 3.193 N/A ALA 903.A N PHE 899.A O no hydrogen 2.913 N/A MET 904.A N VAL 900.A O no hydrogen 3.149 N/A MET 905.A N GLY 902.A O no hydrogen 3.026 N/A MET 906.A N ALA 903.A O no hydrogen 3.266 N/A SER 908.A N MET 905.A O no hydrogen 3.141 N/A SER 908.A OG ASP 326.A OD2 no hydrogen 2.564 N/A SER 908.A OG VAL 910.A O no hydrogen 3.531 N/A THR 909.A N ASP 326.A OD2 no hydrogen 2.806 N/A VAL 910.A N ASP 326.A OD2 no hydrogen 3.438 N/A VAL 910.A N SER 908.A OG no hydrogen 3.274 N/A LEU 911.A N VAL 562.A O no hydrogen 3.469 N/A TYR 913.A OH LEU 323.A O no hydrogen 2.898 N/A THR 914.A N VAL 910.A O no hydrogen 3.382 N/A THR 914.A OG1 LEU 911.A O no hydrogen 3.116 N/A GLN 915.A N LEU 911.A O no hydrogen 2.945 N/A LEU 916.A N ALA 912.A O no hydrogen 3.121 N/A GLY 917.A N TYR 913.A O no hydrogen 3.044 N/A THR 918.A N THR 914.A O no hydrogen 2.951 N/A THR 918.A OG1 THR 914.A O no hydrogen 3.212 N/A PHE 919.A N GLN 915.A O no hydrogen 3.029 N/A MET 920.A N LEU 916.A O no hydrogen 2.945 N/A MET 921.A N GLY 917.A O no hydrogen 3.122 N/A LEU 922.A N THR 918.A O no hydrogen 3.100 N/A VAL 923.A N PHE 919.A O no hydrogen 2.899 N/A MET 924.A N MET 920.A O no hydrogen 3.441 N/A CYS 925.A N MET 921.A O no hydrogen 3.129 N/A CYS 925.A SG MET 921.A O no hydrogen 3.333 N/A VAL 926.A N LEU 922.A O no hydrogen 3.051 N/A SER 927.A N VAL 923.A O no hydrogen 2.922 N/A TRP 928.A N MET 924.A O no hydrogen 2.927 N/A ALA 929.A N CYS 925.A O no hydrogen 3.147 N/A PHE 930.A N VAL 926.A O no hydrogen 2.977 N/A ALA 931.A N SER 927.A O no hydrogen 3.049 N/A THR 932.A N TRP 928.A O no hydrogen 2.911 N/A THR 932.A OG1 TYR 864.A OH no hydrogen 2.852 N/A THR 932.A OG1 TRP 928.A O no hydrogen 2.920 N/A PHE 933.A N ALA 929.A O no hydrogen 2.940 N/A PHE 935.A N PHE 930.A O no hydrogen 2.996 N/A GLN 936.A NE2 SER 883.A OG no hydrogen 3.008 N/A CYS 937.A N PHE 933.A O no hydrogen 2.913 N/A CYS 937.A SG VAL 522.A O no hydrogen 3.522 N/A CYS 937.A SG PHE 933.A O no hydrogen 3.031 N/A LEU 938.A N PHE 934.A O no hydrogen 3.028 N/A CYS 939.A N PHE 935.A O no hydrogen 3.073 N/A CYS 939.A SG PHE 935.A O no hydrogen 3.372 N/A ARG 940.A N GLN 936.A O no hydrogen 2.852 N/A ARG 940.A NE GLU 877.A OE2 no hydrogen 2.888 N/A ARG 940.A NH1 ARG 940.A O no hydrogen 2.990 N/A ARG 940.A NH2 GLU 877.A OE2 no hydrogen 3.106 N/A CYS 941.A N CYS 937.A O no hydrogen 2.969 N/A CYS 941.A SG CYS 937.A O no hydrogen 3.277 N/A LEU 942.A N LEU 938.A O no hydrogen 2.961 N/A GLY 943.A N CYS 939.A O no hydrogen 2.859 N/A GLN 945.A NE2 PRO 874.A O no hydrogen 3.645 N/A CYS 948.A N GLN 945.A O no hydrogen 3.281 N/A GLN 950.A N THR 947.A O no hydrogen 3.113 N/A ILE 951.A N TRP 812.A O no hydrogen 2.845 N/A