Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cu6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N GLU 5.A OE1 no hydrogen 3.253 N/A GLU 5.A N THR 2.A OG1 no hydrogen 3.176 N/A VAL 6.A N THR 2.A O no hydrogen 3.078 N/A ASN 7.A N ASN 3.A O no hydrogen 3.007 N/A GLN 8.A N GLU 4.A O no hydrogen 3.074 N/A GLN 8.A NE2 ASP 12.A OD1 no hydrogen 2.691 N/A MET 9.A N GLU 5.A O no hydrogen 2.901 N/A ILE 10.A N VAL 6.A O no hydrogen 3.081 N/A GLU 11.A N ASN 7.A O no hydrogen 2.997 N/A ASP 12.A N GLN 8.A O no hydrogen 2.733 N/A ARG 13.A N MET 9.A O no hydrogen 2.992 N/A ARG 13.A N ILE 10.A O no hydrogen 3.235 N/A ARG 13.A NE ASP 279.A OD1 no hydrogen 3.058 N/A ARG 13.A NH2 VAL 172.A O no hydrogen 2.946 N/A ARG 13.A NH2 ASP 279.A OD2 no hydrogen 2.786 N/A VAL 15.A N LEU 164.A O no hydrogen 3.028 N/A PHE 17.A N VAL 162.A O no hydrogen 3.071 N/A ASN 18.A N ASP 16.A OD1 no hydrogen 2.753 N/A ASN 18.A ND2 ASP 161.A OD1 no hydrogen 2.900 N/A ASN 20.A N ASP 46.A OD1 no hydrogen 3.070 N/A TRP 21.A N LEU 45.A O no hydrogen 2.901 N/A TRP 21.A NE1 PHE 17.A O no hydrogen 2.867 N/A TYR 22.A N ARG 78.A O no hydrogen 2.829 N/A PHE 23.A N LYS 43.A O no hydrogen 2.753 N/A LYS 24.A N TRP 76.A O no hydrogen 3.082 N/A LYS 24.A NZ THR 41.A OG1 no hydrogen 3.325 N/A ASN 26.A N GLU 74.A O no hydrogen 3.065 N/A ALA 32.A N ASN 28.A O no hydrogen 2.984 N/A ILE 33.A N SER 29.A O no hydrogen 3.278 N/A LYS 34.A N LYS 30.A O no hydrogen 3.315 N/A SER 40.A N ASP 38.A OD1 no hydrogen 3.073 N/A SER 40.A OG ASP 38.A OD1 no hydrogen 2.484 N/A SER 40.A OG ASP 38.A OD2 no hydrogen 3.446 N/A TRP 42.A N VAL 39.A O no hydrogen 3.039 N/A LYS 43.A N PHE 23.A O no hydrogen 2.727 N/A LYS 44.A NZ TYR 22.A OH no hydrogen 3.151 N/A LEU 45.A N TRP 21.A O no hydrogen 2.896 N/A LEU 47.A N ASN 18.A O no hydrogen 2.736 N/A TYR 49.A N ILE 158.A O no hydrogen 2.901 N/A TRP 51.A N SER 156.A O no hydrogen 3.296 N/A TRP 51.A NE1 GLY 72.A O no hydrogen 2.786 N/A SER 52.A N ASP 50.A OD1 no hydrogen 3.053 N/A SER 52.A OG ASN 71.A O no hydrogen 2.725 N/A SER 52.A OG SER 156.A OG no hydrogen 2.768 N/A ASN 55.A N SER 52.A O no hydrogen 3.154 N/A ASP 58.A N GLN 69.A O no hydrogen 2.970 N/A HIS 59.A ND1 ASN 587.A O no hydrogen 2.722 N/A GLU 60.A N ASP 58.A OD1 no hydrogen 2.855 N/A SER 61.A N ASP 58.A O no hydrogen 2.987 N/A SER 61.A OG ASN 71.A OD1 no hydrogen 2.282 N/A ALA 63.A N SER 61.A OG no hydrogen 3.331 N/A GLN 64.A N SER 61.A O no hydrogen 3.170 N/A ASN 65.A N ASN 587.A OD1 no hydrogen 3.144 N/A ASN 65.A ND2 TRP 583.A O no hydrogen 3.160 N/A GLU 66.A N ASN 585.A OD1 no hydrogen 3.287 N/A GLY 67.A N GLN 64.A O no hydrogen 3.170 N/A GLY 68.A N ASN 65.A O no hydrogen 3.057 N/A GLN 69.A N GLN 64.A O no hydrogen 3.027 N/A GLN 69.A NE2 ASN 587.A O no hydrogen 3.118 N/A GLN 69.A NE2 ASN 587.A OD1 no hydrogen 3.644 N/A ASN 71.A ND2 ASP 58.A OD2 no hydrogen 3.089 N/A GLY 73.A N ASN 145.A O no hydrogen 2.778 N/A ALA 75.A N ALA 143.A O no hydrogen 3.071 N/A TRP 76.A N LYS 24.A O no hydrogen 3.048 N/A TYR 77.A N VAL 141.A O no hydrogen 2.828 N/A TYR 77.A OH TYR 49.A O no hydrogen 3.082 N/A ARG 78.A N TYR 22.A O no hydrogen 2.768 N/A ARG 78.A NE ALA 32.A O no hydrogen 2.646 N/A ARG 78.A NH2 LYS 34.A O no hydrogen 2.365 N/A ARG 78.A NH2 PRO 35.A O no hydrogen 3.345 N/A LYS 79.A N ILE 139.A O no hydrogen 2.842 N/A LYS 79.A NZ PHE 17.A O no hydrogen 3.549 N/A PHE 81.A N ASN 137.A O no hydrogen 2.954 N/A ASP 87.A N ASP 84.A O no hydrogen 2.984 N/A LEU 88.A N GLU 85.A O no hydrogen 3.305 N/A LYS 90.A N ASP 87.A O no hydrogen 3.087 N/A ASN 91.A N THR 167.A O no hydrogen 2.711 N/A ASN 91.A ND2 ASP 125.A OD2 no hydrogen 2.982 N/A VAL 92.A N THR 127.A OG1 no hydrogen 2.770 N/A ARG 93.A N GLN 165.A O no hydrogen 2.944 N/A ARG 93.A NH1 SER 123.A OG no hydrogen 3.043 N/A ARG 93.A NH1 GLU 394.A OE1 no hydrogen 2.918 N/A ARG 93.A NH2 GLU 173.A OE1 no hydrogen 3.255 N/A ARG 93.A NH2 GLU 394.A OE1 no hydrogen 3.363 N/A ARG 93.A NH2 GLU 394.A OE2 no hydrogen 2.581 N/A LEU 94.A N TYR 124.A O no hydrogen 2.958 N/A THR 95.A N THR 163.A O no hydrogen 2.752 N/A PHE 96.A N PHE 122.A O no hydrogen 2.687 N/A ASP 97.A N ASP 161.A O no hydrogen 2.970 N/A TYR 100.A N GLY 157.A O no hydrogen 3.021 N/A TYR 100.A OH SER 149.A OG no hydrogen 2.091 N/A MET 101.A N VAL 144.A O no hydrogen 3.213 N/A ASP 102.A N PRO 116.A O no hydrogen 3.016 N/A SER 103.A N TYR 115.A O no hydrogen 2.901 N/A SER 103.A OG TYR 115.A O no hydrogen 3.194 N/A GLN 104.A N HIS 142.A O no hydrogen 2.964 N/A VAL 105.A N GLY 113.A O no hydrogen 3.178 N/A TYR 106.A N ALA 140.A O no hydrogen 2.880 N/A VAL 107.A N GLN 110.A O no hydrogen 2.931 N/A ASN 108.A N VAL 138.A O no hydrogen 2.761 N/A ASN 108.A ND2 TYR 129.A O no hydrogen 2.678 N/A GLN 110.A N VAL 107.A O no hydrogen 3.252 N/A VAL 112.A N VAL 105.A O no hydrogen 2.854 N/A HIS 114.A NE2 ASP 102.A OD1 no hydrogen 2.853 N/A TYR 115.A N SER 103.A O no hydrogen 2.910 N/A TYR 115.A OH ASP 405.A OD1 no hydrogen 2.669 N/A ASN 117.A ND2 ASP 405.A OD2 no hydrogen 3.128 N/A TYR 119.A N ASN 117.A OD1 no hydrogen 2.935 N/A ASN 120.A N ASN 117.A OD1 no hydrogen 2.986 N/A ASN 120.A ND2 TYR 115.A OH no hydrogen 3.010 N/A ASN 120.A ND2 ASP 405.A O no hydrogen 3.170 N/A ASN 120.A ND2 THR 408.A OG1 no hydrogen 3.071 N/A GLN 121.A NE2 ASP 97.A OD1 no hydrogen 3.290 N/A PHE 122.A N PHE 96.A O no hydrogen 2.954 N/A TYR 124.A N LEU 94.A O no hydrogen 2.925 N/A ILE 126.A N VAL 92.A O no hydrogen 2.868 N/A THR 127.A N ASP 125.A OD1 no hydrogen 3.036 N/A THR 127.A OG1 VAL 92.A O no hydrogen 3.439 N/A THR 127.A OG1 ASP 125.A OD1 no hydrogen 2.535 N/A TYR 129.A N ILE 126.A O no hydrogen 3.111 N/A LEU 130.A N THR 127.A O no hydrogen 3.191 N/A ASN 137.A N PHE 81.A O no hydrogen 2.856 N/A VAL 138.A N ASN 108.A OD1 no hydrogen 2.959 N/A ILE 139.A N LYS 79.A O no hydrogen 2.738 N/A ALA 140.A N TYR 106.A O no hydrogen 2.869 N/A VAL 141.A N TYR 77.A O no hydrogen 2.729 N/A HIS 142.A N GLN 104.A O no hydrogen 2.868 N/A ALA 143.A N ALA 75.A O no hydrogen 3.016 N/A VAL 144.A N MET 101.A O no hydrogen 3.034 N/A ASN 145.A N GLY 73.A O no hydrogen 2.901 N/A ASN 145.A ND2 SER 156.A OG no hydrogen 3.143 N/A GLN 147.A NE2 LEU 70.A O no hydrogen 3.030 N/A SER 149.A OG TYR 100.A OH no hydrogen 2.091 N/A SER 149.A OG ASN 145.A OD1 no hydrogen 3.258 N/A SER 150.A OG TRP 152.A O no hydrogen 2.775 N/A ARG 151.A NE ASP 371.A OD2 no hydrogen 2.887 N/A ARG 151.A NH2 ASP 371.A OD1 no hydrogen 3.146 N/A TYR 153.A N ILE 577.A O no hydrogen 3.104 N/A TYR 153.A OH ASP 50.A OD2 no hydrogen 2.498 N/A SER 154.A OG GLY 155.A O no hydrogen 2.872 N/A SER 156.A N ASP 50.A OD1 no hydrogen 2.827 N/A SER 156.A OG SER 52.A OG no hydrogen 2.768 N/A GLY 157.A N TYR 100.A O no hydrogen 2.890 N/A ILE 158.A N TYR 77.A OH no hydrogen 3.227 N/A TYR 159.A OH GLY 118.A O no hydrogen 2.492 N/A ARG 160.A NH1 ASP 97.A O no hydrogen 3.168 N/A ARG 160.A NH1 TYR 119.A O no hydrogen 2.566 N/A ARG 160.A NH2 PRO 349.A O no hydrogen 2.872 N/A VAL 162.A N ASN 18.A OD1 no hydrogen 2.925 N/A THR 163.A N THR 95.A O no hydrogen 2.919 N/A LEU 164.A N VAL 15.A O no hydrogen 3.151 N/A GLN 165.A N ARG 93.A O no hydrogen 2.778 N/A VAL 166.A N ARG 13.A O no hydrogen 2.996 N/A THR 167.A N ASN 91.A O no hydrogen 2.992 N/A THR 167.A OG1 ASP 168.A O no hydrogen 3.486 N/A VAL 170.A N ASP 168.A OD2 no hydrogen 3.211 N/A HIS 171.A N VAL 201.A O no hydrogen 3.247 N/A HIS 171.A ND1 ASP 168.A O no hydrogen 2.706 N/A VAL 172.A N ASP 279.A OD2 no hydrogen 3.036 N/A GLU 173.A N LYS 199.A O no hydrogen 3.043 N/A LYS 174.A N GLU 173.A OE1 no hydrogen 2.836 N/A LYS 174.A NZ THR 95.A OG1 no hydrogen 3.397 N/A THR 177.A OG1 ASP 283.A OD2 no hydrogen 2.815 N/A THR 178.A N THR 197.A O no hydrogen 3.081 N/A ILE 179.A N ASN 415.A OD1 no hydrogen 2.788 N/A LEU 180.A N HIS 195.A O no hydrogen 2.912 N/A LEU 184.A N THR 181.A O no hydrogen 3.433 N/A GLN 187.A N LYS 183.A O no hydrogen 2.846 N/A GLN 187.A NE2 GLU 193.A OE1 no hydrogen 2.948 N/A GLY 190.A N GLN 187.A O no hydrogen 2.798 N/A VAL 192.A N VAL 249.A O no hydrogen 2.703 N/A GLU 193.A N GLN 187.A OE1 no hydrogen 2.740 N/A THR 194.A N LEU 247.A O no hydrogen 2.718 N/A THR 194.A OG1 TYR 287.A OH no hydrogen 3.022 N/A HIS 195.A N LEU 180.A O no hydrogen 2.806 N/A VAL 196.A N ALA 245.A O no hydrogen 2.997 N/A THR 197.A N THR 178.A O no hydrogen 2.786 N/A THR 197.A OG1 ASP 244.A OD1 no hydrogen 3.384 N/A SER 198.A N LEU 243.A O no hydrogen 2.741 N/A ILE 200.A N THR 241.A O no hydrogen 2.960 N/A VAL 201.A N HIS 171.A O no hydrogen 3.024 N/A ASN 202.A N GLU 239.A O no hydrogen 2.858 N/A ASN 202.A ND2 LYS 206.A O no hydrogen 3.008 N/A ASN 202.A ND2 LEU 235.A O no hydrogen 3.336 N/A ASN 202.A ND2 LYS 236.A O no hydrogen 3.291 N/A THR 203.A N LYS 169.A O no hydrogen 2.909 N/A THR 203.A OG1 LYS 169.A O no hydrogen 2.723 N/A ASP 204.A N ASN 202.A OD1 no hydrogen 2.910 N/A HIS 208.A N LEU 235.A O no hydrogen 3.113 N/A HIS 208.A ND1 ASP 274.A OD2 no hydrogen 3.081 N/A HIS 208.A NE2 ASP 204.A OD2 no hydrogen 2.610 N/A GLU 209.A N ASP 274.A OD1 no hydrogen 2.989 N/A LEU 210.A N ARG 233.A O no hydrogen 2.742 N/A ALA 212.A N THR 230.A OG1 no hydrogen 2.956 N/A GLU 213.A N ARG 270.A O no hydrogen 2.844 N/A TYR 214.A N VAL 228.A O no hydrogen 2.880 N/A GLN 215.A N ILE 268.A O no hydrogen 3.014 N/A GLN 215.A NE2 THR 225.A O no hydrogen 2.883 N/A ILE 216.A N THR 225.A OG1 no hydrogen 2.969 N/A VAL 217.A N GLU 266.A O no hydrogen 3.056 N/A GLU 218.A N HIS 222.A O no hydrogen 2.828 N/A ARG 219.A N LEU 264.A O no hydrogen 2.998 N/A ARG 219.A NH2 GLU 360.A OE2 no hydrogen 2.841 N/A HIS 222.A N GLU 218.A OE1 no hydrogen 3.305 N/A VAL 224.A N ILE 216.A O no hydrogen 2.842 N/A THR 225.A OG1 GLY 226.A O no hydrogen 2.736 N/A VAL 228.A N TYR 214.A O no hydrogen 2.911 N/A ARG 229.A NE GLU 213.A OE2 no hydrogen 2.595 N/A ARG 229.A NH2 GLU 213.A OE2 no hydrogen 3.460 N/A THR 230.A N ALA 212.A O no hydrogen 2.809 N/A ARG 233.A N LEU 210.A O no hydrogen 3.162 N/A THR 234.A OG1 GLU 209.A OE2 no hydrogen 1.983 N/A LEU 235.A N HIS 208.A O no hydrogen 2.872 N/A ALA 237.A N ASP 207.A OD1 no hydrogen 2.688 N/A GLU 239.A N LYS 236.A O no hydrogen 3.254 N/A THR 241.A N ILE 200.A O no hydrogen 2.953 N/A LEU 243.A N SER 198.A O no hydrogen 2.302 N/A ALA 245.A N VAL 196.A O no hydrogen 3.202 N/A LEU 247.A N THR 194.A O no hydrogen 2.975 N/A VAL 249.A N VAL 192.A O no hydrogen 3.066 N/A ARG 251.A N GLY 190.A O no hydrogen 2.766 N/A LYS 253.A N TYR 265.A OH no hydrogen 3.057 N/A LYS 253.A NZ GLU 218.A OE2 no hydrogen 3.223 N/A TRP 255.A N TYR 287.A O no hydrogen 2.802 N/A TRP 255.A NE1 ALA 359.A O no hydrogen 2.842 N/A LEU 258.A N THR 256.A OG1 no hydrogen 3.019 N/A LYS 261.A N ASN 259.A OD1 no hydrogen 2.982 N/A TYR 265.A N PHE 285.A O no hydrogen 2.842 N/A GLU 266.A N VAL 217.A O no hydrogen 2.858 N/A LEU 267.A N ASP 283.A O no hydrogen 2.907 N/A ILE 268.A N GLN 215.A O no hydrogen 2.738 N/A THR 269.A N LYS 281.A O no hydrogen 2.892 N/A ARG 270.A N GLU 213.A O no hydrogen 2.718 N/A ARG 270.A NH1 GLU 213.A OE1 no hydrogen 3.023 N/A VAL 271.A N ASP 279.A O no hydrogen 2.766 N/A TYR 272.A N VAL 211.A O no hydrogen 2.992 N/A TYR 272.A OH GLU 213.A OE1 no hydrogen 2.445 N/A ARG 273.A N GLN 276.A O no hydrogen 2.763 N/A ASP 274.A N GLU 209.A O no hydrogen 2.763 N/A GLN 276.A N ARG 273.A O no hydrogen 3.147 N/A VAL 278.A N VAL 271.A O no hydrogen 2.763 N/A ASP 279.A N VAL 271.A O no hydrogen 3.203 N/A LYS 281.A N THR 269.A O no hydrogen 2.959 N/A LYS 281.A NZ LYS 282.A O no hydrogen 3.312 N/A LYS 281.A NZ ASP 283.A OD1 no hydrogen 2.999 N/A LYS 281.A NZ ASP 283.A OD2 no hydrogen 3.063 N/A ASP 283.A N LEU 267.A O no hydrogen 2.860 N/A PHE 285.A N TYR 265.A O no hydrogen 2.901 N/A TYR 287.A OH THR 194.A OG1 no hydrogen 3.022 N/A ARG 288.A NH1 PRO 417.A O no hydrogen 2.460 N/A ARG 288.A NH1 ILE 419.A O no hydrogen 3.113 N/A TYR 289.A N ASN 301.A OD1 no hydrogen 2.981 N/A TYR 289.A OH GLN 188.A OE1 no hydrogen 3.144 N/A TYR 290.A OH THR 454.A O no hydrogen 3.025 N/A HIS 291.A N SER 299.A O no hydrogen 3.019 N/A THR 293.A N GLY 297.A O no hydrogen 2.786 N/A THR 293.A OG1 GLU 296.A OE1 no hydrogen 3.149 N/A GLY 297.A N THR 293.A O no hydrogen 3.076 N/A SER 299.A N HIS 291.A O no hydrogen 2.879 N/A SER 299.A OG HIS 291.A O no hydrogen 3.554 N/A LEU 300.A N GLU 303.A O.A no hydrogen 2.700 N/A LEU 300.A N GLU 303.A O.B no hydrogen 2.700 N/A ASN 301.A N TYR 289.A O no hydrogen 2.777 N/A ASN 301.A ND2 TRP 255.A O no hydrogen 2.983 N/A GLU 303.A N.A LEU 300.A O no hydrogen 2.983 N/A GLU 303.A N.B LEU 300.A O no hydrogen 2.982 N/A ILE 305.A N PHE 298.A O no hydrogen 3.196 N/A LYS 306.A NZ ASP 559.A O no hydrogen 2.735 N/A LYS 306.A NZ ASP 559.A OD1 no hydrogen 3.067 N/A LYS 306.A NZ ASN 562.A O no hydrogen 2.722 N/A PHE 307.A N ALA 566.A O no hydrogen 3.025 N/A HIS 308.A N ASN 341.A OD1 no hydrogen 2.812 N/A VAL 310.A N SER 342.A O no hydrogen 3.056 N/A SER 311.A N ILE 570.A O no hydrogen 2.798 N/A SER 311.A OG PHE 569.A O no hydrogen 3.426 N/A LEU 312.A N ARG 344.A O no hydrogen 3.163 N/A HIS 314.A NE2 SER 154.A O no hydrogen 3.043 N/A HIS 316.A N GLY 320.A O no hydrogen 2.794 N/A HIS 316.A NE2 GLU 323.A OE1 no hydrogen 2.416 N/A GLY 317.A N ASP 315.A OD1 no hydrogen 3.162 N/A LEU 319.A N HIS 316.A O no hydrogen 3.364 N/A GLY 320.A N GLY 317.A O no hydrogen 2.771 N/A ALA 321.A N ASP 50.A OD2 no hydrogen 2.958 N/A GLU 322.A N LEU 319.A O no hydrogen 3.249 N/A GLU 323.A N TYR 159.A O no hydrogen 2.912 N/A ASN 324.A N GLU 323.A OE1 no hydrogen 3.011 N/A ASN 324.A ND2 LYS 747.A O no hydrogen 2.992 N/A TYR 325.A OH GLU 360.A OE1 no hydrogen 2.665 N/A LYS 326.A NZ ASP 739.A OD2 no hydrogen 3.028 N/A LYS 326.A NZ ASP 748.A OD1 no hydrogen 3.560 N/A LYS 326.A NZ LEU 749.A O no hydrogen 2.710 N/A ALA 327.A N ASN 324.A OD1 no hydrogen 3.113 N/A GLU 328.A N ASN 324.A O no hydrogen 2.975 N/A TYR 329.A N TYR 325.A O no hydrogen 2.822 N/A ARG 330.A N LYS 326.A O no hydrogen 2.990 N/A ARG 330.A NH2 ALA 602.A O no hydrogen 3.199 N/A ARG 331.A N ALA 327.A O no hydrogen 3.107 N/A ARG 331.A NE GLU 328.A OE1 no hydrogen 2.996 N/A ARG 331.A NH1 HIS 313.A O no hydrogen 2.810 N/A ARG 331.A NH1 THR 574.A OG1 no hydrogen 3.272 N/A ARG 331.A NH2 HIS 313.A O no hydrogen 2.635 N/A ARG 331.A NH2 GLU 328.A OE1 no hydrogen 3.373 N/A LEU 332.A N GLU 328.A O no hydrogen 2.925 N/A LYS 333.A N TYR 329.A O no hydrogen 2.758 N/A GLN 334.A N ARG 330.A O no hydrogen 3.041 N/A GLN 334.A NE2 GLY 603.A O no hydrogen 3.026 N/A MET 335.A N ARG 331.A O no hydrogen 2.985 N/A LYS 336.A N LEU 332.A O no hydrogen 2.984 N/A LYS 336.A NZ VAL 257.A O no hydrogen 2.833 N/A LYS 336.A NZ LEU 361.A O no hydrogen 3.191 N/A LYS 336.A NZ GLY 362.A O no hydrogen 2.494 N/A GLU 337.A N.A LYS 333.A O no hydrogen 2.968 N/A GLU 337.A N.B LYS 333.A O no hydrogen 3.004 N/A MET 338.A N MET 335.A O no hydrogen 3.164 N/A GLY 339.A N LYS 336.A O no hydrogen 3.182 N/A VAL 340.A N MET 335.A O no hydrogen 3.293 N/A ASN 341.A N HIS 308.A O no hydrogen 2.839 N/A ASN 341.A ND2 LYS 306.A O no hydrogen 2.945 N/A SER 342.A OG ASN 341.A OD1 no hydrogen 2.734 N/A ILE 343.A N LEU 364.A O no hydrogen 2.918 N/A ARG 344.A N VAL 310.A O no hydrogen 2.904 N/A ARG 344.A NH1 GLU 508.A OE1 no hydrogen 2.926 N/A ARG 344.A NH2 GLU 368.A OE2 no hydrogen 2.713 N/A ARG 344.A NH2 ASN 426.A OD1 no hydrogen 2.836 N/A THR 345.A N GLN 366.A O no hydrogen 2.821 N/A THR 345.A OG1 ASN 348.A O no hydrogen 3.359 N/A THR 345.A OG1 GLN 366.A O no hydrogen 3.476 N/A THR 346.A N ARG 344.A O no hydrogen 2.995 N/A THR 346.A OG1 LEU 312.A O no hydrogen 3.321 N/A HIS 347.A ND1 GLU 368.A OE1 no hydrogen 2.699 N/A ASN 348.A N THR 345.A O no hydrogen 3.077 N/A ALA 350.A N GLU 367.A OE2 no hydrogen 2.791 N/A SER 351.A OG GLU 323.A OE2 no hydrogen 2.760 N/A SER 351.A OG THR 354.A OG1 no hydrogen 3.195 N/A GLN 353.A N GLN 353.A OE1 no hydrogen 2.868 N/A GLN 353.A NE2 ASP 161.A OD2 no hydrogen 3.034 N/A THR 354.A N SER 351.A OG no hydrogen 3.119 N/A THR 354.A OG1 GLU 323.A OE2 no hydrogen 3.464 N/A THR 354.A OG1 GLU 328.A OE2 no hydrogen 2.504 N/A THR 354.A OG1 SER 351.A OG no hydrogen 3.195 N/A LEU 355.A N SER 351.A O no hydrogen 3.270 N/A GLN 356.A N GLU 352.A O no hydrogen 3.073 N/A ILE 357.A N GLN 353.A O no hydrogen 2.930 N/A ALA 358.A N THR 354.A O no hydrogen 3.046 N/A ALA 359.A N LEU 355.A O no hydrogen 3.170 N/A GLU 360.A N GLN 356.A O no hydrogen 2.947 N/A LEU 361.A N ILE 357.A O no hydrogen 2.820 N/A LEU 363.A N ALA 358.A O no hydrogen 3.008 N/A LEU 364.A N ASN 341.A O no hydrogen 2.794 N/A VAL 365.A N ALA 418.A O no hydrogen 2.723 N/A GLN 366.A N ILE 343.A O no hydrogen 2.929 N/A GLU 367.A N MET 421.A O no hydrogen 3.268 N/A GLU 368.A N THR 345.A OG1 no hydrogen 3.257 N/A ALA 369.A N SER 423.A O no hydrogen 2.888 N/A TRP 373.A N GLU 430.A OE2 no hydrogen 3.048 N/A TRP 373.A NE1 ILE 424.A O no hydrogen 2.906 N/A GLY 375.A N GLU 430.A OE2 no hydrogen 2.735 N/A GLY 376.A N THR 372.A OG1 no hydrogen 3.043 N/A LYS 377.A N ASP 381.A OD2 no hydrogen 2.829 N/A LYS 377.A NZ ASP 371.A O no hydrogen 2.243 N/A LYS 377.A NZ ASP 371.A OD1 no hydrogen 3.126 N/A LYS 377.A NZ ASN 426.A O no hydrogen 2.698 N/A LYS 377.A NZ GLU 427.A O no hydrogen 3.167 N/A LYS 378.A N ASP 381.A OD2 no hydrogen 2.987 N/A LYS 378.A NZ GLU 66.A OE2 no hydrogen 3.067 N/A TYR 380.A N PRO 148.A O no hydrogen 3.113 N/A ASP 381.A N LYS 378.A O no hydrogen 3.300 N/A TYR 382.A OH ASP 405.A OD2 no hydrogen 2.506 N/A GLY 383.A N ASP 381.A OD1 no hydrogen 2.819 N/A ARG 384.A NE ASP 381.A O no hydrogen 2.910 N/A ARG 384.A NH2 TYR 380.A O no hydrogen 2.716 N/A PHE 385.A N TYR 382.A O no hydrogen 2.808 N/A PHE 386.A N GLY 383.A O no hydrogen 3.289 N/A LYS 388.A N PHE 385.A O no hydrogen 3.000 N/A LYS 388.A NZ ARG 384.A O no hydrogen 3.500 N/A ALA 390.A N GLU 399.A O no hydrogen 2.944 N/A HIS 392.A NE2 SER 123.A O no hydrogen 2.845 N/A GLU 394.A N HIS 392.A ND1 no hydrogen 3.120 N/A ALA 395.A N HIS 392.A O no hydrogen 3.046 N/A ARG 396.A N GLU 399.A OE1 no hydrogen 2.712 N/A GLU 399.A N ARG 396.A O no hydrogen 3.188 N/A LYS 400.A N ASP 403.A OD2 no hydrogen 3.228 N/A TRP 401.A N LYS 388.A O no hydrogen 2.817 N/A SER 402.A N PHE 386.A O no hydrogen 3.309 N/A SER 402.A OG PHE 386.A O no hydrogen 2.759 N/A PHE 404.A N LYS 400.A O no hydrogen 2.938 N/A ASP 405.A N TRP 401.A O no hydrogen 2.805 N/A LEU 406.A N SER 402.A O no hydrogen 3.083 N/A ARG 407.A N ASP 403.A O no hydrogen 2.950 N/A ARG 407.A NE GLU 399.A OE2 no hydrogen 3.077 N/A ARG 407.A NH1 GLU 411.A OE1 no hydrogen 3.473 N/A ARG 407.A NH2 GLU 399.A OE1 no hydrogen 3.153 N/A ARG 407.A NH2 GLU 399.A OE2 no hydrogen 3.283 N/A THR 408.A N PHE 404.A O no hydrogen 2.951 N/A THR 408.A OG1 PHE 404.A O no hydrogen 2.792 N/A THR 408.A OG1 ASP 405.A O no hydrogen 3.276 N/A MET 409.A N ASP 405.A O no hydrogen 3.151 N/A VAL 410.A N LEU 406.A O no hydrogen 3.172 N/A GLU 411.A N ARG 407.A O no hydrogen 3.003 N/A ARG 412.A N THR 408.A O no hydrogen 3.034 N/A ARG 412.A NH1 GLU 352.A OE2 no hydrogen 3.152 N/A ARG 412.A NH2 ALA 350.A O no hydrogen 2.864 N/A ARG 412.A NH2 GLU 367.A OE2 no hydrogen 2.907 N/A GLY 413.A N MET 409.A O no hydrogen 3.218 N/A LYS 414.A NZ ASN 175.A O no hydrogen 2.809 N/A ASN 415.A ND2 THR 177.A O no hydrogen 2.656 N/A ASN 416.A N GLY 413.A O no hydrogen 3.034 N/A ASN 416.A ND2 LEU 355.A O no hydrogen 3.184 N/A ALA 418.A N ASN 416.A OD1 no hydrogen 2.783 N/A ILE 419.A N ASN 416.A O no hydrogen 3.274 N/A PHE 420.A N VAL 365.A O no hydrogen 3.120 N/A TRP 422.A N TYR 456.A O no hydrogen 2.784 N/A TRP 422.A NE1 ASP 452.A OD2 no hydrogen 2.918 N/A SER 423.A N GLU 367.A O no hydrogen 2.899 N/A SER 423.A OG GLU 368.A OE2 no hydrogen 2.754 N/A ILE 424.A N THR 458.A O no hydrogen 2.991 N/A ASN 426.A N PHE 370.A O no hydrogen 3.067 N/A ASN 426.A ND2 ASP 371.A OD1 no hydrogen 3.407 N/A GLU 427.A N GLY 460.A O no hydrogen 2.819 N/A GLU 430.A N GLU 430.A OE1 no hydrogen 2.728 N/A ALA 431.A N ILE 428.A O no hydrogen 3.269 N/A GLY 433.A N SER 437.A OG no hydrogen 3.086 N/A ASP 434.A N ASN 432.A OD1 no hydrogen 3.218 N/A HIS 436.A NE2 GLU 387.A OE2 no hydrogen 2.731 N/A SER 437.A N ASP 434.A OD1 no hydrogen 2.762 N/A SER 437.A OG ASN 432.A OD1 no hydrogen 3.558 N/A SER 437.A OG ASP 434.A O no hydrogen 3.209 N/A SER 437.A OG ASP 434.A OD1 no hydrogen 2.690 N/A LEU 438.A N ASP 434.A O no hydrogen 2.916 N/A ALA 439.A N ALA 435.A O no hydrogen 2.989 N/A THR 440.A N HIS 436.A O no hydrogen 3.005 N/A THR 440.A OG1 HIS 436.A O no hydrogen 3.033 N/A VAL 441.A N SER 437.A O no hydrogen 2.897 N/A LYS 442.A N LEU 438.A O no hydrogen 3.387 N/A ARG 443.A N ALA 439.A O no hydrogen 2.972 N/A ARG 443.A NH1 SER 402.A OG no hydrogen 3.031 N/A ARG 443.A NH1 ASP 403.A OD1 no hydrogen 2.508 N/A LEU 444.A N THR 440.A O no hydrogen 3.013 N/A VAL 445.A N VAL 441.A O no hydrogen 2.816 N/A LYS 446.A N LYS 442.A O no hydrogen 3.092 N/A LYS 446.A NZ ASP 450.A OD1 no hydrogen 3.461 N/A LYS 446.A NZ ASP 450.A OD2 no hydrogen 3.401 N/A VAL 447.A N ARG 443.A O no hydrogen 3.085 N/A ILE 448.A N LEU 444.A O no hydrogen 3.358 N/A LYS 449.A N VAL 445.A O no hydrogen 2.963 N/A LYS 449.A NZ ASP 481.A OD1 no hydrogen 3.109 N/A LYS 449.A NZ ASP 481.A OD2 no hydrogen 2.858 N/A ASP 450.A N LYS 446.A O no hydrogen 3.061 N/A VAL 451.A N ILE 448.A O no hydrogen 2.881 N/A ASP 452.A N ILE 448.A O no hydrogen 2.623 N/A THR 454.A N ASP 452.A OD1 no hydrogen 3.085 N/A THR 454.A OG1 ASP 452.A OD1 no hydrogen 2.801 N/A ARG 455.A NE ILE 419.A O no hydrogen 2.639 N/A ARG 455.A NH1 LYS 414.A O no hydrogen 2.494 N/A ARG 455.A NH1 ASP 452.A OD2 no hydrogen 3.166 N/A ARG 455.A NH2 LYS 414.A O no hydrogen 2.770 N/A ARG 455.A NH2 ASN 416.A O no hydrogen 2.757 N/A TYR 456.A N PHE 420.A O no hydrogen 2.946 N/A VAL 457.A N ASP 481.A OD2 no hydrogen 3.032 N/A THR 458.A N TRP 422.A O no hydrogen 2.921 N/A THR 458.A OG1 MET 459.A O no hydrogen 3.471 N/A THR 458.A OG1 ALA 482.A O no hydrogen 2.799 N/A THR 458.A OG1 TYR 505.A OH no hydrogen 2.621 N/A GLY 460.A N GLY 425.A O no hydrogen 2.950 N/A ALA 461.A N GLY 484.A O no hydrogen 3.057 N/A LYS 463.A NZ GLY 429.A O no hydrogen 2.846 N/A ARG 465.A N ASP 462.A O no hydrogen 3.220 N/A PHE 466.A N LYS 463.A O no hydrogen 3.344 N/A GLY 469.A N PHE 466.A O no hydrogen 2.915 N/A SER 470.A N ASN 468.A OD1 no hydrogen 3.323 N/A SER 470.A OG GLU 474.A OE2 no hydrogen 2.877 N/A GLY 471.A N GLU 474.A OE1 no hydrogen 3.249 N/A HIS 473.A NE2 GLY 469.A O no hydrogen 2.669 N/A GLU 474.A N GLY 471.A O no hydrogen 2.970 N/A LYS 475.A N GLY 472.A O no hydrogen 3.151 N/A LYS 475.A NZ GLY 433.A O no hydrogen 3.040 N/A ILE 476.A N HIS 473.A O no hydrogen 3.064 N/A ALA 477.A N HIS 473.A O no hydrogen 3.141 N/A ASP 478.A N GLU 474.A O no hydrogen 3.110 N/A GLU 479.A N ILE 476.A O no hydrogen 2.988 N/A LEU 480.A N ALA 477.A O no hydrogen 3.154 N/A ALA 482.A N VAL 457.A O no hydrogen 3.201 N/A VAL 483.A N LEU 503.A O no hydrogen 2.719 N/A GLY 484.A N MET 459.A O no hydrogen 3.119 N/A PHE 485.A N TYR 505.A O no hydrogen 2.919 N/A ASN 486.A N ALA 461.A O no hydrogen 2.838 N/A TYR 487.A N GLU 508.A O no hydrogen 2.926 N/A TYR 487.A OH GLU 508.A OE2 no hydrogen 2.810 N/A TYR 487.A OH SER 511.A OG no hydrogen 2.888 N/A SER 488.A OG ASN 486.A O no hydrogen 2.728 N/A GLU 489.A N GLU 489.A OE1 no hydrogen 2.686 N/A ASN 491.A N SER 488.A O no hydrogen 3.136 N/A ASN 491.A ND2 PHE 464.A O no hydrogen 2.788 N/A ASN 491.A ND2 GLY 467.A O no hydrogen 3.018 N/A TYR 492.A N GLU 489.A O no hydrogen 3.271 N/A LEU 495.A N ASN 491.A O no hydrogen 2.884 N/A ARG 496.A N TYR 492.A O no hydrogen 2.638 N/A ARG 496.A NE TYR 492.A OH no hydrogen 3.489 N/A ARG 496.A NH1 TRP 502.A O no hydrogen 2.875 N/A ARG 496.A NH2 TRP 502.A O no hydrogen 2.803 N/A ARG 496.A NH2 GLY 564.A O no hydrogen 3.493 N/A ALA 497.A N LYS 493.A O no hydrogen 3.037 N/A LYS 498.A N ALA 494.A O no hydrogen 3.058 N/A LYS 498.A NZ GLU 474.A OE1 no hydrogen 3.273 N/A LYS 498.A NZ GLU 474.A OE2 no hydrogen 3.429 N/A HIS 499.A N LEU 495.A O no hydrogen 2.899 N/A HIS 499.A NE2 GLU 474.A OE2 no hydrogen 2.942 N/A TRP 502.A N HIS 499.A O no hydrogen 3.196 N/A TRP 502.A NE1 ASP 478.A OD1 no hydrogen 3.073 N/A TYR 505.A N VAL 483.A O no hydrogen 3.377 N/A TYR 505.A OH GLN 366.A OE1 no hydrogen 3.051 N/A TYR 505.A OH THR 458.A OG1 no hydrogen 2.621 N/A GLY 506.A N GLY 567.A O no hydrogen 2.886 N/A SER 507.A N PHE 485.A O no hydrogen 2.943 N/A GLU 508.A N PHE 485.A O no hydrogen 3.524 N/A THR 509.A N PHE 569.A O no hydrogen 3.210 N/A THR 509.A OG1 GLN 568.A OE1 no hydrogen 2.494 N/A SER 510.A OG LYS 550.A O no hydrogen 2.931 N/A SER 511.A N THR 509.A O no hydrogen 3.138 N/A SER 511.A N TRP 571.A O no hydrogen 3.200 N/A SER 511.A OG TYR 487.A OH no hydrogen 2.888 N/A THR 513.A N ASP 544.A O no hydrogen 2.956 N/A ARG 514.A N TYR 595.A O no hydrogen 2.934 N/A ARG 514.A NE GLY 597.A O no hydrogen 3.194 N/A ARG 514.A NH1 ASP 608.A OD2 no hydrogen 2.549 N/A ARG 514.A NH2 PHE 596.A O no hydrogen 3.123 N/A THR 515.A N GLN 538.A O no hydrogen 2.847 N/A THR 515.A OG1 GLN 789.A OE1 no hydrogen 3.030 N/A ARG 516.A NE ASP 600.A OD2 no hydrogen 2.865 N/A ARG 516.A NH1 PHE 808.A O no hydrogen 3.148 N/A ARG 516.A NH2 ASN 786.A O no hydrogen 3.063 N/A ARG 516.A NH2 PHE 808.A O no hydrogen 2.795 N/A ARG 516.A NH2 LYS 811.A O no hydrogen 3.458 N/A GLY 517.A N ASP 540.A OD2 no hydrogen 3.083 N/A SER 518.A N THR 515.A O no hydrogen 3.216 N/A SER 518.A OG GLU 537.A OE1 no hydrogen 2.630 N/A TYR 519.A OH HIS 607.A NE2 no hydrogen 2.681 N/A TYR 520.A N SER 539.A OG no hydrogen 2.788 N/A ARG 521.A N LYS 641.A O no hydrogen 2.877 N/A ARG 521.A NH2 SER 640.A O no hydrogen 3.104 N/A GLU 523.A N GLU 523.A OE1 no hydrogen 3.088 N/A ARG 524.A N ARG 521.A O no hydrogen 2.954 N/A LEU 526.A N ASN 543.A O no hydrogen 2.814 N/A HIS 528.A N ARG 545.A O no hydrogen 2.919 N/A ASN 530.A ND2 PRO 582.A O no hydrogen 2.714 N/A GLU 533.A N GLU 533.A OE1 no hydrogen 2.981 N/A ARG 534.A N GLY 531.A O no hydrogen 2.977 N/A ARG 534.A NH1 SER 529.A OG no hydrogen 3.207 N/A ARG 534.A NH1 ASP 544.A OD1 no hydrogen 3.199 N/A ARG 534.A NH1 ASP 544.A OD2 no hydrogen 3.416 N/A ARG 534.A NH2 ASP 544.A OD2 no hydrogen 3.025 N/A ASN 535.A N.A PRO 532.A O no hydrogen 3.158 N/A ASN 535.A N.B PRO 532.A O no hydrogen 3.131 N/A GLU 537.A N ARG 534.A O no hydrogen 3.053 N/A GLN 538.A N THR 515.A OG1 no hydrogen 3.238 N/A GLN 538.A NE2 THR 513.A OG1 no hydrogen 2.489 N/A SER 539.A N ASP 544.A OD2 no hydrogen 3.045 N/A SER 539.A OG TYR 520.A O no hydrogen 3.262 N/A SER 539.A OG ASN 543.A OD1 no hydrogen 2.983 N/A ASP 540.A N SER 518.A O no hydrogen 2.758 N/A TYR 541.A OH PRO 650.A O no hydrogen 2.689 N/A GLY 542.A N SER 539.A O no hydrogen 2.991 N/A ASN 543.A ND2 TYR 520.A O no hydrogen 3.070 N/A ASN 543.A ND2 ARG 524.A O no hydrogen 3.068 N/A ARG 545.A N LEU 526.A O no hydrogen 3.144 N/A ARG 545.A NE GLU 525.A OE2 no hydrogen 2.826 N/A ARG 545.A NH1 VAL 546.A O no hydrogen 3.015 N/A ARG 545.A NH2 GLU 525.A OE2 no hydrogen 3.467 N/A VAL 546.A N SER 511.A O no hydrogen 3.523 N/A GLY 547.A N HIS 528.A ND1 no hydrogen 3.173 N/A GLY 549.A N VAL 546.A O no hydrogen 2.930 N/A LYS 550.A N SER 510.A O no hydrogen 2.898 N/A LYS 550.A NZ ASP 490.A OD1 no hydrogen 3.143 N/A ALA 554.A N THR 551.A OG1 no hydrogen 3.071 N/A SER 555.A N THR 551.A O no hydrogen 3.064 N/A SER 555.A OG THR 551.A O no hydrogen 2.720 N/A SER 555.A OG ALA 552.A O no hydrogen 3.236 N/A TRP 556.A N ALA 552.A O no hydrogen 2.852 N/A THR 557.A N THR 553.A O no hydrogen 2.813 N/A THR 557.A OG1 THR 553.A O no hydrogen 2.881 N/A THR 557.A OG1 ALA 554.A O no hydrogen 3.325 N/A PHE 558.A N ALA 554.A O no hydrogen 3.398 N/A ASP 559.A N SER 555.A O no hydrogen 3.484 N/A ARG 560.A N TRP 556.A O no hydrogen 2.880 N/A ARG 560.A NE ASP 561.A OD1 no hydrogen 2.875 N/A ARG 560.A NH2 ASP 561.A OD1 no hydrogen 3.173 N/A ARG 560.A NH2 ASP 561.A OD2 no hydrogen 3.527 N/A ASP 561.A N THR 557.A O no hydrogen 2.805 N/A ASN 562.A N ASP 559.A O no hydrogen 3.271 N/A TYR 565.A N ASN 562.A O no hydrogen 3.376 N/A ALA 566.A N ILE 504.A O no hydrogen 2.876 N/A GLN 568.A N PHE 307.A O no hydrogen 2.937 N/A GLN 568.A NE2 SER 555.A O no hydrogen 3.195 N/A GLN 568.A NE2 ASP 559.A OD2 no hydrogen 2.885 N/A PHE 569.A N GLY 506.A O no hydrogen 2.841 N/A ILE 570.A N GLY 309.A O no hydrogen 2.919 N/A TRP 571.A N THR 509.A O no hydrogen 2.820 N/A THR 572.A N PHE 596.A O no hydrogen 3.001 N/A THR 572.A OG1 SER 311.A O no hydrogen 3.354 N/A GLY 573.A N SER 311.A O no hydrogen 2.984 N/A THR 574.A OG1 ASP 575.A O no hydrogen 3.340 N/A ASP 575.A N VAL 599.A O no hydrogen 2.807 N/A TYR 576.A N SER 594.A OG no hydrogen 3.017 N/A TYR 576.A OH GLU 579.A OE1 no hydrogen 2.480 N/A ILE 577.A N ASP 315.A OD2 no hydrogen 2.539 N/A GLY 578.A N LYS 592.A O no hydrogen 2.929 N/A GLU 579.A N GLU 66.A O no hydrogen 2.927 N/A TRP 583.A N PRO 580.A O no hydrogen 2.816 N/A ASN 585.A N ASN 65.A OD1 no hydrogen 2.676 N/A ASN 585.A ND2 GLU 66.A OE2 no hydrogen 3.064 N/A GLN 586.A N TRP 583.A O no hydrogen 3.368 N/A GLN 588.A NE2 HIS 59.A O no hydrogen 3.674 N/A GLN 588.A NE2 GLU 60.A OE2 no hydrogen 3.440 N/A THR 589.A N GLN 586.A O no hydrogen 3.146 N/A THR 589.A OG1 GLN 586.A O no hydrogen 2.501 N/A LYS 592.A N GLN 789.A O no hydrogen 3.209 N/A LYS 592.A NZ SER 593.A OG no hydrogen 3.159 N/A LYS 592.A NZ GLU 788.A O no hydrogen 3.103 N/A LYS 592.A NZ GLN 789.A O no hydrogen 3.180 N/A LYS 592.A NZ SER 791.A O no hydrogen 3.030 N/A SER 594.A N TYR 576.A O no hydrogen 2.912 N/A SER 594.A OG ASP 575.A OD1 no hydrogen 2.650 N/A SER 594.A OG TYR 576.A O no hydrogen 3.379 N/A TYR 595.A OH TYR 536.A O no hydrogen 2.537 N/A GLY 597.A N ASP 575.A OD1 no hydrogen 2.678 N/A ILE 598.A N THR 572.A O no hydrogen 3.071 N/A VAL 599.A N GLY 573.A O no hydrogen 3.302 N/A ASP 600.A N ILE 604.A O no hydrogen 3.131 N/A THR 601.A OG1 ASP 785.A OD1 no hydrogen 3.552 N/A THR 601.A OG1 ASP 785.A OD2 no hydrogen 2.568 N/A GLY 603.A N ASP 600.A O no hydrogen 2.972 N/A ILE 604.A N ASP 600.A OD1 no hydrogen 2.976 N/A LYS 606.A N ILE 598.A O no hydrogen 3.027 N/A LYS 606.A NZ ARG 514.A O no hydrogen 3.006 N/A LYS 606.A NZ ASP 575.A OD2 no hydrogen 2.832 N/A LYS 606.A NZ GLY 597.A O no hydrogen 2.667 N/A HIS 607.A N ASP 540.A OD1 no hydrogen 2.991 N/A HIS 607.A ND1 HIS 626.A NE2 no hydrogen 2.716 N/A HIS 607.A NE2 TYR 519.A OH no hydrogen 2.681 N/A PHE 609.A N LYS 606.A O no hydrogen 3.168 N/A TYR 610.A N HIS 607.A O no hydrogen 2.966 N/A LEU 611.A N HIS 607.A O no hydrogen 3.366 N/A TYR 612.A N ASP 608.A O no hydrogen 2.955 N/A GLN 613.A N PHE 609.A O no hydrogen 2.997 N/A GLN 613.A NE2 GLU 337.A O.A no hydrogen 2.859 N/A GLN 613.A NE2 GLU 337.A O.B no hydrogen 2.907 N/A SER 614.A N TYR 610.A O no hydrogen 2.984 N/A SER 614.A OG TYR 610.A O no hydrogen 3.545 N/A SER 614.A OG LEU 611.A O no hydrogen 2.620 N/A SER 614.A OG GLN 615.A OE1 no hydrogen 3.319 N/A GLN 615.A N LEU 611.A O no hydrogen 3.269 N/A TRP 616.A N TYR 612.A O no hydrogen 2.754 N/A VAL 617.A N GLN 613.A O no hydrogen 2.932 N/A LYS 621.A N SER 618.A OG no hydrogen 2.997 N/A LYS 622.A N SER 618.A O no hydrogen 2.951 N/A MET 624.A N ASN 656.A OD1 no hydrogen 3.137 N/A HIS 626.A N TYR 654.A O no hydrogen 2.734 N/A HIS 626.A NE2 HIS 607.A ND1 no hydrogen 2.716 N/A LEU 627.A N ASP 722.A OD2 no hydrogen 2.977 N/A LEU 628.A N ARG 652.A O no hydrogen 3.067 N/A TRP 631.A NE1 GLN 703.A O.A no hydrogen 2.761 N/A TRP 631.A NE1 GLN 703.A O.B no hydrogen 2.718 N/A ASN 632.A N HIS 630.A ND1 no hydrogen 3.021 N/A ASN 632.A ND2 GLU 634.A OE2 no hydrogen 2.662 N/A ASN 632.A ND2 ALA 727.A O no hydrogen 2.909 N/A TRP 633.A N TYR 702.A OH no hydrogen 3.309 N/A TRP 633.A NE1 HIS 630.A O no hydrogen 2.845 N/A LEU 638.A N ASN 635.A OD1 no hydrogen 2.919 N/A ALA 639.A N ASN 635.A O no hydrogen 3.048 N/A SER 640.A N LYS 636.A O no hydrogen 2.776 N/A SER 640.A OG LYS 636.A O no hydrogen 2.908 N/A SER 640.A OG GLU 637.A O no hydrogen 2.761 N/A VAL 642.A N ALA 639.A O no hydrogen 3.033 N/A ALA 643.A N ALA 639.A O no hydrogen 2.766 N/A ASP 644.A N LYS 648.A O no hydrogen 3.016 N/A GLU 646.A N ASP 644.A OD1 no hydrogen 3.016 N/A GLY 647.A N ASP 644.A O no hydrogen 2.712 N/A LYS 648.A N ASP 644.A OD1 no hydrogen 3.019 N/A ILE 649.A N VAL 700.A O no hydrogen 2.706 N/A VAL 651.A N TRP 698.A O no hydrogen 2.737 N/A ARG 652.A N LEU 628.A O no hydrogen 2.819 N/A ARG 652.A NE GLU 697.A OE2 no hydrogen 3.045 N/A ARG 652.A NH2 PRO 522.A O no hydrogen 3.465 N/A ARG 652.A NH2 GLU 697.A OE2 no hydrogen 3.338 N/A ALA 653.A N LEU 696.A O no hydrogen 2.785 N/A TYR 654.A N HIS 626.A O no hydrogen 2.930 N/A SER 655.A OG MET 624.A O no hydrogen 2.625 N/A ASN 656.A ND2 VAL 617.A O no hydrogen 3.233 N/A ASN 656.A ND2 LYS 622.A O no hydrogen 2.744 N/A ALA 657.A N SER 655.A OG no hydrogen 3.189 N/A SER 658.A N ARG 712.A O no hydrogen 3.079 N/A SER 659.A N ARG 712.A O no hydrogen 3.254 N/A VAL 660.A N LYS 672.A O no hydrogen 2.799 N/A GLU 661.A N ILE 710.A O no hydrogen 2.903 N/A LEU 662.A N GLY 670.A O no hydrogen 3.388 N/A PHE 663.A N GLU 708.A O no hydrogen 2.808 N/A LEU 664.A N LYS 667.A O no hydrogen 2.938 N/A ASN 665.A N THR 706.A O no hydrogen 2.783 N/A ASN 665.A ND2 PRO 704.A O no hydrogen 3.269 N/A LYS 667.A N LEU 664.A O no hydrogen 3.114 N/A SER 668.A OG GLU 661.A OE2 no hydrogen 2.527 N/A LEU 669.A N LEU 662.A O no hydrogen 2.718 N/A GLY 670.A N SER 668.A OG no hydrogen 3.038 N/A LYS 672.A N VAL 660.A O no hydrogen 2.861 N/A PHE 674.A N SER 658.A O no hydrogen 2.999 N/A ASN 675.A N GLU 687.A O no hydrogen 2.807 N/A LYS 676.A NZ SER 658.A OG no hydrogen 2.951 N/A LYS 677.A N TYR 685.A O no hydrogen 2.818 N/A THR 679.A N ARG 683.A O no hydrogen 2.607 N/A THR 679.A OG1 ASP 681.A OD1 no hydrogen 3.387 N/A THR 679.A OG1 ARG 683.A O no hydrogen 2.809 N/A GLY 682.A N THR 679.A O no hydrogen 2.518 N/A ARG 683.A NH1 ASP 681.A OD2 no hydrogen 2.840 N/A THR 684.A OG1 LYS 677.A O no hydrogen 3.534 N/A TYR 685.A N LYS 677.A O no hydrogen 2.819 N/A GLU 687.A N ASN 675.A O no hydrogen 3.032 N/A GLY 688.A N GLU 693.A O no hydrogen 2.728 N/A ASN 690.A ND2 GLU 693.A OE2 no hydrogen 3.211 N/A ASN 692.A N ASN 690.A OD1 no hydrogen 2.652 N/A GLU 693.A N ASN 690.A O no hydrogen 3.231 N/A LEU 696.A N ALA 653.A O no hydrogen 3.021 N/A TRP 698.A N VAL 651.A O no hydrogen 2.775 N/A TRP 698.A NE1 GLY 670.A O no hydrogen 3.185 N/A LYS 699.A NZ ASP 644.A OD2 no hydrogen 3.475 N/A VAL 700.A N ILE 649.A O no hydrogen 3.184 N/A TYR 702.A OH TRP 631.A O no hydrogen 2.892 N/A GLN 703.A N.B ALA 701.A O no hydrogen 2.947 N/A GLY 705.A N THR 726.A OG1 no hydrogen 2.855 N/A THR 706.A N ASN 665.A OD1 no hydrogen 3.109 N/A LEU 707.A N ILE 724.A O no hydrogen 2.746 N/A GLU 708.A N PHE 663.A O no hydrogen 2.936 N/A ALA 709.A N ASP 722.A O no hydrogen 2.706 N/A ILE 710.A N GLU 661.A O no hydrogen 2.933 N/A ALA 711.A N ALA 720.A O no hydrogen 2.770 N/A ARG 712.A N SER 659.A O no hydrogen 3.037 N/A ARG 712.A NH1 GLU 661.A OE1 no hydrogen 2.613 N/A ASP 713.A N LYS 717.A O no hydrogen 2.913 N/A GLY 716.A N ASP 713.A O no hydrogen 2.885 N/A LYS 717.A N ASP 713.A OD1 no hydrogen 2.972 N/A ILE 719.A N ALA 711.A O no hydrogen 2.728 N/A ALA 720.A N ALA 711.A O no hydrogen 3.275 N/A ASP 722.A N ALA 709.A O no hydrogen 3.092 N/A ILE 724.A N LEU 707.A O no hydrogen 2.674 N/A THR 726.A N GLY 705.A O no hydrogen 2.842 N/A THR 726.A OG1 TRP 631.A O no hydrogen 2.835 N/A THR 726.A OG1 GLY 705.A O no hydrogen 3.166 N/A ALA 727.A N ASN 632.A OD1 no hydrogen 3.011 N/A GLY 728.A N ASP 758.A OD2 no hydrogen 2.823 N/A ALA 731.A N VAL 757.A O no hydrogen 2.690 N/A ALA 732.A N VAL 757.A O no hydrogen 3.066 N/A VAL 733.A N LYS 835.A O.A no hydrogen 2.845 N/A VAL 733.A N LYS 835.A O.B no hydrogen 2.849 N/A ARG 734.A N GLU 755.A O no hydrogen 2.886 N/A ARG 734.A NE GLU 755.A OE1 no hydrogen 2.915 N/A ARG 734.A NH1 GLY 761.A O no hydrogen 2.857 N/A ARG 734.A NH2 GLU 755.A OE1 no hydrogen 2.929 N/A ARG 734.A NH2 GLY 761.A O no hydrogen 3.121 N/A ILE 736.A N TYR 753.A O no hydrogen 2.734 N/A LYS 737.A NZ HIS 740.A ND1 no hydrogen 3.489 N/A LYS 737.A NZ THR 840.A O no hydrogen 3.449 N/A GLU 738.A N TYR 751.A O no hydrogen 3.342 N/A ILE 742.A N PHE 842.A O no hydrogen 2.820 N/A ALA 743.A N ASP 748.A OD2 no hydrogen 3.002 N/A ALA 744.A N GLY 844.A O no hydrogen 2.985 N/A GLY 746.A N SER 818.A OG no hydrogen 3.086 N/A GLY 746.A N THR 819.A O no hydrogen 3.228 N/A LYS 747.A N ASP 745.A OD1 no hydrogen 3.020 N/A ASP 748.A N ASP 745.A OD1 no hydrogen 2.910 N/A LEU 749.A N ASP 748.A OD1 no hydrogen 2.948 N/A THR 750.A N VAL 816.A O no hydrogen 2.870 N/A THR 750.A OG1 ASP 739.A OD2 no hydrogen 2.618 N/A ILE 752.A N ALA 814.A O no hydrogen 2.934 N/A TYR 753.A N ILE 736.A O no hydrogen 2.907 N/A TYR 753.A OH GLU 738.A OE2 no hydrogen 3.354 N/A TYR 754.A N GLY 812.A O no hydrogen 2.930 N/A TYR 754.A OH LYS 806.A O no hydrogen 2.718 N/A GLU 755.A N ARG 734.A O no hydrogen 2.766 N/A ILE 756.A N GLY 810.A O no hydrogen 2.871 N/A VAL 757.A N ALA 732.A O no hydrogen 2.951 N/A ASP 758.A N ASN 762.A O no hydrogen 2.927 N/A SER 759.A OG GLN 760.A OE1 no hydrogen 3.541 N/A GLN 760.A N ASP 758.A OD1 no hydrogen 2.778 N/A GLY 761.A N ASP 758.A O no hydrogen 3.073 N/A ASN 762.A N ASP 758.A OD1 no hydrogen 2.927 N/A VAL 764.A N ILE 756.A O no hydrogen 2.827 N/A ALA 767.A N VAL 764.A O no hydrogen 3.326 N/A VAL 771.A N ARG 805.A O no hydrogen 2.854 N/A ARG 772.A N HIS 830.A O no hydrogen 2.699 N/A PHE 773.A N TRP 803.A O no hydrogen 2.840 N/A GLN 774.A N THR 828.A O no hydrogen 2.940 N/A HIS 776.A N THR 826.A O no hydrogen 3.083 N/A GLN 778.A N LYS 824.A O no hydrogen 2.775 N/A GLY 779.A N GLY 777.A O no hydrogen 2.828 N/A GLN 780.A N LYS 817.A O no hydrogen 2.794 N/A VAL 782.A N ILE 815.A O no hydrogen 2.732 N/A VAL 784.A N TYR 795.A O no hydrogen 3.025 N/A ASP 785.A N VAL 813.A O no hydrogen 2.989 N/A ASN 786.A ND2 GLU 793.A OE2 no hydrogen 2.867 N/A ASN 786.A ND2 LYS 806.A O no hydrogen 2.813 N/A GLY 787.A N ASP 785.A OD1 no hydrogen 2.943 N/A GLU 788.A N ASN 786.A OD1 no hydrogen 3.189 N/A GLN 789.A N GLN 789.A OE1 no hydrogen 2.799 N/A GLN 789.A NE2 SER 594.A O no hydrogen 2.820 N/A SER 791.A N GLU 788.A O no hydrogen 3.275 N/A SER 791.A OG GLU 793.A OE2 no hydrogen 2.672 N/A ARG 792.A NH1 GLN 69.A OE1 no hydrogen 2.911 N/A ARG 792.A NH1 PRO 590.A O no hydrogen 2.927 N/A ARG 792.A NH2 GLN 69.A OE1 no hydrogen 2.478 N/A GLU 793.A N SER 791.A OG no hydrogen 3.292 N/A ARG 794.A NE.A ASP 56.A OD1 no hydrogen 2.934 N/A ARG 794.A NH1.A ALA 797.A O no hydrogen 3.024 N/A ARG 794.A NH2.A ASP 56.A OD1 no hydrogen 3.373 N/A ARG 794.A NH2.A ASP 56.A OD2 no hydrogen 3.159 N/A LYS 796.A NZ ALA 318.A O no hydrogen 3.563 N/A LYS 796.A NZ VAL 782.A O no hydrogen 2.970 N/A GLN 798.A N SER 802.A O no hydrogen 2.824 N/A GLY 801.A N GLN 798.A O no hydrogen 2.847 N/A SER 802.A N ASP 800.A OD1 no hydrogen 3.041 N/A ARG 805.A N VAL 771.A O no hydrogen 2.962 N/A ARG 805.A NH1 ARG 794.A O.A no hydrogen 2.916 N/A ARG 805.A NH1 ARG 794.A O.B no hydrogen 2.945 N/A ARG 805.A NH2 ASN 786.A OD1 no hydrogen 3.222 N/A LYS 806.A N GLU 793.A OE1 no hydrogen 2.985 N/A ALA 807.A N ASN 769.A O no hydrogen 2.844 N/A PHE 808.A N LYS 811.A O no hydrogen 2.981 N/A ASN 809.A ND2 ARG 516.A O no hydrogen 2.545 N/A GLY 810.A N ALA 767.A O no hydrogen 2.869 N/A LYS 811.A N PHE 808.A O no hydrogen 3.255 N/A GLY 812.A N TYR 754.A O no hydrogen 2.870 N/A VAL 813.A N ASP 785.A O no hydrogen 2.740 N/A ALA 814.A N ILE 752.A O no hydrogen 2.767 N/A ILE 815.A N GLY 783.A O no hydrogen 2.799 N/A VAL 816.A N THR 750.A O no hydrogen 3.017 N/A LYS 817.A N GLN 780.A O no hydrogen 2.729 N/A LYS 817.A NZ GLU 322.A OE2 no hydrogen 2.920 N/A SER 818.A N ASP 748.A O no hydrogen 3.004 N/A SER 818.A OG ALA 743.A O no hydrogen 2.954 N/A SER 818.A OG ASP 745.A OD1 no hydrogen 3.425 N/A SER 818.A OG ASP 748.A O no hydrogen 3.236 N/A THR 819.A OG1 GLN 821.A O no hydrogen 3.513 N/A THR 819.A OG1 GLN 821.A OE1 no hydrogen 3.504 N/A GLN 821.A N THR 819.A OG1 no hydrogen 3.220 N/A GLY 823.A N THR 843.A O no hydrogen 2.901 N/A LYS 824.A N GLN 778.A OE1 no hydrogen 3.048 N/A PHE 825.A N VAL 841.A O no hydrogen 2.942 N/A THR 826.A N HIS 776.A O no hydrogen 2.915 N/A THR 826.A OG1 THR 840.A OG1 no hydrogen 2.971 N/A LEU 827.A N VAL 839.A O no hydrogen 3.004 N/A THR 828.A N GLN 774.A O no hydrogen 3.010 N/A THR 828.A OG1 GLN 838.A OE1 no hydrogen 3.457 N/A ALA 829.A N ASN 837.A O no hydrogen 2.695 N/A HIS 830.A N ARG 772.A O no hydrogen 2.838 N/A HIS 830.A ND1 SER 836.A OG no hydrogen 2.780 N/A HIS 830.A NE2 GLN 774.A OE1 no hydrogen 3.000 N/A SER 831.A OG LEU 770.A O no hydrogen 2.615 N/A LEU 834.A N SER 831.A O no hydrogen 3.150 N/A LYS 835.A N.A ALA 731.A O no hydrogen 2.936 N/A LYS 835.A N.B ALA 731.A O no hydrogen 2.900 N/A SER 836.A OG HIS 830.A ND1 no hydrogen 2.780 N/A ASN 837.A N ALA 829.A O no hydrogen 3.183 N/A VAL 839.A N LEU 827.A O no hydrogen 3.179 N/A THR 840.A OG1 THR 826.A OG1 no hydrogen 2.971 N/A VAL 841.A N PHE 825.A O no hydrogen 2.910 N/A PHE 842.A N HIS 740.A O no hydrogen 3.047 N/A THR 843.A N GLY 823.A O no hydrogen 2.884 N/A THR 843.A OG1 GLN 821.A O no hydrogen 3.302 N/A GLY 844.A N ILE 742.A O no hydrogen 3.081 N/A