Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xs8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 TYR 293.A O no hydrogen 2.806 N/A VAL 6.A N SER 131.A OG no hydrogen 3.015 N/A LYS 9.A N ASN 125.A OD1 no hydrogen 2.830 N/A LYS 9.A NZ LYS 95.A O no hydrogen 2.762 N/A LYS 9.A NZ ASP 177.A OD2 no hydrogen 2.914 N/A THR 11.A OG1 THR 93.A O no hydrogen 2.601 N/A SER 12.A N THR 93.A O no hydrogen 2.982 N/A LYS 18.A N ASP 15.A OD1 no hydrogen 3.223 N/A LEU 20.A N ALA 17.A O no hydrogen 3.095 N/A VAL 21.A N ALA 17.A O no hydrogen 2.925 N/A LYS 22.A N LYS 18.A O no hydrogen 3.225 N/A ILE 24.A N LEU 20.A O no hydrogen 2.736 N/A GLN 25.A N VAL 21.A O no hydrogen 2.930 N/A GLN 26.A N LYS 22.A O no hydrogen 3.255 N/A THR 27.A N ILE 24.A O no hydrogen 3.321 N/A THR 27.A OG1 PHE 23.A O no hydrogen 3.037 N/A TYR 28.A N GLN 25.A O no hydrogen 3.082 N/A GLY 31.A N GLN 35.A OE1 no hydrogen 3.463 N/A GLY 32.A N PRO 29.A O no hydrogen 2.509 N/A GLN 37.A N GLU 34.A O no hydrogen 2.944 N/A TYR 38.A N GLU 34.A O no hydrogen 3.189 N/A CYS 39.A N GLN 35.A O no hydrogen 3.069 N/A ALA 42.A N TYR 38.A O no hydrogen 3.393 N/A LEU 45.A N ALA 41.A O no hydrogen 2.944 N/A LYS 47.A N GLU 43.A O no hydrogen 3.124 N/A LEU 48.A N GLU 44.A O no hydrogen 2.822 N/A LEU 48.A N LEU 45.A O no hydrogen 3.098 N/A ARG 49.A N LEU 45.A O no hydrogen 2.999 N/A ARG 49.A NE GLU 118.A OE2 no hydrogen 2.815 N/A ARG 49.A NH2 THR 11.A OG1 no hydrogen 3.115 N/A ARG 49.A NH2 GLU 118.A OE1 no hydrogen 3.557 N/A ARG 49.A NH2 GLU 118.A OE2 no hydrogen 3.511 N/A ARG 50.A N SER 46.A O no hydrogen 3.205 N/A ARG 50.A NE GLU 13.A OE2 no hydrogen 2.885 N/A ALA 51.A N LYS 47.A O no hydrogen 3.347 N/A ALA 52.A N LEU 48.A O no hydrogen 2.739 N/A VAL 53.A N ARG 50.A O no hydrogen 3.473 N/A GLY 54.A N ARG 50.A O no hydrogen 2.804 N/A HIS 60.A N ASP 58.A O no hydrogen 2.820 N/A LEU 64.A N HIS 60.A O no hydrogen 3.089 N/A GLU 65.A N GLU 61.A O no hydrogen 2.851 N/A THR 66.A N GLY 62.A O no hydrogen 3.095 N/A THR 66.A OG1 GLY 62.A O no hydrogen 3.437 N/A LEU 67.A N ALA 63.A O no hydrogen 3.264 N/A LEU 68.A N LEU 64.A O no hydrogen 2.647 N/A ARG 69.A N GLU 65.A O no hydrogen 2.556 N/A TYR 70.A N THR 66.A O no hydrogen 2.883 N/A TYR 70.A OH GLU 118.A OE2 no hydrogen 2.509 N/A TYR 71.A N LEU 67.A O no hydrogen 3.002 N/A ASP 72.A N LEU 68.A O no hydrogen 2.997 N/A GLN 73.A N ARG 69.A O no hydrogen 2.903 N/A GLN 73.A NE2 GLN 73.A O no hydrogen 3.067 N/A GLN 73.A NE2 ASP 352.A OD1 no hydrogen 2.662 N/A ILE 74.A N TYR 70.A O no hydrogen 3.112 N/A CYS 75.A N TYR 71.A O no hydrogen 3.050 N/A CYS 75.A SG TYR 71.A O no hydrogen 3.433 N/A SER 76.A N ASP 72.A O no hydrogen 3.059 N/A SER 76.A OG ASP 72.A O no hydrogen 2.818 N/A ILE 77.A N ILE 74.A O no hydrogen 3.081 N/A LYS 80.A N ILE 77.A O no hydrogen 2.912 N/A LYS 80.A NZ PHE 354.A O no hydrogen 2.724 N/A LYS 80.A NZ GLU 355.A O no hydrogen 2.908 N/A LYS 80.A NZ MET 357.A O no hydrogen 3.184 N/A CYS 89.A SG ASN 86.A O no hydrogen 4.025 N/A PHE 92.A N LEU 112.A O no hydrogen 2.753 N/A TRP 94.A N LEU 110.A O no hydrogen 2.875 N/A TRP 94.A NE1 GLU 118.A OE1 no hydrogen 3.018 N/A LYS 95.A N LYS 10.A O no hydrogen 2.699 N/A ASP 96.A N VAL 108.A O no hydrogen 3.151 N/A ALA 97.A N ASP 177.A OD2 no hydrogen 2.681 N/A PHE 98.A N ASP 96.A OD2 no hydrogen 3.027 N/A LYS 100.A N ASP 96.A OD2 no hydrogen 3.034 N/A LYS 100.A NZ ASP 234.A O no hydrogen 3.356 N/A LYS 100.A NZ LEU 236.A O no hydrogen 3.435 N/A GLY 105.A N LEU 103.A O no hydrogen 2.827 N/A LEU 110.A N TRP 94.A O no hydrogen 2.944 N/A LEU 112.A N PHE 92.A O no hydrogen 2.773 N/A SER 114.A OG ALA 169.A O no hydrogen 3.062 N/A GLY 116.A N SER 114.A OG no hydrogen 3.388 N/A TYR 117.A N SER 114.A O no hydrogen 2.781 N/A TYR 117.A OH TRP 94.A O no hydrogen 3.313 N/A TYR 117.A OH LEU 110.A O no hydrogen 2.739 N/A GLU 118.A N SER 114.A O no hydrogen 3.360 N/A LYS 119.A N LEU 115.A O no hydrogen 3.066 N/A LYS 119.A NZ GLU 78.A OE1 no hydrogen 3.175 N/A SER 120.A N GLY 116.A O no hydrogen 3.193 N/A SER 120.A OG GLY 116.A O no hydrogen 2.942 N/A CYS 121.A N TYR 117.A O no hydrogen 3.106 N/A CYS 121.A SG TYR 117.A O no hydrogen 3.358 N/A VAL 122.A N GLU 118.A O no hydrogen 3.092 N/A LEU 123.A N LYS 119.A O no hydrogen 3.113 N/A PHE 124.A N SER 120.A O no hydrogen 2.871 N/A ASN 125.A N CYS 121.A O no hydrogen 2.932 N/A ASN 125.A ND2 LYS 9.A O no hydrogen 3.126 N/A CYS 126.A N VAL 122.A O no hydrogen 2.892 N/A CYS 126.A SG LEU 67.A O no hydrogen 3.625 N/A CYS 126.A SG VAL 122.A O no hydrogen 3.021 N/A ALA 127.A N LEU 123.A O no hydrogen 2.881 N/A ALA 128.A N PHE 124.A O no hydrogen 2.853 N/A LEU 129.A N ASN 125.A O no hydrogen 2.976 N/A ALA 130.A N CYS 126.A O no hydrogen 3.130 N/A SER 131.A N ALA 127.A O no hydrogen 2.805 N/A SER 131.A OG ALA 128.A O no hydrogen 2.475 N/A GLN 132.A N ALA 128.A O no hydrogen 2.904 N/A GLN 132.A NE2 VAL 6.A O no hydrogen 2.739 N/A ILE 133.A N LEU 129.A O no hydrogen 3.030 N/A ALA 134.A N ALA 130.A O no hydrogen 2.972 N/A ALA 135.A N SER 131.A O no hydrogen 3.063 N/A GLU 136.A N ILE 133.A O no hydrogen 3.335 N/A GLN 137.A N ALA 134.A O no hydrogen 3.026 N/A GLN 137.A NE2 ILE 133.A O no hydrogen 2.650 N/A ASP 140.A N ASN 138.A OD1 no hydrogen 2.936 N/A ASN 141.A N ASN 138.A O no hydrogen 3.398 N/A GLU 143.A N ASN 141.A OD1 no hydrogen 3.081 N/A GLY 144.A N ASN 141.A OD1 no hydrogen 2.779 N/A LEU 145.A N ASN 141.A O no hydrogen 3.331 N/A LYS 146.A N ASP 142.A O no hydrogen 3.387 N/A ILE 147.A N GLU 143.A O no hydrogen 2.970 N/A ALA 148.A N GLY 144.A O no hydrogen 3.015 N/A ALA 149.A N LEU 145.A O no hydrogen 2.968 N/A LYS 150.A N LYS 146.A O no hydrogen 3.112 N/A HIS 151.A N ILE 147.A O no hydrogen 3.077 N/A HIS 151.A NE2 GLU 61.A OE2 no hydrogen 2.794 N/A TYR 152.A N ALA 148.A O no hydrogen 3.012 N/A GLN 153.A N ALA 149.A O no hydrogen 3.314 N/A GLN 153.A NE2 LYS 338.A O no hydrogen 3.132 N/A PHE 154.A N LYS 150.A O no hydrogen 2.917 N/A ALA 155.A N HIS 151.A O no hydrogen 2.836 N/A SER 156.A N TYR 152.A O no hydrogen 2.888 N/A SER 156.A OG SER 187.A O no hydrogen 2.558 N/A SER 156.A OG SER 187.A OG no hydrogen 3.218 N/A GLY 157.A N GLN 153.A O no hydrogen 3.012 N/A ALA 158.A N PHE 154.A O no hydrogen 2.894 N/A PHE 159.A N ALA 155.A O no hydrogen 2.903 N/A LEU 160.A N SER 156.A O no hydrogen 2.971 N/A HIS 161.A N GLY 157.A O no hydrogen 2.968 N/A ILE 162.A N ALA 158.A O no hydrogen 2.944 N/A LYS 163.A N PHE 159.A O no hydrogen 2.927 N/A GLU 164.A N LEU 160.A O no hydrogen 3.092 N/A GLU 164.A N HIS 161.A O no hydrogen 2.915 N/A THR 165.A N ILE 162.A O no hydrogen 3.497 N/A THR 165.A OG1 HIS 161.A O no hydrogen 3.004 N/A VAL 166.A N ILE 162.A O no hydrogen 3.091 N/A ALA 169.A N THR 165.A O no hydrogen 2.980 N/A LEU 170.A N LEU 167.A O no hydrogen 2.928 N/A THR 175.A OG1 ASP 177.A OD1 no hydrogen 3.153 N/A ASP 177.A N ASP 96.A OD1 no hydrogen 3.327 N/A ILE 178.A N THR 175.A O no hydrogen 3.376 N/A SER 179.A N VAL 176.A O no hydrogen 2.829 N/A SER 179.A OG THR 175.A O no hydrogen 3.062 N/A SER 179.A OG VAL 176.A O no hydrogen 3.328 N/A THR 182.A OG1 VAL 176.A O no hydrogen 3.082 N/A VAL 183.A N SER 179.A O no hydrogen 3.081 N/A GLY 184.A N PRO 180.A O no hydrogen 2.984 N/A THR 185.A N ASP 181.A O no hydrogen 3.098 N/A THR 185.A OG1 ASP 181.A O no hydrogen 3.283 N/A THR 185.A OG1 GLN 229.A OE1 no hydrogen 2.720 N/A LEU 186.A N THR 182.A O no hydrogen 3.105 N/A SER 187.A N VAL 183.A O no hydrogen 3.117 N/A SER 187.A OG SER 156.A O no hydrogen 2.742 N/A SER 187.A OG SER 156.A OG no hydrogen 3.218 N/A LEU 188.A N THR 185.A O no hydrogen 3.094 N/A ILE 189.A N THR 185.A O no hydrogen 2.900 N/A MET 190.A N LEU 186.A O no hydrogen 2.981 N/A LEU 191.A N SER 187.A O no hydrogen 3.174 N/A ALA 192.A N LEU 188.A O no hydrogen 2.772 N/A GLN 193.A N ILE 189.A O no hydrogen 2.906 N/A ALA 194.A N MET 190.A O no hydrogen 3.163 N/A ALA 194.A N LEU 191.A O no hydrogen 3.099 N/A GLN 195.A N LEU 191.A O no hydrogen 3.023 N/A GLN 195.A NE2 LEU 215.A O no hydrogen 3.001 N/A GLN 195.A NE2 ALA 334.A O no hydrogen 2.829 N/A GLU 196.A N ALA 192.A O no hydrogen 2.836 N/A VAL 197.A N GLN 193.A O no hydrogen 3.107 N/A PHE 198.A N ALA 194.A O no hydrogen 3.181 N/A PHE 199.A N GLN 195.A O no hydrogen 2.875 N/A LEU 200.A N GLU 196.A O no hydrogen 2.825 N/A LYS 201.A N VAL 197.A O no hydrogen 2.975 N/A ALA 202.A N PHE 198.A O no hydrogen 2.957 N/A THR 203.A N PHE 199.A O no hydrogen 3.020 N/A THR 203.A OG1 PHE 199.A O no hydrogen 3.315 N/A ARG 204.A N LEU 200.A O no hydrogen 2.898 N/A ASP 205.A N LYS 201.A O no hydrogen 2.764 N/A LYS 206.A N THR 203.A O no hydrogen 2.806 N/A MET 207.A N ALA 202.A O no hydrogen 3.105 N/A ILE 212.A N LYS 208.A O no hydrogen 3.067 N/A ALA 213.A N ASP 209.A O no hydrogen 2.827 N/A LYS 214.A N ALA 210.A O no hydrogen 3.335 N/A LEU 215.A N ILE 211.A O no hydrogen 2.965 N/A ALA 216.A N ILE 212.A O no hydrogen 3.030 N/A ASN 217.A N ALA 213.A O no hydrogen 2.968 N/A ASN 217.A ND2 GLY 332.A O no hydrogen 2.872 N/A GLN 218.A N LYS 214.A O no hydrogen 3.036 N/A GLN 218.A NE2 GLN 218.A O no hydrogen 3.016 N/A ALA 219.A N LEU 215.A O no hydrogen 3.191 N/A ALA 220.A N ALA 216.A O no hydrogen 3.138 N/A ALA 220.A N ASN 217.A O no hydrogen 2.917 N/A ASP 221.A N ASN 217.A O no hydrogen 3.002 N/A TYR 222.A N GLN 218.A O no hydrogen 2.974 N/A TYR 222.A OH THR 335.A OG1 no hydrogen 2.552 N/A PHE 223.A N ALA 219.A O no hydrogen 2.913 N/A GLY 224.A N ALA 220.A O no hydrogen 2.887 N/A ASP 225.A N ASP 221.A O no hydrogen 3.050 N/A ALA 226.A N TYR 222.A O no hydrogen 3.039 N/A PHE 227.A N PHE 223.A O no hydrogen 2.932 N/A LYS 228.A N GLY 224.A O no hydrogen 2.915 N/A GLN 229.A N ASP 225.A O no hydrogen 3.027 N/A CYS 230.A N ALA 226.A O no hydrogen 3.130 N/A CYS 230.A SG ALA 226.A O no hydrogen 3.303 N/A GLN 231.A N LYS 228.A O no hydrogen 2.784 N/A LYS 233.A NZ ASP 181.A OD2 no hydrogen 2.590 N/A VAL 240.A N PRO 237.A O no hydrogen 3.292 N/A VAL 243.A N GLU 239.A O no hydrogen 3.411 N/A LEU 244.A N VAL 240.A O no hydrogen 3.010 N/A ALA 245.A N PHE 241.A O no hydrogen 3.106 N/A ALA 246.A N PRO 242.A O no hydrogen 2.817 N/A LYS 247.A N VAL 243.A O no hydrogen 2.941 N/A LYS 247.A NZ GLU 196.A OE1 no hydrogen 2.612 N/A HIS 248.A N LEU 244.A O no hydrogen 2.979 N/A CYS 249.A N ALA 245.A O no hydrogen 3.134 N/A CYS 249.A SG ALA 245.A O no hydrogen 3.583 N/A ILE 250.A N ALA 246.A O no hydrogen 2.885 N/A MET 251.A N LYS 247.A O no hydrogen 3.043 N/A GLN 252.A N HIS 248.A O no hydrogen 3.024 N/A ALA 253.A N CYS 249.A O no hydrogen 2.897 N/A ASN 254.A N ILE 250.A O no hydrogen 3.142 N/A ASN 254.A ND2 ILE 250.A O no hydrogen 2.722 N/A ALA 255.A N MET 251.A O no hydrogen 3.088 N/A GLU 256.A N GLN 252.A O no hydrogen 2.863 N/A TYR 257.A N ALA 253.A O no hydrogen 2.740 N/A HIS 258.A N ASN 254.A O no hydrogen 3.138 N/A HIS 258.A ND1 ASP 209.A OD1 no hydrogen 2.960 N/A GLN 259.A N ALA 255.A O no hydrogen 3.076 N/A SER 260.A N GLU 256.A O no hydrogen 2.865 N/A SER 260.A N TYR 257.A O no hydrogen 3.275 N/A SER 260.A OG TYR 257.A O no hydrogen 2.740 N/A ILE 261.A N TYR 257.A O no hydrogen 3.285 N/A LEU 262.A N HIS 258.A O no hydrogen 3.335 N/A LEU 262.A N GLN 259.A O no hydrogen 3.169 N/A ALA 263.A N GLN 259.A O no hydrogen 3.031 N/A LYS 264.A N SER 260.A O no hydrogen 3.026 N/A GLN 265.A N ILE 261.A O no hydrogen 3.190 N/A GLN 266.A N ALA 263.A O no hydrogen 2.955 N/A TYR 267.A N LYS 264.A O no hydrogen 3.085 N/A TYR 268.A N ALA 263.A O no hydrogen 2.812 N/A GLY 270.A N ASP 320.A OD2 no hydrogen 2.919 N/A GLU 272.A N TYR 268.A O no hydrogen 2.999 N/A ILE 273.A N PHE 269.A O no hydrogen 3.279 N/A ALA 274.A N GLY 270.A O no hydrogen 3.000 N/A ARG 275.A N GLU 271.A O no hydrogen 2.889 N/A ARG 275.A NE GLU 271.A OE2 no hydrogen 2.922 N/A ARG 275.A NH1 GLU 256.A OE1 no hydrogen 2.960 N/A ARG 275.A NH2 ASP 329.A O no hydrogen 3.026 N/A LEU 276.A N GLU 272.A O no hydrogen 3.099 N/A GLN 277.A N ILE 273.A O no hydrogen 2.981 N/A HIS 278.A N ALA 274.A O no hydrogen 3.084 N/A HIS 278.A ND1 GLU 256.A OE2 no hydrogen 2.635 N/A ALA 279.A N ARG 275.A O no hydrogen 2.869 N/A ALA 280.A N LEU 276.A O no hydrogen 2.765 N/A GLU 281.A N GLN 277.A O no hydrogen 2.810 N/A LEU 282.A N HIS 278.A O no hydrogen 2.996 N/A ILE 283.A N ALA 279.A O no hydrogen 2.962 N/A LYS 284.A N ALA 280.A O no hydrogen 2.804 N/A THR 285.A N GLU 281.A O no hydrogen 3.130 N/A THR 285.A OG1 GLU 281.A O no hydrogen 3.067 N/A VAL 286.A N LEU 282.A O no hydrogen 3.083 N/A ALA 287.A N ILE 283.A O no hydrogen 2.980 N/A SER 288.A N LYS 284.A O no hydrogen 3.330 N/A ARG 289.A N THR 285.A O no hydrogen 2.881 N/A TYR 290.A N VAL 286.A O no hydrogen 2.836 N/A ASP 291.A N ASP 291.A OD1 no hydrogen 2.501 N/A TYR 293.A N TYR 290.A O no hydrogen 2.888 N/A VAL 294.A N TYR 290.A O no hydrogen 2.934 N/A SER 300.A N VAL 296.A O no hydrogen 2.851 N/A ASP 301.A N LYS 297.A O no hydrogen 2.871 N/A LYS 302.A N ASP 298.A O no hydrogen 2.980 N/A ILE 303.A N PHE 299.A O no hydrogen 3.073 N/A ASN 304.A N SER 300.A O no hydrogen 3.000 N/A ARG 305.A N ASP 301.A O no hydrogen 2.918 N/A ALA 306.A N LYS 302.A O no hydrogen 3.276 N/A LEU 307.A N ILE 303.A O no hydrogen 2.687 N/A ALA 308.A N ASN 304.A O no hydrogen 2.854 N/A ALA 309.A N ARG 305.A O no hydrogen 3.022 N/A ALA 310.A N ALA 306.A O no hydrogen 2.954 N/A LYS 311.A N LEU 307.A O no hydrogen 2.908 N/A LYS 312.A N ALA 308.A O no hydrogen 3.037 N/A ASP 313.A N ALA 309.A O no hydrogen 3.265 N/A ASN 314.A N ALA 310.A O no hydrogen 3.180 N/A ASN 314.A ND2 ASP 320.A O no hydrogen 3.016 N/A ASP 315.A N LYS 311.A O no hydrogen 2.788 N/A PHE 316.A N LYS 312.A O no hydrogen 3.161 N/A ILE 317.A N ASP 313.A O no hydrogen 2.899 N/A TYR 318.A N ASP 313.A O no hydrogen 2.921 N/A HIS 319.A N ASN 314.A O no hydrogen 2.804 N/A ASP 320.A N ASN 314.A OD1 no hydrogen 2.691 N/A ASP 327.A N ASP 324.A O no hydrogen 3.080 N/A LEU 328.A N LEU 325.A O no hydrogen 3.045 N/A LYS 333.A NZ ASP 221.A OD1 no hydrogen 3.102 N/A ALA 334.A N LYS 214.A O no hydrogen 3.347 N/A THR 335.A OG1 TYR 222.A OH no hydrogen 2.552 N/A THR 335.A OG1 VAL 337.A O no hydrogen 3.482 N/A LEU 336.A N GLN 195.A OE1 no hydrogen 3.365 N/A THR 340.A N GLN 153.A O no hydrogen 2.927 N/A ILE 346.A N ASP 72.A OD1 no hydrogen 2.758 N/A SER 347.A N ASP 72.A OD2 no hydrogen 2.715 N/A SER 347.A OG ASP 72.A OD2 no hydrogen 2.402 N/A GLN 348.A N GLU 65.A OE1 no hydrogen 3.075 N/A LEU 353.A N GLN 73.A OE1 no hydrogen 2.889 N/A PHE 354.A N ASP 352.A OD1 no hydrogen 3.121 N/A GLU 355.A N ASP 352.A O no hydrogen 2.998 N/A MET 357.A N PHE 354.A O no hydrogen 3.021 N/A VAL 360.A N PRO 79.A O no hydrogen 2.906 N/A VAL 362.A N PRO 359.A O no hydrogen 2.857 N/A GLN 363.A N PRO 359.A O no hydrogen 3.237 N/A GLN 364.A N VAL 360.A O no hydrogen 3.201 N/A SER 365.A N SER 361.A O no hydrogen 3.384 N/A SER 365.A OG SER 361.A O no hydrogen 2.966 N/A LEU 366.A N VAL 362.A O no hydrogen 2.889 N/A ALA 367.A N GLN 363.A O no hydrogen 3.156 N/A ALA 368.A N GLN 364.A O no hydrogen 3.057 N/A TYR 369.A N SER 365.A O no hydrogen 3.157 N/A ASN 370.A N LEU 366.A O no hydrogen 3.100 N/A ASN 370.A N ALA 367.A O no hydrogen 2.951 N/A GLN 371.A N ALA 367.A O no hydrogen 3.174 N/A ARG 372.A N TYR 369.A O no hydrogen 3.179 N/A LYS 373.A N TYR 369.A O no hydrogen 2.908 N/A ALA 374.A N ASN 370.A O no hydrogen 2.785 N/A LEU 376.A N ARG 372.A O no hydrogen 3.182 N/A VAL 377.A N LYS 373.A O no hydrogen 2.944 N/A ASN 378.A N ALA 374.A O no hydrogen 2.776 N/A ARG 379.A N ASP 375.A O no hydrogen 2.987 N/A SER 380.A N LEU 376.A O no hydrogen 3.286 N/A SER 380.A OG LEU 376.A O no hydrogen 2.603 N/A ILE 381.A N VAL 377.A O no hydrogen 2.863 N/A ALA 382.A N ASN 378.A O no hydrogen 2.710 N/A GLN 383.A N ARG 379.A O no hydrogen 2.804 N/A MET 384.A N SER 380.A O no hydrogen 3.117 N/A ARG 385.A N ILE 381.A O no hydrogen 3.043 N/A GLU 386.A N ALA 382.A O no hydrogen 3.127 N/A ALA 387.A N GLN 383.A O no hydrogen 3.191 N/A THR 388.A N MET 384.A O no hydrogen 2.907 N/A THR 388.A OG1 MET 384.A O no hydrogen 3.528 N/A THR 389.A N ARG 385.A O no hydrogen 2.777 N/A LEU 390.A N GLU 386.A O no hydrogen 2.965 N/A ALA 391.A N ALA 387.A O no hydrogen 3.105 N/A ASN 392.A N THR 388.A O no hydrogen 2.925 N/A GLY 393.A N THR 389.A O no hydrogen 3.081 N/A VAL 394.A N LEU 390.A O no hydrogen 2.892 N/A LEU 395.A N ALA 391.A O no hydrogen 2.938 N/A ALA 396.A N ASN 392.A O no hydrogen 3.124 N/A SER 397.A N GLY 393.A O no hydrogen 3.149 N/A LEU 398.A N LEU 395.A O no hydrogen 3.047 N/A ASN 399.A N ALA 396.A O no hydrogen 2.733 N/A LEU 400.A N LEU 395.A O no hydrogen 2.698 N/A ALA 403.A N ASN 399.A O no hydrogen 2.703 N/A GLU 405.A N ALA 402.A O no hydrogen 2.647 N/A ASP 406.A N ALA 403.A O no hydrogen 3.412 N/A VAL 407.A N GLU 405.A O no hydrogen 3.067 N/A SER 408.A OG THR 411.A OG1 no hydrogen 3.313 N/A THR 411.A N SER 408.A O no hydrogen 3.512 N/A THR 411.A OG1 SER 408.A OG no hydrogen 3.313 N/A GLN 414.A NE2 GLN 414.A O no hydrogen 2.642 N/A GLN 414.A NE2 THR 418.A OG1 no hydrogen 3.135 N/A SER 415.A N GLU 405.A OE1 no hydrogen 2.555 N/A SER 415.A OG GLU 405.A OE1 no hydrogen 2.561 N/A LEU 417.A N PRO 413.A O no hydrogen 3.004 N/A THR 418.A N GLN 414.A O no hydrogen 2.820 N/A THR 418.A OG1 GLN 414.A O no hydrogen 3.381 N/A LYS 419.A N SER 415.A O no hydrogen 3.016 N/A SER 420.A N ILE 416.A O no hydrogen 2.781 N/A SER 420.A OG LEU 522.A O no hydrogen 2.764 N/A ARG 421.A N LEU 417.A O no hydrogen 2.928 N/A SER 422.A N THR 418.A O no hydrogen 2.808 N/A SER 422.A OG TYR 659.A OH no hydrogen 3.108 N/A VAL 423.A N LYS 419.A O no hydrogen 2.918 N/A ILE 424.A N SER 420.A O no hydrogen 2.893 N/A GLU 425.A N ARG 421.A O no hydrogen 3.089 N/A GLN 426.A N VAL 423.A O no hydrogen 3.087 N/A GLY 427.A N ILE 424.A O no hydrogen 3.239 N/A GLY 428.A N VAL 423.A O no hydrogen 3.109 N/A THR 431.A N GLY 428.A O no hydrogen 3.171 N/A THR 431.A OG1 GLN 426.A O no hydrogen 2.855 N/A ASP 433.A N ILE 429.A O no hydrogen 2.553 N/A GLN 434.A NE2 GLU 438.A OE2 no hydrogen 2.988 N/A LEU 435.A N THR 431.A O no hydrogen 3.413 N/A ILE 436.A N VAL 432.A O no hydrogen 3.117 N/A LYS 437.A N ASP 433.A O no hydrogen 3.137 N/A LYS 437.A N GLN 434.A O no hydrogen 2.795 N/A GLU 438.A N GLN 434.A O no hydrogen 2.877 N/A GLU 441.A N GLU 438.A O no hydrogen 3.150 N/A LEU 442.A N GLU 438.A O no hydrogen 3.051 N/A LEU 443.A N LEU 439.A O no hydrogen 3.038 N/A GLN 444.A N PRO 440.A O no hydrogen 3.122 N/A GLN 444.A NE2 GLU 448.A OE2 no hydrogen 3.154 N/A ARG 445.A N GLU 441.A O no hydrogen 2.900 N/A ARG 445.A NE THR 680.A OG1 no hydrogen 2.955 N/A ARG 445.A NH2 ASN 677.A OD1 no hydrogen 2.708 N/A ASN 446.A N LEU 442.A O no hydrogen 3.387 N/A ASN 446.A ND2 THR 680.A OG1 no hydrogen 2.796 N/A ARG 447.A N LEU 443.A O no hydrogen 2.987 N/A GLU 448.A N GLN 444.A O no hydrogen 2.836 N/A ILE 449.A N ARG 445.A O no hydrogen 3.094 N/A LEU 450.A N ASN 446.A O no hydrogen 3.098 N/A ASP 451.A N ARG 447.A O no hydrogen 2.883 N/A GLU 452.A N GLU 448.A O no hydrogen 2.970 N/A SER 453.A N ILE 449.A O no hydrogen 2.976 N/A SER 453.A OG ILE 449.A O no hydrogen 3.084 N/A LEU 454.A N LEU 450.A O no hydrogen 3.216 N/A ARG 455.A N ASP 451.A O no hydrogen 2.975 N/A ARG 455.A NH1 GLU 459.A OE2 no hydrogen 3.311 N/A LEU 456.A N GLU 452.A O no hydrogen 3.134 N/A ASP 458.A N LEU 454.A O no hydrogen 2.884 N/A GLU 459.A N ARG 455.A O no hydrogen 2.694 N/A GLU 460.A N LEU 456.A O no hydrogen 2.906 N/A GLU 461.A N LEU 457.A O no hydrogen 2.803 N/A ALA 462.A N ASP 458.A O no hydrogen 3.063 N/A ALA 462.A N GLU 459.A O no hydrogen 3.069 N/A THR 463.A N GLU 459.A O no hydrogen 3.219 N/A THR 463.A OG1 GLU 460.A O no hydrogen 3.380 N/A ASP 464.A N GLU 460.A O no hydrogen 3.042 N/A ASN 465.A N GLU 461.A O no hydrogen 3.151 N/A ASP 466.A N ALA 462.A O no hydrogen 3.059 N/A LEU 467.A N THR 463.A O no hydrogen 2.830 N/A ARG 468.A N ASP 464.A O no hydrogen 3.056 N/A ARG 468.A NH1 ASP 464.A OD2 no hydrogen 3.126 N/A ARG 468.A NH2 ASP 464.A OD1 no hydrogen 3.004 N/A ALA 469.A N ASN 465.A O no hydrogen 3.230 N/A LYS 470.A N ASP 466.A O no hydrogen 2.918 N/A PHE 471.A N LEU 467.A O no hydrogen 2.854 N/A TRP 475.A N PHE 471.A O no hydrogen 2.729 N/A TRP 475.A NE1 ASP 464.A OD1 no hydrogen 3.022 N/A ARG 477.A NH2 ASP 464.A OD1 no hydrogen 3.241 N/A SER 480.A N ASP 464.A OD2 no hydrogen 2.779 N/A SER 480.A OG GLU 460.A OE1 no hydrogen 2.537 N/A LEU 483.A N PRO 479.A O no hydrogen 3.375 N/A TYR 484.A N SER 480.A O no hydrogen 2.911 N/A TYR 484.A OH GLU 460.A OE1 no hydrogen 2.782 N/A LYS 485.A N GLU 482.A O no hydrogen 3.458 N/A ARG 488.A N TYR 484.A O no hydrogen 2.987 N/A ARG 488.A NH1 GLU 461.A OE1 no hydrogen 3.045 N/A ARG 488.A NH2 ASP 458.A OD1 no hydrogen 2.726 N/A ARG 488.A NH2 GLU 461.A OE1 no hydrogen 2.800 N/A ALA 489.A N PRO 486.A O no hydrogen 2.764 N/A GLU 490.A N PRO 486.A O no hydrogen 3.180 N/A GLY 491.A N LEU 487.A O no hydrogen 2.954 N/A THR 492.A N ARG 488.A O no hydrogen 3.135 N/A THR 492.A OG1 ARG 488.A O no hydrogen 3.076 N/A ASN 493.A N ALA 489.A O no hydrogen 3.175 N/A PHE 494.A N GLU 490.A O no hydrogen 2.820 N/A ARG 495.A N GLY 491.A O no hydrogen 2.936 N/A THR 496.A N THR 492.A O no hydrogen 3.094 N/A THR 496.A OG1 THR 492.A O no hydrogen 3.507 N/A VAL 497.A N ASN 493.A O no hydrogen 2.842 N/A LEU 498.A N PHE 494.A O no hydrogen 3.012 N/A ASP 499.A N ARG 495.A O no hydrogen 3.074 N/A LYS 500.A N THR 496.A O no hydrogen 3.362 N/A ALA 501.A N VAL 497.A O no hydrogen 2.927 N/A VAL 502.A N LEU 498.A O no hydrogen 3.007 N/A GLN 503.A N ASP 499.A O no hydrogen 3.183 N/A ALA 504.A N LYS 500.A O no hydrogen 3.048 N/A ASP 505.A N ALA 501.A O no hydrogen 2.905 N/A GLY 506.A N VAL 502.A O no hydrogen 2.980 N/A GLN 507.A N GLN 503.A O no hydrogen 3.359 N/A VAL 508.A N ALA 504.A O no hydrogen 3.034 N/A LYS 509.A N ASP 505.A O no hydrogen 2.961 N/A GLU 510.A N GLY 506.A O no hydrogen 3.121 N/A CYS 511.A N GLN 507.A O no hydrogen 3.120 N/A CYS 511.A SG HIS 515.A ND1 no hydrogen 3.700 N/A TYR 512.A N VAL 508.A O no hydrogen 2.981 N/A TYR 512.A OH ASP 433.A OD1 no hydrogen 2.501 N/A GLN 513.A N LYS 509.A O no hydrogen 2.938 N/A SER 514.A N GLU 510.A O no hydrogen 3.222 N/A SER 514.A OG GLU 510.A O no hydrogen 3.314 N/A HIS 515.A ND1 CYS 511.A O no hydrogen 2.772 N/A ARG 516.A NH1 ASP 433.A OD1 no hydrogen 2.819 N/A THR 518.A OG1 HIS 515.A O no hydrogen 2.954 N/A ILE 519.A N HIS 515.A O no hydrogen 3.310 N/A VAL 520.A N ARG 516.A O no hydrogen 3.179 N/A LEU 521.A N ASP 517.A O no hydrogen 3.149 N/A LEU 522.A N THR 518.A O no hydrogen 2.838 N/A CYS 523.A N ILE 519.A O no hydrogen 2.929 N/A CYS 523.A SG ILE 519.A O no hydrogen 3.583 N/A LYS 524.A N LEU 521.A O no hydrogen 2.857 N/A LEU 529.A N PRO 525.A O no hydrogen 2.900 N/A ASN 530.A N GLU 526.A O no hydrogen 2.744 N/A ASN 530.A ND2 ASP 410.A O no hydrogen 3.149 N/A ALA 531.A N PRO 527.A O no hydrogen 2.843 N/A ALA 532.A N LEU 529.A O no hydrogen 3.034 N/A ILE 533.A N ASN 530.A O no hydrogen 3.170 N/A MET 542.A N ALA 539.A O no hydrogen 3.115 N/A GLN 543.A N LYS 540.A O no hydrogen 3.120 N/A SER 545.A N MET 542.A O no hydrogen 3.278 N/A SER 545.A OG MET 542.A O no hydrogen 3.137 N/A ASN 549.A N SER 545.A O no hydrogen 3.366 N/A VAL 550.A N GLU 546.A O no hydrogen 3.239 N/A LEU 551.A N VAL 547.A O no hydrogen 2.946 N/A LYS 552.A N VAL 548.A O no hydrogen 2.728 N/A SER 553.A N ASN 549.A O no hydrogen 3.172 N/A SER 553.A OG ASN 549.A O no hydrogen 3.433 N/A LEU 554.A N VAL 550.A O no hydrogen 2.717 N/A LEU 555.A N LEU 551.A O no hydrogen 2.782 N/A SER 556.A N LYS 552.A O no hydrogen 3.025 N/A ASN 557.A N SER 553.A O no hydrogen 3.060 N/A LEU 558.A N LEU 554.A O no hydrogen 3.411 N/A ASP 559.A N LEU 555.A O no hydrogen 3.030 N/A GLU 560.A N SER 556.A O no hydrogen 3.091 N/A VAL 561.A N ASN 557.A O no hydrogen 2.796 N/A LYS 562.A N ASP 559.A O no hydrogen 3.030 N/A LYS 562.A NZ ASN 392.A OD1 no hydrogen 2.776 N/A LYS 563.A N ASP 559.A O no hydrogen 2.989 N/A GLU 564.A N GLU 560.A O no hydrogen 2.941 N/A ARG 565.A NE SER 617.A OG no hydrogen 3.149 N/A ARG 565.A NH1 THR 388.A OG1 no hydrogen 2.890 N/A ARG 565.A NH1 GLN 621.A OE1 no hydrogen 3.284 N/A ARG 565.A NH2 GLN 621.A OE1 no hydrogen 3.293 N/A GLU 566.A N LYS 563.A O no hydrogen 3.400 N/A LEU 568.A N GLU 564.A O no hydrogen 3.126 N/A GLU 569.A N ARG 565.A O no hydrogen 2.952 N/A ASN 570.A N GLU 566.A O no hydrogen 3.316 N/A ASP 571.A N GLY 567.A O no hydrogen 2.785 N/A ASP 571.A N LEU 568.A O no hydrogen 2.900 N/A LEU 572.A N LEU 568.A O no hydrogen 2.941 N/A LYS 573.A N GLU 569.A O no hydrogen 3.201 N/A LYS 573.A NZ GLU 569.A OE2 no hydrogen 3.217 N/A SER 574.A N ASN 570.A O no hydrogen 3.130 N/A SER 574.A N ASP 571.A O no hydrogen 3.255 N/A SER 574.A OG ASN 570.A O no hydrogen 2.902 N/A VAL 575.A N ASP 571.A O no hydrogen 3.367 N/A THR 580.A N ASP 578.A OD1 no hydrogen 3.425 N/A LYS 582.A N MET 579.A O no hydrogen 3.110 N/A LYS 582.A NZ GLU 602.A OE2 no hydrogen 3.215 N/A PHE 583.A N MET 579.A O no hydrogen 2.999 N/A LEU 584.A N THR 580.A O no hydrogen 2.807 N/A THR 585.A N SER 581.A O no hydrogen 3.280 N/A THR 585.A OG1 SER 581.A O no hydrogen 3.113 N/A ALA 586.A N LYS 582.A O no hydrogen 3.367 N/A LEU 587.A N LEU 584.A O no hydrogen 3.025 N/A ALA 588.A N LEU 584.A O no hydrogen 2.927 N/A GLN 589.A N THR 585.A O no hydrogen 2.897 N/A LEU 598.A N ASN 594.A O no hydrogen 3.372 N/A SER 599.A N GLU 595.A O no hydrogen 2.696 N/A SER 599.A OG GLU 595.A O no hydrogen 2.699 N/A SER 599.A OG GLU 595.A OE1 no hydrogen 3.013 N/A SER 599.A OG GLU 596.A O no hydrogen 3.476 N/A VAL 600.A N GLU 596.A O no hydrogen 3.002 N/A THR 601.A N ALA 597.A O no hydrogen 3.245 N/A THR 601.A OG1 ALA 597.A O no hydrogen 2.948 N/A GLU 602.A N LEU 598.A O no hydrogen 3.333 N/A LEU 603.A N SER 599.A O no hydrogen 2.672 N/A ASP 604.A N VAL 600.A O no hydrogen 3.201 N/A ARG 605.A N GLU 602.A O no hydrogen 3.091 N/A ARG 605.A NE GLU 602.A OE1 no hydrogen 2.667 N/A VAL 606.A N GLU 602.A O no hydrogen 2.843 N/A TYR 607.A N LEU 603.A O no hydrogen 2.770 N/A LEU 610.A N TYR 607.A O no hydrogen 3.014 N/A THR 611.A N TYR 607.A O no hydrogen 2.892 N/A THR 611.A OG1 TYR 607.A O no hydrogen 3.258 N/A THR 611.A OG1 GLY 608.A O no hydrogen 3.198 N/A THR 612.A OG1 GLY 608.A O no hydrogen 2.898 N/A LYS 613.A N GLY 609.A O no hydrogen 3.132 N/A VAL 614.A N LEU 610.A O no hydrogen 2.686 N/A GLU 616.A N THR 612.A O no hydrogen 2.900 N/A SER 617.A N LYS 613.A O no hydrogen 2.912 N/A SER 617.A OG GLU 564.A OE1 no hydrogen 3.492 N/A LEU 618.A N VAL 614.A O no hydrogen 3.436 N/A LYS 620.A N GLU 616.A O no hydrogen 2.907 N/A GLN 621.A N SER 617.A O no hydrogen 2.716 N/A GLN 621.A NE2 ALA 387.A O no hydrogen 3.037 N/A GLU 622.A N LEU 618.A O no hydrogen 2.889 N/A GLY 623.A N LYS 619.A O no hydrogen 3.131 N/A LEU 624.A N LYS 620.A O no hydrogen 3.118 N/A LEU 625.A N GLN 621.A O no hydrogen 2.631 N/A LYS 626.A N GLU 622.A O no hydrogen 2.994 N/A ASN 627.A N GLY 623.A O no hydrogen 3.196 N/A ASN 627.A ND2 GLY 623.A O no hydrogen 2.852 N/A ILE 628.A N LEU 624.A O no hydrogen 2.891 N/A GLN 629.A N LEU 625.A O no hydrogen 3.034 N/A VAL 630.A N LYS 626.A O no hydrogen 3.477 N/A SER 631.A N ASN 627.A O no hydrogen 3.124 N/A HIS 632.A N ILE 628.A O no hydrogen 2.771 N/A GLN 633.A N GLN 629.A O no hydrogen 3.336 N/A GLU 634.A N VAL 630.A O no hydrogen 3.267 N/A PHE 635.A N SER 631.A O no hydrogen 3.404 N/A LYS 637.A N GLU 634.A O no hydrogen 2.739 N/A LYS 639.A NZ GLU 649.A OE1 no hydrogen 3.181 N/A LYS 639.A NZ GLU 649.A OE2 no hydrogen 3.185 N/A ASN 642.A N GLN 640.A O no hydrogen 2.769 N/A ALA 645.A N ASN 642.A O no hydrogen 2.648 N/A ASN 646.A N ASN 642.A O no hydrogen 2.971 N/A ASN 646.A ND2 ASN 643.A OD1 no hydrogen 3.413 N/A LEU 647.A N ASN 643.A O no hydrogen 3.103 N/A ARG 648.A N GLU 644.A O no hydrogen 3.432 N/A ARG 648.A NE ASP 406.A OD2 no hydrogen 2.891 N/A ARG 648.A NH1 PRO 534.A O no hydrogen 3.263 N/A ARG 648.A NH2 ASP 406.A OD1 no hydrogen 2.698 N/A ARG 648.A NH2 ASP 406.A OD2 no hydrogen 3.503 N/A ARG 648.A NH2 THR 411.A O no hydrogen 2.653 N/A GLU 649.A N ALA 645.A O no hydrogen 2.875 N/A GLU 650.A N ASN 646.A O no hydrogen 3.030 N/A VAL 651.A N LEU 647.A O no hydrogen 3.186 N/A LEU 652.A N ARG 648.A O no hydrogen 2.989 N/A LYS 653.A N GLU 649.A O no hydrogen 2.886 N/A ASN 654.A N GLU 650.A O no hydrogen 2.877 N/A ASN 654.A ND2 GLU 650.A OE2 no hydrogen 3.462 N/A LEU 655.A N VAL 651.A O no hydrogen 2.861 N/A ALA 656.A N LEU 652.A O no hydrogen 3.146 N/A THR 657.A N LYS 653.A O no hydrogen 3.089 N/A THR 657.A OG1 LYS 653.A O no hydrogen 3.497 N/A ALA 658.A N ASN 654.A O no hydrogen 2.779 N/A TYR 659.A N LEU 655.A O no hydrogen 2.951 N/A TYR 659.A OH SER 422.A OG no hydrogen 3.108 N/A ASP 660.A N ALA 656.A O no hydrogen 3.056 N/A ASN 661.A N THR 657.A O no hydrogen 2.897 N/A PHE 662.A N ALA 658.A O no hydrogen 2.929 N/A VAL 663.A N TYR 659.A O no hydrogen 2.978 N/A GLU 664.A N ASP 660.A O no hydrogen 2.946 N/A LEU 665.A N ASN 661.A O no hydrogen 2.842 N/A VAL 666.A N PHE 662.A O no hydrogen 3.118 N/A ALA 667.A N VAL 663.A O no hydrogen 3.316 N/A ASN 668.A N GLU 664.A O no hydrogen 2.977 N/A LEU 669.A N LEU 665.A O no hydrogen 2.959 N/A LEU 669.A N VAL 666.A O no hydrogen 3.236 N/A LYS 670.A N VAL 666.A O no hydrogen 2.944 N/A GLU 671.A N ALA 667.A O no hydrogen 2.943 N/A GLY 672.A N ASN 668.A O no hydrogen 3.108 N/A THR 673.A N LEU 669.A O no hydrogen 2.938 N/A THR 673.A OG1 LEU 669.A O no hydrogen 2.994 N/A LYS 674.A N LYS 670.A O no hydrogen 2.887 N/A PHE 675.A N GLU 671.A O no hydrogen 2.906 N/A TYR 676.A N GLY 672.A O no hydrogen 3.100 N/A TYR 676.A OH ASP 505.A OD2 no hydrogen 3.198 N/A ASN 677.A N THR 673.A O no hydrogen 2.965 N/A ASN 677.A ND2 THR 673.A O no hydrogen 2.436 N/A GLU 678.A N LYS 674.A O no hydrogen 2.925 N/A LEU 679.A N PHE 675.A O no hydrogen 2.860 N/A THR 680.A N TYR 676.A O no hydrogen 3.001 N/A THR 680.A OG1 TYR 676.A O no hydrogen 3.194 N/A GLU 681.A N ASN 677.A O no hydrogen 3.181 N/A ILE 682.A N GLU 678.A O no hydrogen 2.950 N/A LEU 683.A N LEU 679.A O no hydrogen 2.812 N/A VAL 684.A N THR 680.A O no hydrogen 2.780 N/A ARG 685.A N GLU 681.A O no hydrogen 3.338 N/A PHE 686.A N ILE 682.A O no hydrogen 3.056 N/A GLN 687.A N LEU 683.A O no hydrogen 2.986 N/A GLN 687.A N VAL 684.A O no hydrogen 3.194 N/A ASN 688.A N VAL 684.A O no hydrogen 3.243 N/A ASN 688.A N ARG 685.A O no hydrogen 2.741 N/A LYS 689.A N ARG 685.A O no hydrogen 3.122 N/A CYS 690.A N PHE 686.A O no hydrogen 3.324 N/A CYS 690.A SG SER 453.A O no hydrogen 3.906 N/A CYS 690.A SG PHE 686.A O no hydrogen 3.368 N/A SER 691.A N GLN 687.A O no hydrogen 3.115 N/A SER 691.A OG GLN 687.A O no hydrogen 3.278 N/A SER 691.A OG ASN 688.A O no hydrogen 3.541 N/A ASP 692.A N ASN 688.A O no hydrogen 2.872 N/A ILE 693.A N LYS 689.A O no hydrogen 3.325 N/A VAL 694.A N CYS 690.A O no hydrogen 2.993 N/A VAL 694.A N SER 691.A O no hydrogen 3.121 N/A PHE 695.A N SER 691.A O no hydrogen 3.021 N/A ARG 697.A NH1 THR 478.A O no hydrogen 3.276 N/A ARG 697.A NH2 THR 478.A O no hydrogen 2.818 N/A ARG 697.A NH2 SER 480.A OG no hydrogen 3.162 N/A