Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8szf_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A NE2 GLU 321.A OE1 no hydrogen 3.233 N/A ARG 6.A NE PRO 3.A O no hydrogen 3.043 N/A ARG 6.A NH2 PRO 3.A O no hydrogen 2.527 N/A ALA 7.A N ILE 78.A O no hydrogen 3.175 N/A GLN 8.A N HIS 315.A O no hydrogen 3.307 N/A LYS 9.A N TYR 76.A O no hydrogen 3.068 N/A ASP 12.A N THR 73.A OG1 no hydrogen 3.225 N/A ILE 13.A N THR 73.A O no hydrogen 3.404 N/A LEU 15.A N GLY 75.A O no hydrogen 2.913 N/A GLY 16.A N ALA 111.A O no hydrogen 2.840 N/A GLY 17.A N ARG 77.A O no hydrogen 3.237 N/A PHE 19.A N PHE 79.A O no hydrogen 3.335 N/A ILE 21.A N ASP 80.A OD1 no hydrogen 2.571 N/A HIS 22.A ND1 ASP 80.A OD2 no hydrogen 3.384 N/A HIS 22.A NE2 GLU 321.A OE2 no hydrogen 3.005 N/A PHE 23.A N ARG 43.A O no hydrogen 2.725 N/A ALA 26.A N GLU 40.A O no hydrogen 2.693 N/A ILE 42.A N GLY 24.A O no hydrogen 3.206 N/A ARG 43.A NH1 GLU 248.A OE1 no hydrogen 3.093 N/A TYR 44.A OH PHE 318.A O no hydrogen 3.388 N/A ASN 45.A N ILE 21.A O no hydrogen 2.811 N/A ASN 45.A ND2 PRO 20.A O no hydrogen 3.341 N/A PHE 49.A N ASN 45.A O no hydrogen 3.024 N/A ARG 50.A N PHE 46.A O no hydrogen 2.904 N/A TRP 51.A N ARG 47.A O no hydrogen 2.956 N/A LEU 52.A N GLY 48.A O no hydrogen 2.976 N/A GLN 53.A N PHE 49.A O no hydrogen 2.935 N/A GLN 53.A NE2 TYR 351.A OH no hydrogen 3.176 N/A ALA 54.A N ARG 50.A O no hydrogen 2.893 N/A MET 55.A N TRP 51.A O no hydrogen 3.055 N/A ILE 56.A N LEU 52.A O no hydrogen 3.017 N/A PHE 57.A N GLN 53.A O no hydrogen 2.865 N/A ALA 58.A N ALA 54.A O no hydrogen 2.968 N/A ILE 59.A N MET 55.A O no hydrogen 3.021 N/A GLU 60.A N ILE 56.A O no hydrogen 2.940 N/A GLU 61.A N PHE 57.A O no hydrogen 2.925 N/A ILE 62.A N ALA 58.A O no hydrogen 2.967 N/A ASN 63.A N ILE 59.A O no hydrogen 2.940 N/A ASN 63.A ND2 LEU 74.A O no hydrogen 3.183 N/A SER 64.A N GLU 60.A O no hydrogen 2.916 N/A SER 65.A N GLU 61.A O no hydrogen 2.942 N/A ALA 67.A N SER 65.A OG no hydrogen 3.420 N/A THR 73.A N ASP 12.A OD2 no hydrogen 3.446 N/A LEU 74.A N ASN 63.A OD1 no hydrogen 3.018 N/A GLY 75.A N ILE 13.A O no hydrogen 2.669 N/A TYR 76.A N LYS 9.A O no hydrogen 3.247 N/A ARG 77.A N LEU 15.A O no hydrogen 2.931 N/A ARG 77.A NH2 SER 94.A O no hydrogen 3.551 N/A ILE 78.A N ALA 7.A O no hydrogen 2.953 N/A PHE 79.A N GLY 17.A O no hydrogen 3.146 N/A THR 81.A N PHE 19.A O no hydrogen 3.184 N/A CYS 82.A N ASP 80.A OD1 no hydrogen 3.301 N/A CYS 82.A SG ASP 80.A OD2 no hydrogen 3.180 N/A ASN 83.A N THR 81.A OG1 no hydrogen 3.365 N/A THR 84.A N THR 81.A O no hydrogen 3.054 N/A THR 84.A OG1 CYS 82.A O no hydrogen 2.975 N/A LYS 87.A NZ VAL 39.A O no hydrogen 3.426 N/A ALA 88.A N THR 84.A O no hydrogen 3.375 N/A LEU 89.A N VAL 85.A O no hydrogen 3.006 N/A GLU 90.A N SER 86.A O no hydrogen 3.379 N/A ALA 91.A N LYS 87.A O no hydrogen 3.445 N/A THR 92.A N ALA 88.A O no hydrogen 3.015 N/A THR 92.A OG1 ALA 88.A O no hydrogen 2.630 N/A LEU 93.A N LEU 89.A O no hydrogen 3.140 N/A SER 94.A N ALA 91.A O no hydrogen 3.206 N/A SER 94.A OG ALA 91.A O no hydrogen 2.800 N/A PHE 95.A N ALA 91.A O no hydrogen 3.330 N/A VAL 96.A N THR 92.A O no hydrogen 3.400 N/A ALA 97.A N SER 94.A O no hydrogen 3.316 N/A GLN 98.A NE2 GLN 98.A O no hydrogen 2.956 N/A LYS 100.A N VAL 96.A O no hydrogen 2.977 N/A ILE 101.A N GLN 98.A O no hydrogen 3.256 N/A LEU 104.A N LYS 100.A O no hydrogen 2.659 N/A SER 108.A OG ASN 99.A OD1 no hydrogen 3.112 N/A ILE 110.A N ILE 14.A O no hydrogen 3.312 N/A VAL 112.A N PRO 134.A O no hydrogen 3.202 N/A VAL 113.A N GLY 16.A O no hydrogen 2.872 N/A GLY 114.A N VAL 136.A O no hydrogen 2.398 N/A SER 121.A N GLY 117.A O no hydrogen 2.911 N/A SER 121.A OG GLY 117.A O no hydrogen 3.077 N/A SER 121.A OG SER 140.A OG no hydrogen 2.558 N/A THR 122.A N SER 118.A O no hydrogen 2.891 N/A THR 122.A OG1 SER 118.A O no hydrogen 3.139 N/A THR 122.A OG1 GLY 119.A O no hydrogen 2.510 N/A ALA 123.A N GLY 119.A O no hydrogen 2.961 N/A VAL 124.A N VAL 120.A O no hydrogen 2.923 N/A ALA 125.A N SER 121.A O no hydrogen 2.872 N/A ASN 126.A N THR 122.A O no hydrogen 2.962 N/A LEU 128.A N VAL 124.A O no hydrogen 2.919 N/A GLY 129.A N ALA 125.A O no hydrogen 2.908 N/A LEU 130.A N LEU 127.A O no hydrogen 3.414 N/A ILE 133.A N LEU 128.A O no hydrogen 3.379 N/A GLN 135.A N SER 153.A O no hydrogen 3.037 N/A VAL 136.A N VAL 112.A O no hydrogen 2.992 N/A SER 137.A N LEU 155.A O no hydrogen 2.929 N/A SER 137.A OG ALA 115.A O no hydrogen 3.088 N/A SER 137.A OG SER 140.A OG no hydrogen 3.232 N/A TYR 138.A OH LEU 18.A O no hydrogen 2.679 N/A SER 140.A N SER 137.A OG no hydrogen 3.194 N/A SER 140.A OG THR 116.A O no hydrogen 3.212 N/A SER 140.A OG GLY 117.A O no hydrogen 3.416 N/A SER 140.A OG SER 121.A OG no hydrogen 2.558 N/A SER 140.A OG SER 137.A OG no hydrogen 3.232 N/A SER 141.A OG ASP 161.A OD1 no hydrogen 3.123 N/A SER 141.A OG ASP 161.A OD2 no hydrogen 2.844 N/A SER 142.A OG ASP 188.A O no hydrogen 2.921 N/A LEU 144.A N SER 142.A OG no hydrogen 3.416 N/A LEU 145.A N SER 142.A O no hydrogen 3.442 N/A SER 146.A N ARG 143.A O no hydrogen 3.400 N/A SER 146.A OG ASP 427.A OD2 no hydrogen 3.311 N/A LYS 148.A NZ LEU 145.A O no hydrogen 3.559 N/A LYS 148.A NZ CYS 425.A O no hydrogen 3.219 N/A ASN 149.A N ASN 147.A OD1 no hydrogen 3.256 N/A ASN 149.A ND2 ASN 147.A OD1 no hydrogen 3.220 N/A GLN 150.A NE2 ASN 126.A OD1 no hydrogen 3.616 N/A PHE 151.A N ASN 147.A O no hydrogen 3.265 N/A SER 153.A OG ILE 133.A O no hydrogen 2.847 N/A LEU 155.A N GLN 135.A O no hydrogen 2.884 N/A ARG 156.A N GLY 426.A O no hydrogen 3.325 N/A ARG 156.A NH1 SER 140.A O no hydrogen 3.087 N/A ARG 156.A NH1 SER 142.A O no hydrogen 2.892 N/A ARG 156.A NH2 SER 142.A O no hydrogen 2.944 N/A ARG 156.A NH2 SER 146.A OG no hydrogen 3.130 N/A THR 157.A N SER 137.A O no hydrogen 3.091 N/A THR 157.A OG1 SER 137.A O no hydrogen 3.476 N/A THR 157.A OG1 ASN 362.A O no hydrogen 3.485 N/A ALA 165.A N ASP 161.A O no hydrogen 2.932 N/A THR 166.A N GLU 162.A O no hydrogen 2.985 N/A THR 166.A OG1 GLU 162.A O no hydrogen 2.858 N/A ALA 167.A N HIS 163.A O no hydrogen 2.859 N/A MET 168.A N GLN 164.A O no hydrogen 2.944 N/A ALA 169.A N ALA 165.A O no hydrogen 3.025 N/A ASP 170.A N THR 166.A O no hydrogen 2.883 N/A ILE 171.A N ALA 167.A O no hydrogen 2.891 N/A ILE 172.A N MET 168.A O no hydrogen 2.992 N/A GLU 173.A N ALA 169.A O no hydrogen 2.942 N/A TYR 174.A N ASP 170.A O no hydrogen 2.837 N/A PHE 175.A N ILE 171.A O no hydrogen 3.010 N/A ARG 176.A N GLU 173.A O no hydrogen 3.323 N/A TRP 177.A N ILE 172.A O no hydrogen 3.372 N/A TRP 177.A NE1 PRO 481.A O no hydrogen 3.186 N/A TRP 179.A NE1 THR 234.A OG1 no hydrogen 3.028 N/A VAL 180.A N CYS 207.A O no hydrogen 3.254 N/A GLY 181.A N VAL 237.A O no hydrogen 3.125 N/A THR 182.A N PHE 210.A O no hydrogen 2.981 N/A THR 182.A OG1 PHE 210.A O no hydrogen 3.347 N/A ILE 183.A N VAL 239.A O no hydrogen 2.818 N/A ALA 184.A N GLU 212.A O no hydrogen 3.072 N/A ALA 185.A N PHE 241.A O no hydrogen 2.901 N/A ASP 186.A N ILE 214.A O no hydrogen 2.941 N/A ASP 187.A N ALA 185.A O no hydrogen 3.028 N/A TYR 189.A OH SER 267.A OG no hydrogen 3.169 N/A GLY 190.A N ASP 187.A OD1 no hydrogen 3.379 N/A ARG 191.A NH1 ASP 186.A OD1 no hydrogen 2.716 N/A ILE 194.A N GLY 190.A O no hydrogen 2.915 N/A GLU 195.A N ARG 191.A O no hydrogen 2.922 N/A LYS 196.A N PRO 192.A O no hydrogen 2.947 N/A PHE 197.A N GLY 193.A O no hydrogen 2.924 N/A ARG 198.A N ILE 194.A O no hydrogen 2.900 N/A ARG 198.A NE GLU 195.A OE2 no hydrogen 2.905 N/A ARG 198.A NH1 GLU 202.A OE1 no hydrogen 3.246 N/A ARG 198.A NH2 GLU 195.A OE2 no hydrogen 2.794 N/A GLU 199.A N GLU 195.A O no hydrogen 2.975 N/A GLU 200.A N LYS 196.A O no hydrogen 2.940 N/A ALA 201.A N PHE 197.A O no hydrogen 2.849 N/A GLU 202.A N ARG 198.A O no hydrogen 2.966 N/A ARG 204.A N ALA 201.A O no hydrogen 3.241 N/A ARG 204.A NH1 GLU 200.A O no hydrogen 3.355 N/A ARG 204.A NH1 GLU 200.A OE1 no hydrogen 2.706 N/A ARG 204.A NH2 ASP 170.A OD1 no hydrogen 2.604 N/A ILE 206.A N ALA 201.A O no hydrogen 3.414 N/A CYS 207.A N ASN 178.A O no hydrogen 3.111 N/A ASP 209.A N VAL 180.A O no hydrogen 2.669 N/A GLU 212.A N THR 182.A O no hydrogen 3.245 N/A ILE 214.A N ALA 184.A O no hydrogen 3.133 N/A TYR 217.A N SER 215.A OG no hydrogen 3.155 N/A SER 218.A N SER 215.A O no hydrogen 3.446 N/A SER 218.A OG SER 215.A O no hydrogen 3.559 N/A SER 218.A OG GLU 222.A OE1 no hydrogen 3.405 N/A ASP 219.A N GLU 222.A OE1 no hydrogen 3.385 N/A GLU 222.A N ASP 219.A OD1 no hydrogen 2.889 N/A ILE 223.A N ASP 219.A O no hydrogen 2.965 N/A GLN 224.A N GLU 220.A O no hydrogen 2.885 N/A HIS 225.A N GLU 221.A O no hydrogen 2.907 N/A VAL 226.A N GLU 222.A O no hydrogen 2.975 N/A VAL 227.A N ILE 223.A O no hydrogen 2.916 N/A GLU 228.A N GLN 224.A O no hydrogen 2.899 N/A VAL 229.A N HIS 225.A O no hydrogen 2.957 N/A ILE 230.A N VAL 226.A O no hydrogen 2.933 N/A GLN 231.A N VAL 227.A O no hydrogen 2.875 N/A ASN 232.A N GLU 228.A O no hydrogen 2.980 N/A SER 233.A N ILE 230.A O no hydrogen 3.342 N/A SER 233.A OG ASP 209.A OD2 no hydrogen 2.604 N/A ALA 235.A N SER 233.A OG no hydrogen 3.140 N/A LYS 236.A NZ PHE 482.A O no hydrogen 3.352 N/A ILE 238.A N ILE 263.A O no hydrogen 2.871 N/A VAL 239.A N GLY 181.A O no hydrogen 2.993 N/A VAL 240.A N LEU 265.A O no hydrogen 3.254 N/A PHE 241.A N ILE 183.A O no hydrogen 3.013 N/A SER 242.A OG SER 243.A O no hydrogen 2.979 N/A SER 243.A OG ASP 246.A OD2 no hydrogen 3.495 N/A LEU 247.A N GLY 244.A O no hydrogen 3.126 N/A GLU 248.A N GLY 244.A O no hydrogen 2.926 N/A ILE 251.A N LEU 247.A O no hydrogen 3.288 N/A LYS 252.A N GLU 248.A O no hydrogen 2.923 N/A GLU 253.A N PRO 249.A O no hydrogen 2.967 N/A ILE 254.A N LEU 250.A O no hydrogen 2.930 N/A VAL 255.A N ILE 251.A O no hydrogen 2.878 N/A ARG 256.A N LYS 252.A O no hydrogen 2.935 N/A ARG 256.A NH2 GLU 253.A OE2 no hydrogen 3.202 N/A ARG 257.A N GLU 253.A O no hydrogen 2.953 N/A ARG 257.A NE GLU 253.A OE2 no hydrogen 3.144 N/A ASN 258.A N VAL 255.A O no hydrogen 3.100 N/A ILE 259.A N ILE 254.A O no hydrogen 3.361 N/A LYS 262.A NZ ALA 235.A O no hydrogen 3.204 N/A ILE 263.A N LYS 236.A O no hydrogen 2.781 N/A TRP 264.A NE1 VAL 284.A O no hydrogen 2.911 N/A LEU 265.A N ILE 238.A O no hydrogen 2.965 N/A ALA 266.A N ILE 289.A O no hydrogen 2.858 N/A SER 267.A OG TYR 189.A OH no hydrogen 3.169 N/A GLU 268.A N GLN 164.A OE1 no hydrogen 2.927 N/A ALA 277.A N SER 273.A O no hydrogen 2.985 N/A MET 278.A N ILE 276.A O no hydrogen 2.828 N/A GLN 280.A N GLN 280.A OE1 no hydrogen 3.019 N/A TYR 281.A N MET 278.A O no hydrogen 3.117 N/A VAL 284.A N TYR 281.A O no hydrogen 2.945 N/A VAL 285.A N TYR 281.A O no hydrogen 2.928 N/A THR 288.A OG1 VAL 285.A O no hydrogen 2.956 N/A ILE 289.A N TRP 264.A O no hydrogen 3.289 N/A GLY 290.A N ILE 435.A O no hydrogen 3.268 N/A ALA 292.A N SER 433.A O no hydrogen 2.805 N/A GLY 296.A N LEU 357.A O no hydrogen 3.089 N/A PHE 301.A N ILE 298.A O no hydrogen 3.510 N/A ARG 302.A NH1 ILE 352.A O no hydrogen 3.315 N/A ARG 302.A NH2 ILE 352.A O no hydrogen 3.036 N/A GLU 303.A N GLU 303.A OE1 no hydrogen 2.465 N/A PHE 304.A N GLY 300.A O no hydrogen 2.956 N/A LEU 305.A N PHE 301.A O no hydrogen 2.856 N/A LYS 306.A N ARG 302.A O no hydrogen 2.969 N/A LYS 307.A N PHE 304.A O no hydrogen 3.265 N/A HIS 309.A NE2 GLY 340.A O no hydrogen 2.855 N/A ARG 311.A N HIS 309.A ND1 no hydrogen 3.224 N/A SER 313.A N HIS 309.A O no hydrogen 3.324 N/A SER 313.A OG HIS 309.A O no hydrogen 3.301 N/A GLY 317.A N ARG 6.A O no hydrogen 3.109 N/A LYS 320.A NZ PRO 310.A O no hydrogen 3.282 N/A PHE 322.A N PHE 318.A O no hydrogen 2.968 N/A TRP 323.A N ALA 319.A O no hydrogen 2.870 N/A TRP 323.A NE1 GLU 342.A OE1 no hydrogen 3.190 N/A GLU 324.A N LYS 320.A O no hydrogen 2.969 N/A GLU 325.A N GLU 321.A O no hydrogen 2.894 N/A THR 326.A N PHE 322.A O no hydrogen 2.897 N/A THR 326.A OG1 PHE 322.A O no hydrogen 2.568 N/A PHE 327.A N TRP 323.A O no hydrogen 2.968 N/A HIS 330.A N PRO 336.A O no hydrogen 2.917 N/A LEU 331.A N GLU 324.A OE2 no hydrogen 2.977 N/A CYS 338.A N HIS 330.A O no hydrogen 2.708 N/A THR 339.A N GLU 342.A OE2 no hydrogen 3.411 N/A THR 339.A OG1 ASP 341.A OD1 no hydrogen 3.536 N/A GLY 340.A N GLU 342.A OE1 no hydrogen 3.101 N/A GLU 342.A N GLU 342.A OE1 no hydrogen 2.821 N/A SER 346.A N ASN 343.A O no hydrogen 3.230 N/A SER 346.A OG ASN 343.A O no hydrogen 2.499 N/A TYR 351.A OH LEU 305.A O no hydrogen 3.247 N/A ASP 353.A N THR 349.A O no hydrogen 3.288 N/A THR 355.A OG1 HIS 356.A ND1 no hydrogen 3.241 N/A ARG 358.A NE LEU 293.A O no hydrogen 2.782 N/A TYR 361.A OH ASN 415.A OD1 no hydrogen 3.105 N/A ASN 362.A N ARG 358.A O no hydrogen 3.266 N/A ASN 362.A ND2 TYR 138.A O no hydrogen 3.331 N/A VAL 363.A N ILE 359.A O no hydrogen 2.969 N/A TYR 364.A N SER 360.A O no hydrogen 2.956 N/A TYR 364.A OH GLU 61.A OE1 no hydrogen 2.851 N/A LEU 365.A N TYR 361.A O no hydrogen 2.881 N/A ALA 366.A N ASN 362.A O no hydrogen 2.928 N/A VAL 367.A N VAL 363.A O no hydrogen 3.052 N/A TYR 368.A N TYR 364.A O no hydrogen 2.980 N/A SER 369.A N LEU 365.A O no hydrogen 2.843 N/A SER 369.A OG LEU 365.A O no hydrogen 2.438 N/A ILE 370.A N ALA 366.A O no hydrogen 3.057 N/A ALA 371.A N VAL 367.A O no hydrogen 2.995 N/A HIS 372.A N TYR 368.A O no hydrogen 2.884 N/A HIS 372.A ND1 TYR 368.A O no hydrogen 3.104 N/A ALA 373.A N SER 369.A O no hydrogen 2.970 N/A LEU 374.A N ILE 370.A O no hydrogen 3.016 N/A GLN 375.A N ALA 371.A O no hydrogen 2.909 N/A ASP 376.A N HIS 372.A O no hydrogen 2.892 N/A ILE 377.A N ALA 373.A O no hydrogen 2.988 N/A TYR 378.A N LEU 374.A O no hydrogen 2.901 N/A THR 379.A N GLN 375.A O no hydrogen 2.935 N/A THR 379.A OG1 GLN 375.A O no hydrogen 2.987 N/A CYS 380.A SG LEU 381.A O no hydrogen 3.880 N/A ARG 384.A N LEU 381.A O no hydrogen 3.114 N/A GLY 385.A N GLY 390.A O no hydrogen 2.659 N/A GLY 390.A N PHE 387.A O no hydrogen 3.081 N/A SER 391.A N THR 388.A O no hydrogen 3.115 N/A SER 391.A OG THR 388.A O no hydrogen 2.753 N/A CYS 392.A SG LEU 381.A O no hydrogen 3.104 N/A LYS 397.A N ASP 394.A O no hydrogen 3.234 N/A GLU 399.A N GLN 402.A OE1 no hydrogen 3.096 N/A TRP 401.A NE1 GLU 399.A OE1 no hydrogen 3.070 N/A VAL 403.A N GLU 399.A O no hydrogen 2.992 N/A LEU 404.A N ALA 400.A O no hydrogen 2.868 N/A LYS 405.A N TRP 401.A O no hydrogen 2.915 N/A LYS 405.A NZ HIS 409.A NE2 no hydrogen 3.214 N/A HIS 406.A N GLN 402.A O no hydrogen 3.019 N/A LEU 407.A N VAL 403.A O no hydrogen 2.872 N/A ARG 408.A N LEU 404.A O no hydrogen 2.902 N/A ARG 408.A NH2 LYS 152.A O no hydrogen 2.923 N/A HIS 409.A N LYS 405.A O no hydrogen 3.005 N/A PHE 412.A N VAL 420.A O no hydrogen 3.391 N/A THR 413.A OG1 GLN 419.A OE1 no hydrogen 2.316 N/A ASN 414.A N GLU 418.A O no hydrogen 2.917 N/A ASN 415.A ND2 GLN 297.A O no hydrogen 3.136 N/A MET 416.A N ASN 414.A OD1 no hydrogen 3.040 N/A GLY 417.A N ASN 414.A O no hydrogen 3.353 N/A GLU 418.A N ASN 414.A OD1 no hydrogen 2.812 N/A VAL 420.A N PHE 412.A O no hydrogen 2.821 N/A ASP 423.A N ASP 427.A O no hydrogen 3.470 N/A GLU 424.A N GLU 424.A OE1 no hydrogen 3.043 N/A CYS 425.A SG SER 146.A O no hydrogen 3.791 N/A GLY 426.A N ASP 423.A O no hydrogen 3.146 N/A ASP 427.A N ASP 423.A OD1 no hydrogen 2.370 N/A TYR 432.A N TYR 454.A O no hydrogen 3.227 N/A SER 433.A N ALA 292.A O no hydrogen 2.846 N/A ILE 434.A N GLY 452.A O no hydrogen 3.126 N/A ILE 435.A N GLY 290.A O no hydrogen 3.177 N/A ASN 436.A N LYS 449.A O no hydrogen 2.854 N/A ASN 436.A ND2 HIS 438.A NE2 no hydrogen 3.039 N/A ASN 436.A ND2 LEU 472.A O no hydrogen 3.683 N/A TRP 437.A N THR 288.A O no hydrogen 3.072 N/A HIS 438.A N VAL 447.A O no hydrogen 2.768 N/A SER 440.A N SER 445.A O no hydrogen 2.950 N/A SER 440.A OG GLU 442.A OE1 no hydrogen 3.296 N/A SER 445.A OG ASP 443.A OD2 no hydrogen 3.463 N/A VAL 447.A N HIS 438.A O no hydrogen 3.029 N/A LYS 449.A N ASN 436.A O no hydrogen 2.959 N/A VAL 451.A N ILE 434.A O no hydrogen 2.956 N/A TYR 453.A N PHE 465.A O no hydrogen 3.154 N/A TYR 454.A N TYR 432.A O no hydrogen 2.998 N/A TYR 454.A OH ASP 170.A OD2 no hydrogen 2.998 N/A ASN 455.A N ARG 463.A O no hydrogen 2.768 N/A VAL 456.A N ASN 431.A OD1 no hydrogen 3.436 N/A TYR 457.A N ASN 455.A OD1 no hydrogen 3.299 N/A GLU 462.A N LYS 459.A O no hydrogen 3.024 N/A ARG 463.A NE ALA 458.A O no hydrogen 3.217 N/A PHE 465.A N TYR 453.A O no hydrogen 3.200 N/A ASN 467.A N VAL 451.A O no hydrogen 2.776 N/A LYS 470.A N ASN 467.A O no hydrogen 3.315 N/A ILE 471.A N GLU 468.A O no hydrogen 3.176 N/A TRP 473.A N SER 477.A O no hydrogen 2.751 N/A GLY 475.A N LEU 472.A O no hydrogen 3.237 N/A PHE 476.A N TRP 473.A O no hydrogen 3.276 N/A SER 477.A N TRP 473.A O no hydrogen 2.817 N/A SER 483.A OG TRP 179.A O no hydrogen 3.037 N/A CYS 489.A N ASP 521.A OD1 no hydrogen 3.373 N/A CYS 489.A SG ARG 494.A O no hydrogen 3.976 N/A THR 493.A N LEU 490.A O no hydrogen 3.145 N/A ARG 494.A N VAL 509.A O no hydrogen 2.451 N/A ARG 494.A NH1 LYS 495.A O no hydrogen 3.213 N/A LYS 495.A N ALA 522.A O no hydrogen 3.143 N/A GLY 496.A N GLU 507.A O no hydrogen 2.415 N/A CYS 504.A SG ASN 178.A O no hydrogen 3.675 N/A CYS 505.A N PRO 502.A O no hydrogen 3.375 N/A GLU 507.A N GLY 496.A O no hydrogen 2.950 N/A VAL 509.A N ARG 494.A O no hydrogen 2.412 N/A CYS 511.A N GLY 492.A O no hydrogen 3.405 N/A CYS 511.A SG TYR 516.A O no hydrogen 3.939 N/A TYR 516.A N ASN 526.A O no hydrogen 2.998 N/A SER 517.A N HIS 538.A O no hydrogen 2.871 N/A SER 517.A OG GLU 519.A O no hydrogen 3.538 N/A GLU 519.A N GLU 519.A OE1 no hydrogen 2.463 N/A ASN 526.A N TYR 516.A O no hydrogen 3.098 N/A LYS 527.A NZ GLU 515.A OE2 no hydrogen 2.750 N/A PHE 532.A N PRO 529.A O no hydrogen 3.104 N/A TRP 533.A N ILE 542.A O no hydrogen 2.767 N/A SER 534.A OG ASP 513.A O no hydrogen 2.694 N/A ASN 535.A N SER 540.A O no hydrogen 2.962 N/A GLU 536.A N ASN 535.A OD1 no hydrogen 2.503 N/A HIS 538.A N ASN 535.A O no hydrogen 3.197 N/A LYS 544.A N ASP 531.A O no hydrogen 3.103 N/A LYS 544.A NZ ASP 530.A O no hydrogen 3.339 N/A LYS 544.A NZ ASP 683.A O no hydrogen 2.955 N/A GLU 547.A N ILE 686.A O no hydrogen 3.191 N/A SER 550.A N GLU 553.A OE1 no hydrogen 3.477 N/A SER 550.A OG TRP 551.A O no hydrogen 3.032 N/A THR 552.A OG1 TRP 551.A O no hydrogen 2.475 N/A ILE 557.A N GLU 553.A O no hydrogen 2.888 N/A ALA 558.A N PRO 554.A O no hydrogen 3.336 N/A LEU 559.A N PHE 555.A O no hydrogen 2.984 N/A THR 560.A N GLY 556.A O no hydrogen 2.894 N/A THR 560.A OG1 GLY 556.A O no hydrogen 3.012 N/A LEU 561.A N ILE 557.A O no hydrogen 2.907 N/A PHE 562.A N ALA 558.A O no hydrogen 2.947 N/A ALA 563.A N LEU 559.A O no hydrogen 2.957 N/A VAL 564.A N THR 560.A O no hydrogen 2.941 N/A LEU 565.A N LEU 561.A O no hydrogen 2.918 N/A GLY 566.A N PHE 562.A O no hydrogen 2.963 N/A ILE 567.A N ALA 563.A O no hydrogen 2.968 N/A PHE 568.A N VAL 564.A O no hydrogen 2.908 N/A LEU 569.A N LEU 565.A O no hydrogen 2.925 N/A THR 570.A N GLY 566.A O no hydrogen 2.990 N/A THR 570.A OG1 GLY 566.A O no hydrogen 2.982 N/A ALA 571.A N ILE 567.A O no hydrogen 2.944 N/A PHE 572.A N PHE 568.A O no hydrogen 2.886 N/A VAL 573.A N LEU 569.A O no hydrogen 2.979 N/A LEU 574.A N THR 570.A O no hydrogen 2.954 N/A GLY 575.A N ALA 571.A O no hydrogen 2.893 N/A VAL 576.A N PHE 572.A O no hydrogen 2.896 N/A PHE 577.A N VAL 573.A O no hydrogen 3.020 N/A ILE 578.A N LEU 574.A O no hydrogen 2.890 N/A LYS 579.A N GLY 575.A O no hydrogen 2.909 N/A PHE 580.A N VAL 576.A O no hydrogen 2.950 N/A ARG 581.A NH1 ILE 578.A O no hydrogen 3.024 N/A ALA 588.A N PRO 584.A O no hydrogen 3.089 N/A THR 589.A OG1 ILE 585.A O no hydrogen 3.447 N/A THR 589.A OG1 VAL 586.A O no hydrogen 2.916 N/A SER 594.A OG ASN 590.A O no hydrogen 3.377 N/A LEU 596.A N GLU 592.A O no hydrogen 3.050 N/A LEU 597.A N LEU 593.A O no hydrogen 2.874 N/A LEU 598.A N SER 594.A O no hydrogen 2.945 N/A PHE 599.A N TYR 595.A O no hydrogen 2.929 N/A SER 600.A N LEU 596.A O no hydrogen 2.929 N/A SER 600.A OG LEU 596.A O no hydrogen 2.788 N/A LEU 601.A N LEU 597.A O no hydrogen 2.918 N/A LEU 602.A N LEU 598.A O no hydrogen 2.994 N/A CYS 603.A N PHE 599.A O no hydrogen 2.955 N/A CYS 603.A SG PHE 599.A O no hydrogen 3.287 N/A CYS 604.A N SER 600.A O no hydrogen 3.007 N/A CYS 604.A N LEU 601.A O no hydrogen 2.959 N/A CYS 604.A SG SER 600.A O no hydrogen 3.558 N/A PHE 605.A N LEU 601.A O no hydrogen 3.206 N/A SER 606.A N LEU 602.A O no hydrogen 3.189 N/A SER 606.A OG LEU 602.A O no hydrogen 2.870 N/A SER 607.A N CYS 603.A O no hydrogen 2.993 N/A SER 608.A N CYS 604.A O no hydrogen 3.008 N/A SER 608.A OG PHE 605.A O no hydrogen 2.744 N/A LEU 609.A N PHE 605.A O no hydrogen 3.059 N/A PHE 610.A N SER 607.A O no hydrogen 2.934 N/A PHE 611.A N SER 608.A O no hydrogen 3.096 N/A GLY 613.A N LEU 549.A O no hydrogen 2.951 N/A GLN 616.A N THR 619.A OG1 no hydrogen 3.205 N/A TRP 618.A NE1 GLN 616.A OE1 no hydrogen 2.801 N/A THR 619.A N GLN 616.A O no hydrogen 3.314 N/A THR 619.A OG1 GLN 616.A O no hydrogen 3.036 N/A CYS 620.A N GLN 616.A O no hydrogen 3.280 N/A CYS 620.A SG GLN 616.A O no hydrogen 3.096 N/A LEU 622.A N THR 619.A O no hydrogen 3.271 N/A ARG 623.A N THR 619.A O no hydrogen 2.931 N/A ALA 626.A N LEU 622.A O no hydrogen 3.056 N/A GLY 628.A N GLN 624.A O no hydrogen 3.296 N/A ILE 629.A N PRO 625.A O no hydrogen 2.940 N/A SER 630.A N ALA 626.A O no hydrogen 3.504 N/A SER 630.A OG ALA 626.A O no hydrogen 3.324 N/A PHE 631.A N PHE 627.A O no hydrogen 2.941 N/A VAL 632.A N GLY 628.A O no hydrogen 2.929 N/A LEU 633.A N ILE 629.A O no hydrogen 2.968 N/A CYS 634.A N SER 630.A O no hydrogen 2.922 N/A CYS 634.A SG SER 630.A O no hydrogen 3.277 N/A ILE 635.A N PHE 631.A O no hydrogen 2.922 N/A SER 636.A N VAL 632.A O no hydrogen 2.897 N/A SER 636.A OG VAL 632.A O no hydrogen 3.383 N/A SER 636.A OG LEU 633.A O no hydrogen 2.678 N/A CYS 637.A N LEU 633.A O no hydrogen 2.947 N/A CYS 637.A SG LEU 633.A O no hydrogen 3.128 N/A ILE 638.A N CYS 634.A O no hydrogen 2.968 N/A LEU 639.A N ILE 635.A O no hydrogen 2.844 N/A VAL 640.A N SER 636.A O no hydrogen 2.974 N/A THR 642.A N LEU 639.A O no hydrogen 3.071 N/A GLN 649.A N GLY 645.A O no hydrogen 3.328 N/A PHE 650.A N ASN 647.A O no hydrogen 3.223 N/A LEU 651.A N LEU 648.A O no hydrogen 2.895 N/A LEU 655.A N LEU 651.A O no hydrogen 2.922 N/A CYS 656.A N LEU 652.A O no hydrogen 2.960 N/A CYS 656.A SG LEU 652.A O no hydrogen 3.180 N/A THR 657.A N VAL 653.A O no hydrogen 2.989 N/A THR 657.A OG1 VAL 653.A O no hydrogen 2.714 N/A PHE 658.A N PHE 654.A O no hydrogen 2.817 N/A MET 659.A N LEU 655.A O no hydrogen 3.006 N/A GLN 660.A N CYS 656.A O no hydrogen 3.082 N/A ILE 661.A N THR 657.A O no hydrogen 2.867 N/A VAL 662.A N PHE 658.A O no hydrogen 2.904 N/A ILE 663.A N MET 659.A O no hydrogen 3.052 N/A CYS 664.A N GLN 660.A O no hydrogen 3.143 N/A CYS 664.A SG GLN 660.A O no hydrogen 3.476 N/A VAL 665.A N ILE 661.A O no hydrogen 2.999 N/A ILE 666.A N VAL 662.A O no hydrogen 3.058 N/A TRP 667.A N ILE 663.A O no hydrogen 3.016 N/A LEU 668.A N CYS 664.A O no hydrogen 2.883 N/A TYR 669.A N VAL 665.A O no hydrogen 2.977 N/A THR 670.A N ILE 666.A O no hydrogen 3.012 N/A ALA 671.A N TRP 667.A O no hydrogen 2.766 N/A SER 674.A N HIS 691.A O no hydrogen 3.072 N/A SER 674.A OG SER 675.A O no hydrogen 3.387 N/A TYR 676.A N THR 689.A O no hydrogen 2.859 N/A ASN 678.A N PHE 687.A O no hydrogen 2.776 N/A GLN 679.A N GLU 680.A OE1 no hydrogen 3.344 N/A GLU 680.A N GLU 680.A OE1 no hydrogen 2.637 N/A GLU 684.A N GLU 684.A OE1 no hydrogen 2.618 N/A ILE 686.A N GLU 545.A O no hydrogen 2.978 N/A PHE 687.A N ASN 678.A O no hydrogen 3.024 N/A HIS 691.A N SER 674.A O no hydrogen 2.721 N/A SER 694.A OG GLY 693.A O no hydrogen 2.632 N/A GLY 699.A N LEU 695.A O no hydrogen 2.931 N/A PHE 700.A N MET 696.A O no hydrogen 2.910 N/A LEU 701.A N ALA 697.A O no hydrogen 2.910 N/A ILE 702.A N LEU 698.A O no hydrogen 3.003 N/A GLY 703.A N GLY 699.A O no hydrogen 2.848 N/A TYR 704.A N PHE 700.A O no hydrogen 2.912 N/A THR 705.A N LEU 701.A O no hydrogen 3.026 N/A THR 705.A OG1 LEU 701.A O no hydrogen 2.829 N/A CYS 706.A N ILE 702.A O no hydrogen 2.914 N/A CYS 706.A SG ILE 702.A O no hydrogen 3.194 N/A LEU 707.A N GLY 703.A O no hydrogen 2.854 N/A LEU 708.A N TYR 704.A O no hydrogen 3.007 N/A ALA 709.A N THR 705.A O no hydrogen 2.978 N/A ALA 710.A N CYS 706.A O no hydrogen 2.888 N/A ILE 711.A N LEU 707.A O no hydrogen 2.971 N/A CYS 712.A N LEU 708.A O no hydrogen 3.125 N/A PHE 713.A N ALA 709.A O no hydrogen 3.038 N/A PHE 714.A N ALA 710.A O no hydrogen 2.984 N/A PHE 715.A N ILE 711.A O no hydrogen 3.052 N/A ALA 716.A N CYS 712.A O no hydrogen 2.721 N/A PHE 717.A N PHE 713.A O no hydrogen 2.758 N/A LYS 718.A N PHE 714.A O no hydrogen 3.073 N/A SER 719.A N ALA 716.A O no hydrogen 3.335 N/A ARG 720.A NE PHE 717.A O no hydrogen 3.001 N/A GLU 728.A N GLU 724.A O no hydrogen 3.448 N/A ILE 732.A N GLU 728.A O no hydrogen 2.948 N/A THR 733.A N ALA 729.A O no hydrogen 2.917 N/A THR 733.A OG1 ALA 729.A O no hydrogen 2.919 N/A PHE 734.A N LYS 730.A O no hydrogen 3.140 N/A SER 735.A N PHE 731.A O no hydrogen 2.909 N/A SER 735.A OG PHE 731.A O no hydrogen 3.535 N/A SER 735.A OG ILE 732.A O no hydrogen 2.553 N/A MET 736.A N ILE 732.A O no hydrogen 2.995 N/A LEU 737.A N THR 733.A O no hydrogen 2.954 N/A ILE 738.A N PHE 734.A O no hydrogen 2.963 N/A PHE 739.A N SER 735.A O no hydrogen 3.277 N/A PHE 740.A N MET 736.A O no hydrogen 3.083 N/A ILE 741.A N LEU 737.A O no hydrogen 3.012 N/A VAL 742.A N ILE 738.A O no hydrogen 3.019 N/A TRP 743.A N PHE 739.A O no hydrogen 3.148 N/A ILE 744.A N PHE 740.A O no hydrogen 3.079 N/A SER 745.A N ILE 741.A O no hydrogen 2.965 N/A PHE 746.A N VAL 742.A O no hydrogen 2.996 N/A ILE 747.A N TRP 743.A O no hydrogen 3.190 N/A ILE 747.A N ILE 744.A O no hydrogen 3.369 N/A ALA 749.A N PHE 746.A O no hydrogen 3.162 N/A TYR 750.A N PHE 746.A O no hydrogen 3.504 N/A ALA 751.A N ILE 747.A O no hydrogen 3.038 N/A SER 752.A N PRO 748.A O no hydrogen 2.932 N/A SER 752.A N ALA 749.A O no hydrogen 3.188 N/A SER 752.A OG PRO 748.A O no hydrogen 3.092 N/A THR 753.A N ALA 749.A O no hydrogen 2.969 N/A THR 753.A OG1 ALA 749.A O no hydrogen 2.962 N/A TYR 754.A OH GLU 682.A OE2 no hydrogen 3.121 N/A LYS 756.A NZ PHE 548.A O no hydrogen 3.496 N/A LYS 756.A NZ GLU 553.A OE1 no hydrogen 3.411 N/A LYS 756.A NZ GLU 553.A OE2 no hydrogen 2.944 N/A SER 759.A OG LYS 756.A O no hydrogen 3.292 N/A ALA 760.A N PHE 757.A O no hydrogen 3.091 N/A VAL 761.A N PHE 757.A O no hydrogen 3.221 N/A VAL 763.A N SER 759.A O no hydrogen 3.299 N/A ILE 764.A N ALA 760.A O no hydrogen 2.964 N/A ALA 765.A N VAL 761.A O no hydrogen 2.886 N/A ILE 766.A N GLU 762.A O no hydrogen 2.970 N/A LEU 767.A N VAL 763.A O no hydrogen 2.972 N/A ALA 768.A N ILE 764.A O no hydrogen 2.905 N/A ALA 769.A N ALA 765.A O no hydrogen 2.928 N/A SER 770.A N ILE 766.A O no hydrogen 2.947 N/A SER 770.A OG ILE 766.A O no hydrogen 2.796 N/A PHE 771.A N LEU 767.A O no hydrogen 2.927 N/A GLY 772.A N ALA 768.A O no hydrogen 2.911 N/A LEU 773.A N ALA 769.A O no hydrogen 2.973 N/A LEU 774.A N SER 770.A O no hydrogen 2.931 N/A ALA 775.A N PHE 771.A O no hydrogen 2.914 N/A CYS 776.A N GLY 772.A O no hydrogen 3.277 N/A CYS 776.A SG GLY 772.A O no hydrogen 3.352 N/A ILE 777.A N LEU 773.A O no hydrogen 2.995 N/A PHE 778.A N LEU 774.A O no hydrogen 2.954 N/A PHE 778.A N ALA 775.A O no hydrogen 3.170 N/A PHE 779.A N ALA 775.A O no hydrogen 2.985 N/A ILE 782.A N PHE 778.A O no hydrogen 3.006 N/A TYR 783.A N PHE 779.A O no hydrogen 2.975 N/A ILE 785.A N LYS 781.A O no hydrogen 3.251 N/A LEU 786.A N ILE 782.A O no hydrogen 3.222 N/A SER 790.A N LYS 788.A O no hydrogen 2.629 N/A CYS 799.A N GLU 795.A O no hydrogen 2.600 N/A CYS 799.A SG GLU 795.A O no hydrogen 3.200 N/A SER 800.A N GLU 796.A O no hydrogen 2.816 N/A SER 800.A OG GLU 796.A O no hydrogen 3.322 N/A SER 800.A OG VAL 797.A O no hydrogen 2.842 N/A THR 801.A OG1 VAL 797.A O no hydrogen 3.450 N/A