Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5msg_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 7.A N ASN 5.A OD1 no hydrogen 2.951 N/A LEU 9.A N PRO 6.A O no hydrogen 3.213 N/A PHE 10.A N TYR 7.A O no hydrogen 3.023 N/A ILE 11.A N PHE 8.A O no hydrogen 3.403 N/A VAL 13.A N LEU 9.A O no hydrogen 2.803 N/A GLN 16.A N GLN 16.A OE1 no hydrogen 3.068 N/A ALA 17.A N PRO 14.A O no hydrogen 2.802 N/A ALA 18.A N PRO 14.A O no hydrogen 3.384 N/A THR 21.A N ALA 18.A O no hydrogen 3.418 N/A THR 21.A OG1 ALA 18.A O no hydrogen 2.716 N/A THR 22.A N ILE 19.A O no hydrogen 2.801 N/A THR 22.A OG1 ILE 19.A O no hydrogen 2.575 N/A PHE 23.A N SER 20.A O no hydrogen 3.419 N/A TYR 25.A N PHE 23.A O no hydrogen 3.009 N/A SER 32.A OG THR 229.A OG1 no hydrogen 3.079 N/A SER 32.A OG ASP 231.A OD1 no hydrogen 2.918 N/A SER 32.A OG ASP 231.A OD2 no hydrogen 3.081 N/A THR 35.A OG1 THR 37.A OG1 no hydrogen 2.750 N/A THR 35.A OG1 GLY 355.A O no hydrogen 3.012 N/A THR 37.A N THR 35.A OG1 no hydrogen 3.233 N/A THR 37.A OG1 THR 35.A OG1 no hydrogen 2.750 N/A THR 37.A OG1 LEU 352.A O no hydrogen 2.835 N/A THR 37.A OG1 GLY 355.A O no hydrogen 2.826 N/A THR 40.A N GLY 36.A O no hydrogen 3.062 N/A THR 40.A OG1 GLY 36.A O no hydrogen 2.671 N/A THR 40.A OG1 THR 227.A OG1 no hydrogen 3.107 N/A ILE 41.A N THR 37.A O no hydrogen 2.801 N/A ASP 42.A N GLY 38.A O no hydrogen 3.000 N/A THR 43.A N TYR 39.A O no hydrogen 3.236 N/A THR 43.A OG1 TYR 39.A O no hydrogen 3.005 N/A VAL 44.A N THR 40.A O no hydrogen 2.802 N/A ILE 45.A N ILE 41.A O no hydrogen 2.801 N/A ARG 46.A N ASP 42.A O no hydrogen 2.984 N/A ARG 46.A NH1 ASP 42.A OD2 no hydrogen 3.152 N/A ARG 46.A NH2 GLU 312.A OE1 no hydrogen 3.000 N/A THR 47.A N THR 43.A O no hydrogen 2.802 N/A THR 47.A OG1 THR 43.A O no hydrogen 2.633 N/A HIS 48.A N VAL 44.A O no hydrogen 3.186 N/A HIS 48.A ND1 VAL 44.A O no hydrogen 2.930 N/A GLU 49.A N ILE 45.A O no hydrogen 2.799 N/A TYR 50.A N ARG 46.A O no hydrogen 3.237 N/A SER 51.A OG THR 47.A O no hydrogen 3.415 N/A LYS 53.A N TYR 83.A OH no hydrogen 2.908 N/A LYS 53.A NZ ASN 52.A OD1 no hydrogen 3.294 N/A LYS 53.A NZ TYR 83.A OH no hydrogen 3.518 N/A GLY 54.A N SER 51.A O no hydrogen 2.802 N/A LYS 55.A N ASP 68.A O no hydrogen 2.800 N/A TYR 57.A N MET 66.A O no hydrogen 2.801 N/A SER 59.A N CYS 64.A O no hydrogen 3.088 N/A SER 59.A OG THR 62.A OG1 no hydrogen 3.188 N/A THR 62.A OG1 SER 59.A OG no hydrogen 3.188 N/A GLY 63.A N SER 59.A O no hydrogen 2.799 N/A CYS 64.A SG THR 62.A OG1 no hydrogen 3.371 N/A THR 65.A OG1 PRO 395.A O no hydrogen 2.749 N/A MET 66.A N TYR 57.A O no hydrogen 2.800 N/A ASP 68.A N LYS 55.A O no hydrogen 2.800 N/A THR 70.A OG1 ASP 68.A OD1 no hydrogen 2.668 N/A ASN 71.A N ALA 84.A O no hydrogen 3.182 N/A TYR 83.A N SER 81.A OG no hydrogen 3.219 N/A ALA 84.A N ALA 82.A O no hydrogen 2.993 N/A GLN 85.A N LEU 472.A O no hydrogen 2.941 N/A GLN 85.A NE2 GLY 72.A O no hydrogen 2.757 N/A GLN 85.A NE2 TYR 83.A O no hydrogen 3.374 N/A LEU 86.A N ASN 71.A OD1 no hydrogen 2.755 N/A VAL 89.A N GLN 85.A O no hydrogen 3.253 N/A LEU 90.A N LEU 86.A O no hydrogen 2.801 N/A GLU 91.A N ASP 87.A O no hydrogen 2.801 N/A ALA 92.A N CYS 88.A O no hydrogen 2.958 N/A LEU 93.A N VAL 89.A O no hydrogen 2.997 N/A ASP 94.A N LEU 90.A O no hydrogen 2.801 N/A ARG 95.A N GLU 91.A O no hydrogen 3.022 N/A MET 96.A N ALA 92.A O no hydrogen 3.244 N/A ASP 97.A N LEU 93.A O no hydrogen 2.800 N/A GLU 98.A N ASP 94.A O no hydrogen 2.916 N/A GLU 99.A N ARG 95.A O no hydrogen 2.804 N/A HIS 100.A N MET 96.A O no hydrogen 2.800 N/A ALA 107.A N LEU 103.A O no hydrogen 2.798 N/A SER 108.A N PHE 104.A O no hydrogen 2.801 N/A SER 108.A OG PHE 104.A O no hydrogen 2.666 N/A SER 108.A OG ILE 326.A O no hydrogen 2.773 N/A GLN 109.A N GLN 105.A O no hydrogen 2.954 N/A ASN 110.A N ALA 106.A O no hydrogen 2.800 N/A ALA 111.A N ALA 107.A O no hydrogen 3.010 N/A MET 112.A N SER 108.A O no hydrogen 3.163 N/A GLU 113.A N GLN 109.A O no hydrogen 2.799 N/A THR 114.A N ASN 110.A O no hydrogen 3.001 N/A THR 114.A OG1 ASN 110.A O no hydrogen 2.648 N/A LEU 115.A N ALA 111.A O no hydrogen 2.927 N/A MET 116.A N MET 112.A O no hydrogen 3.383 N/A VAL 117.A N THR 114.A O no hydrogen 2.801 N/A THR 118.A N THR 114.A O no hydrogen 3.013 N/A THR 118.A N LEU 115.A O no hydrogen 3.258 N/A THR 118.A OG1 THR 114.A O no hydrogen 2.892 N/A THR 119.A OG1 ASP 121.A OD1 no hydrogen 2.770 N/A THR 119.A OG1 ASP 121.A OD2 no hydrogen 3.082 N/A VAL 120.A N GLY 162.A O no hydrogen 3.341 N/A LEU 123.A N VAL 120.A O no hydrogen 3.225 N/A THR 124.A N ASP 121.A O no hydrogen 2.801 N/A THR 124.A OG1 ASP 121.A O no hydrogen 2.644 N/A ARG 127.A NH1 ASP 644.A OD2 no hydrogen 2.852 N/A ARG 127.A NH2 ASP 644.A OD2 no hydrogen 2.758 N/A GLN 128.A NE2 ASN 137.A O no hydrogen 3.375 N/A THR 129.A N GLN 138.A O no hydrogen 2.798 N/A THR 129.A OG1 GLY 126.A O no hydrogen 3.402 N/A PHE 130.A N ALA 245.A O no hydrogen 3.427 N/A ASP 131.A N ARG 136.A O no hydrogen 2.974 N/A THR 133.A N ASP 131.A OD1 no hydrogen 3.442 N/A THR 133.A OG1 ASP 131.A OD1 no hydrogen 2.852 N/A CYS 135.A N ASP 131.A O no hydrogen 2.800 N/A GLN 138.A N THR 129.A O no hydrogen 2.801 N/A ALA 140.A N ARG 127.A O no hydrogen 2.800 N/A THR 142.A OG1 PRO 139.A O no hydrogen 2.606 N/A ALA 143.A N PRO 139.A O no hydrogen 2.800 N/A LEU 144.A N ALA 140.A O no hydrogen 3.030 N/A ASN 145.A N ALA 141.A O no hydrogen 3.307 N/A ASN 145.A ND2 TYR 685.A OH no hydrogen 2.814 N/A THR 146.A N THR 142.A O no hydrogen 2.800 N/A THR 146.A OG1 ASP 131.A OD1 no hydrogen 3.043 N/A THR 146.A OG1 ASP 131.A OD2 no hydrogen 2.736 N/A THR 146.A OG1 THR 142.A O no hydrogen 3.251 N/A THR 146.A OG1 ALA 143.A O no hydrogen 2.811 N/A THR 147.A OG1 ALA 143.A O no hydrogen 2.734 N/A ILE 148.A N LEU 144.A O no hydrogen 2.801 N/A THR 149.A N ASN 145.A O no hydrogen 3.144 N/A THR 149.A OG1 ASN 145.A O no hydrogen 2.927 N/A THR 149.A OG1 THR 146.A O no hydrogen 2.966 N/A SER 150.A N THR 146.A O no hydrogen 3.118 N/A SER 150.A OG THR 181.A O no hydrogen 2.959 N/A PHE 151.A N THR 147.A O no hydrogen 3.153 N/A ARG 152.A N ILE 148.A O no hydrogen 3.199 N/A ARG 152.A NH2 ASP 160.A OD2 no hydrogen 3.430 N/A ASN 154.A N PHE 151.A O no hydrogen 2.802 N/A ASN 154.A ND2 THR 181.A O no hydrogen 3.112 N/A ASP 155.A N ARG 152.A O no hydrogen 3.429 N/A LEU 156.A N PHE 151.A O no hydrogen 3.150 N/A GLY 158.A N ASP 170.A OD2 no hydrogen 2.634 N/A ASP 160.A N ASN 157.A O no hydrogen 3.018 N/A LYS 161.A N GLY 158.A O no hydrogen 3.246 N/A GLY 162.A N ALA 159.A O no hydrogen 3.105 N/A LEU 164.A N THR 118.A O no hydrogen 3.084 N/A CYS 168.A N LEU 164.A O no hydrogen 2.803 N/A CYS 168.A SG LEU 164.A O no hydrogen 3.662 N/A GLN 169.A N ILE 165.A O no hydrogen 2.968 N/A GLN 169.A NE2 ASP 173.A OD2 no hydrogen 2.748 N/A ASP 170.A N PRO 166.A O no hydrogen 2.801 N/A ILE 171.A N PHE 167.A O no hydrogen 3.125 N/A ILE 172.A N CYS 168.A O no hydrogen 3.210 N/A ASP 173.A N GLN 169.A O no hydrogen 3.088 N/A SER 174.A N ASP 170.A O no hydrogen 2.799 N/A SER 174.A OG ASP 170.A O no hydrogen 3.259 N/A SER 174.A OG ILE 171.A O no hydrogen 2.581 N/A SER 174.A OG TYR 218.A OH no hydrogen 3.069 N/A ASP 176.A N ASP 173.A O no hydrogen 3.050 N/A ARG 177.A NE ASN 154.A O no hydrogen 3.187 N/A ARG 177.A NH2 ASP 155.A O no hydrogen 3.502 N/A MET 180.A N ILE 213.A O no hydrogen 3.064 N/A THR 181.A N ASN 154.A OD1 no hydrogen 3.087 N/A THR 181.A OG1 ASN 154.A OD1 no hydrogen 3.409 N/A PHE 182.A N ASP 211.A O no hydrogen 2.800 N/A SER 184.A N VAL 209.A O no hydrogen 3.002 N/A SER 184.A OG VAL 209.A O no hydrogen 3.208 N/A LYS 186.A N MET 207.A O no hydrogen 2.800 N/A ILE 188.A N ILE 205.A O no hydrogen 2.800 N/A LYS 190.A N LYS 203.A O no hydrogen 3.124 N/A LEU 192.A N LEU 201.A O no hydrogen 2.801 N/A ASN 196.A ND2 PHE 200.A O no hydrogen 2.738 N/A PHE 200.A N LYS 198.A O no hydrogen 2.645 N/A LYS 203.A N LYS 190.A O no hydrogen 3.081 N/A ILE 205.A N ILE 188.A O no hydrogen 2.801 N/A MET 207.A N LYS 186.A O no hydrogen 2.800 N/A VAL 209.A N SER 184.A O no hydrogen 2.801 N/A ASP 211.A N PHE 182.A O no hydrogen 2.800 N/A ILE 213.A N MET 180.A O no hydrogen 3.161 N/A THR 214.A N GLU 217.A OE1 no hydrogen 3.292 N/A THR 214.A OG1 GLU 217.A OE1 no hydrogen 2.943 N/A GLU 217.A N THR 214.A OG1 no hydrogen 3.393 N/A TYR 218.A N THR 214.A O no hydrogen 3.036 N/A TYR 218.A OH SER 174.A OG no hydrogen 3.069 N/A ILE 219.A N LYS 215.A O no hydrogen 2.803 N/A LYS 220.A N VAL 216.A O no hydrogen 2.804 N/A LYS 220.A NZ GLU 400.A OE1 no hydrogen 3.446 N/A LYS 220.A NZ GLU 400.A OE2 no hydrogen 3.399 N/A ARG 221.A N GLU 217.A O no hydrogen 3.009 N/A ARG 221.A NH1 TRP 132.A O no hydrogen 2.692 N/A ALA 222.A N TYR 218.A O no hydrogen 2.799 N/A LEU 223.A N ILE 219.A O no hydrogen 2.803 N/A SER 224.A N ARG 221.A O no hydrogen 3.312 N/A SER 224.A OG LYS 220.A O no hydrogen 2.638 N/A LEU 225.A N ILE 349.A O no hydrogen 3.012 N/A ASN 226.A N THR 244.A O no hydrogen 2.800 N/A THR 227.A OG1 THR 40.A OG1 no hydrogen 3.107 N/A THR 227.A OG1 ARG 351.A O no hydrogen 2.679 N/A MET 228.A N ILE 242.A O no hydrogen 3.093 N/A THR 229.A OG1 SER 32.A OG no hydrogen 3.079 N/A LYS 230.A N ARG 240.A O no hydrogen 2.800 N/A ALA 232.A N PRO 30.A O no hydrogen 2.979 N/A ARG 234.A NH2 GLY 27.A O no hydrogen 2.704 N/A ARG 239.A NE LYS 230.A O no hydrogen 3.627 N/A ARG 239.A NH1 LYS 236.A O no hydrogen 3.395 N/A ARG 240.A NE GLU 233.A OE2 no hydrogen 2.819 N/A ARG 240.A NH2 GLU 233.A OE2 no hydrogen 2.895 N/A ILE 242.A N MET 228.A O no hydrogen 3.351 N/A THR 244.A N ASN 226.A O no hydrogen 2.798 N/A GLN 248.A N GLN 248.A OE1 no hydrogen 2.900 N/A GLN 248.A NE2 TYR 218.A OH no hydrogen 3.405 N/A ARG 250.A N GLY 246.A O no hydrogen 3.364 N/A ARG 250.A NE ALA 245.A O no hydrogen 3.554 N/A VAL 253.A N ILE 249.A O no hydrogen 3.027 N/A LEU 254.A N ARG 250.A O no hydrogen 3.452 N/A GLU 257.A N VAL 253.A O no hydrogen 2.800 N/A ASN 258.A N LEU 254.A O no hydrogen 2.801 N/A LEU 259.A N VAL 255.A O no hydrogen 2.800 N/A ALA 260.A N VAL 256.A O no hydrogen 3.191 N/A LYS 261.A N GLU 257.A O no hydrogen 2.799 N/A ASN 262.A N ASN 258.A O no hydrogen 2.959 N/A ASN 262.A ND2 ALA 107.A O no hydrogen 3.262 N/A ILE 263.A N LEU 259.A O no hydrogen 3.374 N/A CYS 264.A N ALA 260.A O no hydrogen 2.800 N/A CYS 264.A SG MET 416.A O no hydrogen 3.640 N/A GLU 265.A N LYS 261.A O no hydrogen 2.943 N/A ASN 266.A ND2 ASN 262.A O no hydrogen 3.056 N/A LEU 267.A N ILE 263.A O no hydrogen 3.119 N/A SER 270.A OG CYS 264.A O no hydrogen 2.894 N/A SER 270.A OG LEU 267.A O no hydrogen 3.283 N/A SER 270.A OG LEU 272.A O no hydrogen 3.537 N/A GLY 271.A N GLN 442.A O no hydrogen 2.843 N/A ASN 277.A ND2 ASN 536.A OD1 no hydrogen 3.516 N/A GLU 278.A N GLY 275.A O no hydrogen 3.151 N/A LYS 279.A N GLY 275.A O no hydrogen 3.414 N/A LYS 280.A N GLY 276.A O no hydrogen 3.108 N/A LYS 280.A NZ ASN 536.A O no hydrogen 3.265 N/A ALA 281.A N ASN 277.A O no hydrogen 3.303 N/A LYS 282.A N GLU 278.A O no hydrogen 2.847 N/A LYS 282.A NZ LEU 267.A O no hydrogen 2.887 N/A LYS 282.A NZ SER 270.A O no hydrogen 3.293 N/A LEU 283.A N LYS 279.A O no hydrogen 3.100 N/A ASN 285.A N ALA 281.A O no hydrogen 2.802 N/A ALA 286.A N LYS 282.A O no hydrogen 3.094 N/A VAL 287.A N LEU 283.A O no hydrogen 2.799 N/A ALA 288.A N SER 284.A O no hydrogen 3.367 N/A LYS 289.A N ASN 285.A O no hydrogen 3.342 N/A MET 290.A N ALA 286.A O no hydrogen 3.349 N/A LEU 291.A N VAL 287.A O no hydrogen 2.797 N/A SER 292.A N ALA 288.A O no hydrogen 3.112 N/A SER 292.A OG ALA 288.A O no hydrogen 2.888 N/A ASN 293.A N LYS 289.A O no hydrogen 2.917 N/A CYS 294.A N LEU 291.A O no hydrogen 3.227 N/A CYS 294.A SG LEU 291.A O no hydrogen 3.248 N/A CYS 294.A SG PRO 295.A O no hydrogen 3.988 N/A ILE 299.A N ALA 453.A O no hydrogen 2.801 N/A SER 300.A OG ASN 452.A OD1 no hydrogen 2.648 N/A SER 300.A OG THR 487.A OG1 no hydrogen 3.104 N/A MET 301.A N VAL 451.A O no hydrogen 2.801 N/A THR 302.A N ASN 485.A O no hydrogen 2.800 N/A THR 302.A OG1 THR 487.A OG1 no hydrogen 2.728 N/A VAL 303.A N LEU 449.A O no hydrogen 2.797 N/A ASP 306.A N SER 482.A OG no hydrogen 2.962 N/A ASN 307.A N ASP 445.A O no hydrogen 2.995 N/A THR 308.A N ASN 476.A O no hydrogen 2.800 N/A CYS 313.A N LYS 309.A O no hydrogen 3.005 N/A CYS 313.A SG LYS 309.A O no hydrogen 3.302 N/A CYS 313.A SG ASN 476.A OD1 no hydrogen 3.078 N/A ARG 317.A N ASN 315.A OD1 no hydrogen 3.219 N/A ARG 317.A NE ASN 315.A OD1 no hydrogen 3.005 N/A ARG 317.A NH2 SER 406.A OG no hydrogen 3.160 N/A ILE 318.A N ASN 315.A O no hydrogen 3.319 N/A LEU 320.A N PRO 316.A O no hydrogen 2.925 N/A ALA 321.A N ARG 317.A O no hydrogen 3.199 N/A MET 322.A N ILE 318.A O no hydrogen 2.801 N/A THR 323.A N PHE 319.A O no hydrogen 3.287 N/A THR 323.A OG1 LEU 320.A O no hydrogen 2.692 N/A GLU 324.A N LEU 320.A O no hydrogen 3.452 N/A ARG 325.A NE ASP 94.A OD1 no hydrogen 2.879 N/A ARG 325.A NH1 ARG 325.A O no hydrogen 3.278 N/A ARG 325.A NH2 ASP 94.A OD1 no hydrogen 3.173 N/A ILE 326.A N MET 322.A O no hydrogen 3.120 N/A THR 327.A N THR 323.A O no hydrogen 2.799 N/A THR 327.A OG1 THR 323.A O no hydrogen 2.735 N/A THR 327.A OG1 GLU 324.A O no hydrogen 3.356 N/A ARG 335.A N PRO 331.A O no hydrogen 2.980 N/A ARG 335.A NH1 GLU 324.A O no hydrogen 2.673 N/A ASP 336.A N ILE 332.A O no hydrogen 3.094 N/A PHE 337.A N TRP 333.A O no hydrogen 2.800 N/A CYS 338.A N PHE 334.A O no hydrogen 2.802 N/A CYS 338.A SG PHE 334.A O no hydrogen 3.474 N/A SER 339.A N ARG 335.A O no hydrogen 3.293 N/A SER 339.A OG ARG 335.A O no hydrogen 3.420 N/A SER 339.A OG ASP 336.A O no hydrogen 2.728 N/A ILE 340.A N PHE 337.A O no hydrogen 3.448 N/A VAL 343.A N SER 339.A O no hydrogen 3.398 N/A LEU 344.A N ILE 340.A O no hydrogen 2.803 N/A PHE 345.A N ALA 341.A O no hydrogen 3.150 N/A SER 346.A N PRO 342.A O no hydrogen 3.079 N/A ASN 347.A N LEU 344.A O no hydrogen 2.802 N/A LYS 348.A NZ LEU 405.A O no hydrogen 2.624 N/A LYS 348.A NZ PRO 407.A O no hydrogen 3.018 N/A LYS 348.A NZ GLY 408.A O no hydrogen 3.050 N/A ILE 349.A N LEU 223.A O no hydrogen 2.799 N/A ALA 350.A N ALA 403.A O no hydrogen 2.799 N/A ARG 351.A N LEU 225.A O no hydrogen 3.069 N/A GLY 355.A N THR 35.A OG1 no hydrogen 3.280 N/A PHE 356.A N ILE 369.A O no hydrogen 2.814 N/A ILE 358.A N ALA 367.A O no hydrogen 2.801 N/A SER 360.A N LEU 365.A O no hydrogen 3.327 N/A SER 360.A OG THR 362.A OG1 no hydrogen 3.000 N/A THR 362.A OG1 SER 360.A OG no hydrogen 3.000 N/A ARG 364.A N SER 360.A O no hydrogen 2.800 N/A LEU 365.A N SER 360.A O no hydrogen 3.406 N/A ALA 367.A N ILE 358.A O no hydrogen 3.052 N/A ILE 369.A N PHE 356.A O no hydrogen 2.799 N/A CYS 371.A SG LEU 352.A O no hydrogen 3.190 N/A CYS 371.A SG GLY 353.A O no hydrogen 3.281 N/A CYS 371.A SG LYS 354.A O no hydrogen 3.251 N/A ASP 373.A N PRO 370.A O no hydrogen 2.801 N/A SER 376.A N ASP 373.A O no hydrogen 3.119 N/A SER 376.A OG ASP 373.A OD1 no hydrogen 3.478 N/A ARG 381.A N PRO 378.A O no hydrogen 2.803 N/A TYR 382.A OH LEU 374.A O no hydrogen 2.857 N/A THR 386.A N ASN 383.A OD1 no hydrogen 2.861 N/A THR 386.A OG1 ASN 383.A OD1 no hydrogen 2.719 N/A ARG 387.A N ASN 383.A O no hydrogen 2.797 N/A ARG 387.A NE LEU 379.A O no hydrogen 3.021 N/A ARG 387.A NH2 GLU 380.A O no hydrogen 3.542 N/A ALA 388.A N GLU 384.A O no hydrogen 3.268 N/A LYS 389.A NZ GLY 38.A O no hydrogen 3.141 N/A LYS 389.A NZ GLU 385.A OE2 no hydrogen 3.484 N/A LEU 390.A N THR 386.A O no hydrogen 3.089 N/A LYS 391.A N ARG 387.A O no hydrogen 3.308 N/A LYS 392.A N ALA 388.A O no hydrogen 3.194 N/A LEU 393.A N LYS 389.A O no hydrogen 3.008 N/A PHE 396.A N LEU 393.A O no hydrogen 3.015 N/A PHE 397.A N LEU 393.A O no hydrogen 2.801 N/A PHE 397.A N LYS 394.A O no hydrogen 3.359 N/A ASN 398.A N THR 402.A O no hydrogen 2.798 N/A ASN 398.A ND2 GLU 400.A OE1 no hydrogen 3.392 N/A ASN 398.A ND2 THR 402.A OG1 no hydrogen 2.842 N/A GLU 400.A N GLU 400.A OE2 no hydrogen 3.232 N/A GLY 401.A N ASN 398.A O no hydrogen 2.802 N/A THR 402.A OG1 GLU 400.A OE1 no hydrogen 3.246 N/A ALA 403.A N ALA 350.A O no hydrogen 2.961 N/A SER 404.A N PHE 396.A O no hydrogen 3.275 N/A SER 404.A OG THR 65.A O no hydrogen 3.491 N/A LEU 405.A N LYS 348.A O no hydrogen 3.181 N/A SER 406.A OG SER 346.A O no hydrogen 2.656 N/A MET 409.A N ASN 311.A O no hydrogen 2.800 N/A GLY 412.A N MET 410.A O no hydrogen 2.748 N/A PHE 414.A N GLY 412.A O no hydrogen 2.636 N/A ASN 415.A N GLU 257.A OE1 no hydrogen 3.386 N/A ASN 415.A N MET 413.A O no hydrogen 2.877 N/A MET 416.A N GLU 257.A OE2 no hydrogen 3.089 N/A SER 418.A OG PHE 414.A O no hydrogen 2.782 N/A SER 418.A OG ASN 415.A O no hydrogen 2.585 N/A THR 419.A N ASN 415.A O no hydrogen 2.800 N/A THR 419.A OG1 ASN 415.A O no hydrogen 2.715 N/A VAL 420.A N MET 416.A O no hydrogen 2.801 N/A LEU 421.A N LEU 417.A O no hydrogen 3.297 N/A GLY 422.A N SER 418.A O no hydrogen 3.297 N/A VAL 423.A N THR 419.A O no hydrogen 2.923 N/A ALA 424.A N VAL 420.A O no hydrogen 2.801 N/A ALA 425.A N LEU 421.A O no hydrogen 3.202 N/A LEU 426.A N GLY 422.A O no hydrogen 3.023 N/A GLY 427.A N VAL 423.A O no hydrogen 2.800 N/A ILE 428.A N ALA 425.A O no hydrogen 3.419 N/A ASN 430.A ND2 LYS 434.A O no hydrogen 2.842 N/A ASN 430.A ND2 TYR 436.A O no hydrogen 2.723 N/A ILE 431.A N TYR 436.A OH no hydrogen 3.319 N/A LYS 434.A N ASN 430.A OD1 no hydrogen 3.097 N/A LYS 434.A NZ ASP 465.A OD2 no hydrogen 3.233 N/A TYR 436.A OH ASP 465.A OD2 no hydrogen 2.694 N/A TRP 438.A N LYS 429.A O no hydrogen 3.138 N/A ASP 439.A N PHE 450.A O no hydrogen 3.240 N/A GLN 442.A NE2 SER 444.A O no hydrogen 2.786 N/A SER 443.A N ASP 446.A O no hydrogen 2.800 N/A SER 443.A OG GLN 442.A O no hydrogen 3.030 N/A ASP 446.A N SER 443.A O no hydrogen 2.994 N/A ALA 448.A N LEU 441.A O no hydrogen 3.247 N/A PHE 450.A N ASP 439.A O no hydrogen 2.799 N/A VAL 451.A N MET 301.A O no hydrogen 2.799 N/A ASN 452.A N LEU 437.A O no hydrogen 2.801 N/A ASN 452.A ND2 MET 290.A O no hydrogen 3.399 N/A ALA 453.A N ILE 299.A O no hydrogen 2.801 N/A THR 458.A OG1 ASP 455.A OD1 no hydrogen 2.634 N/A CYS 459.A N ASP 455.A O no hydrogen 3.269 N/A CYS 459.A SG VAL 451.A O no hydrogen 3.800 N/A CYS 459.A SG ASP 455.A O no hydrogen 3.597 N/A MET 460.A N GLU 456.A O no hydrogen 3.232 N/A GLY 462.A N THR 458.A O no hydrogen 2.985 N/A ILE 463.A N CYS 459.A O no hydrogen 2.969 N/A ASN 464.A N MET 460.A O no hydrogen 3.084 N/A ASP 465.A N GLU 461.A O no hydrogen 3.106 N/A PHE 466.A N GLY 462.A O no hydrogen 2.801 N/A TYR 467.A N ILE 463.A O no hydrogen 2.799 N/A ARG 468.A N ASN 464.A O no hydrogen 2.802 N/A THR 469.A N ASP 465.A O no hydrogen 3.171 N/A THR 469.A OG1 ASP 465.A O no hydrogen 2.554 N/A CYS 470.A N PHE 466.A O no hydrogen 3.002 N/A CYS 470.A SG PHE 466.A O no hydrogen 3.072 N/A LYS 471.A N TYR 467.A O no hydrogen 3.121 N/A LEU 472.A N THR 469.A O no hydrogen 2.801 N/A LEU 473.A N CYS 470.A O no hydrogen 3.169 N/A GLY 474.A N LYS 471.A O no hydrogen 3.244 N/A ILE 475.A N CYS 470.A O no hydrogen 2.801 N/A SER 478.A N ASP 306.A O no hydrogen 2.800 N/A LYS 481.A N SER 478.A OG no hydrogen 3.206 N/A SER 482.A N SER 478.A O no hydrogen 2.847 N/A SER 482.A OG SER 478.A O no hydrogen 2.737 N/A TYR 483.A N THR 304.A O no hydrogen 2.936 N/A CYS 484.A SG ASN 485.A O no hydrogen 3.811 N/A ASN 485.A N THR 302.A O no hydrogen 3.282 N/A ASN 485.A ND2 MET 489.A O no hydrogen 2.781 N/A THR 487.A N SER 300.A O no hydrogen 2.801 N/A THR 487.A OG1 SER 300.A O no hydrogen 2.817 N/A THR 487.A OG1 SER 300.A OG no hydrogen 3.104 N/A THR 487.A OG1 THR 302.A OG1 no hydrogen 2.728 N/A PHE 490.A N TYR 497.A O no hydrogen 2.804 N/A GLU 491.A N THR 304.A OG1 no hydrogen 3.389 N/A PHE 492.A N MET 495.A O no hydrogen 3.051 N/A THR 493.A N ASP 446.A OD2 no hydrogen 3.154 N/A THR 493.A OG1 PHE 492.A O no hydrogen 2.729 N/A SER 494.A N GLU 491.A OE2 no hydrogen 3.276 N/A MET 495.A N PHE 492.A O no hydrogen 2.801 N/A TYR 497.A N PHE 490.A O no hydrogen 2.953 N/A ARG 498.A N GLY 500.A O no hydrogen 2.902 N/A ASP 499.A N GLY 488.A O no hydrogen 2.798 N/A VAL 502.A N PHE 496.A O no hydrogen 2.802 N/A MET 507.A N ASN 504.A O no hydrogen 3.315 N/A LEU 509.A N PHE 505.A O no hydrogen 3.147 N/A SER 511.A N GLU 508.A O no hydrogen 2.801 N/A SER 511.A OG GLU 508.A O no hydrogen 2.547 N/A PHE 512.A N LEU 509.A O no hydrogen 3.166 N/A GLY 513.A N PRO 510.A O no hydrogen 3.277 N/A GLY 516.A N ASP 522.A OD2 no hydrogen 2.756 N/A VAL 517.A N ASP 522.A OD1 no hydrogen 2.934 N/A ASN 518.A N ASP 522.A OD1 no hydrogen 2.967 N/A ASN 518.A ND2 TRP 662.A O no hydrogen 3.269 N/A SER 520.A N HIS 660.A O no hydrogen 3.398 N/A SER 520.A OG VAL 656.A O no hydrogen 3.297 N/A SER 520.A OG SER 661.A OG no hydrogen 3.365 N/A ALA 521.A N ASN 518.A OD1 no hydrogen 2.865 N/A ASP 522.A N ASN 518.A O no hydrogen 2.798 N/A ILE 525.A N ALA 521.A O no hydrogen 2.801 N/A GLY 526.A N ASP 522.A O no hydrogen 2.798 N/A MET 527.A N MET 523.A O no hydrogen 3.041 N/A THR 528.A N ALA 524.A O no hydrogen 3.079 N/A THR 528.A OG1 ALA 524.A O no hydrogen 2.670 N/A ILE 529.A N ILE 525.A O no hydrogen 2.896 N/A ILE 530.A N GLY 526.A O no hydrogen 3.403 N/A LYS 531.A N MET 527.A O no hydrogen 3.235 N/A ASN 532.A N THR 528.A O no hydrogen 3.020 N/A ASN 533.A N ILE 529.A O no hydrogen 3.264 N/A ASN 533.A N ILE 530.A O no hydrogen 2.802 N/A ASN 533.A ND2 ILE 529.A O no hydrogen 2.713 N/A MET 534.A N ILE 530.A O no hydrogen 3.133 N/A ASN 536.A N ASN 532.A O no hydrogen 3.249 N/A ASN 537.A N ASN 533.A O no hydrogen 2.803 N/A ALA 544.A N GLY 540.A O no hydrogen 2.862 N/A GLN 545.A N PRO 541.A O no hydrogen 2.800 N/A GLN 545.A NE2 ASN 600.A OD1 no hydrogen 2.702 N/A THR 546.A N ALA 542.A O no hydrogen 2.801 N/A THR 546.A OG1 ALA 542.A O no hydrogen 2.973 N/A ALA 547.A N THR 543.A O no hydrogen 2.801 N/A ILE 548.A N ALA 544.A O no hydrogen 3.171 N/A LEU 550.A N THR 546.A O no hydrogen 2.799 N/A PHE 551.A N ALA 547.A O no hydrogen 2.801 N/A ILE 552.A N ILE 548.A O no hydrogen 3.312 N/A ALA 553.A N GLN 549.A O no hydrogen 2.911 N/A ASP 554.A N LEU 550.A O no hydrogen 3.497 N/A TYR 555.A N PHE 551.A O no hydrogen 2.798 N/A TYR 555.A OH GLU 519.A O no hydrogen 2.667 N/A ARG 556.A N ILE 552.A O no hydrogen 2.799 N/A ARG 556.A NH2 GLY 595.A O no hydrogen 2.694 N/A TYR 557.A N ALA 553.A O no hydrogen 3.315 N/A THR 558.A N ASP 554.A O no hydrogen 2.801 N/A THR 558.A OG1 ASP 554.A O no hydrogen 2.671 N/A THR 558.A OG1 ASP 554.A OD1 no hydrogen 3.128 N/A TYR 559.A N TYR 555.A O no hydrogen 2.802 N/A TYR 559.A OH ASP 522.A OD2 no hydrogen 2.806 N/A CYS 561.A N ARG 556.A O no hydrogen 2.803 N/A CYS 561.A SG TYR 555.A O no hydrogen 3.924 N/A CYS 561.A SG VAL 591.A O no hydrogen 3.707 N/A ARG 563.A NE ASP 565.A OD1 no hydrogen 3.178 N/A ARG 563.A NH2 ASP 565.A OD2 no hydrogen 2.727 N/A GLY 564.A N GLY 594.A O no hydrogen 2.800 N/A SER 566.A N ARG 563.A O no hydrogen 2.802 N/A SER 566.A OG ARG 563.A O no hydrogen 2.598 N/A ARG 572.A NH1 GLU 519.A OE2 no hydrogen 2.710 N/A ARG 572.A NH1 TYR 559.A O no hydrogen 2.963 N/A ARG 572.A NH2 GLU 519.A OE1 no hydrogen 3.152 N/A LYS 574.A N GLY 570.A O no hydrogen 3.049 N/A ILE 575.A N ARG 572.A O no hydrogen 2.801 N/A ILE 576.A N ARG 572.A O no hydrogen 2.803 N/A LYS 577.A N MET 573.A O no hydrogen 2.801 N/A LYS 577.A NZ VAL 568.A O no hydrogen 3.161 N/A LEU 579.A N ILE 575.A O no hydrogen 2.919 N/A TRP 580.A N ILE 576.A O no hydrogen 3.062 N/A GLU 581.A N LYS 577.A O no hydrogen 3.241 N/A ASN 582.A N GLU 578.A O no hydrogen 2.800 N/A THR 583.A N LEU 579.A O no hydrogen 2.863 N/A THR 583.A OG1 LEU 579.A O no hydrogen 2.787 N/A GLY 585.A N ASP 617.A OD1 no hydrogen 2.914 N/A ARG 586.A N LYS 584.A O no hydrogen 2.883 N/A ARG 586.A NE THR 583.A O no hydrogen 3.133 N/A GLY 588.A N GLY 585.A O no hydrogen 3.189 N/A LEU 589.A N ARG 586.A O no hydrogen 3.236 N/A LEU 590.A N TYR 620.A OH no hydrogen 3.164 N/A ASP 593.A N LEU 590.A O no hydrogen 2.803 N/A GLY 594.A N VAL 591.A O no hydrogen 2.801 N/A GLY 595.A N LEU 590.A O no hydrogen 2.801 N/A TYR 599.A N ASN 597.A OD1 no hydrogen 3.474 N/A TYR 599.A OH ILE 606.A O no hydrogen 2.927 N/A LEU 601.A N ASN 600.A OD1 no hydrogen 2.731 N/A ASN 603.A N ASN 600.A O no hydrogen 2.802 N/A ILE 606.A N ASN 603.A O no hydrogen 3.078 N/A VAL 610.A N PRO 607.A O no hydrogen 2.802 N/A LEU 611.A N PRO 607.A O no hydrogen 3.060 N/A LYS 612.A N GLU 608.A O no hydrogen 3.096 N/A LYS 612.A NZ LEU 589.A O no hydrogen 3.065 N/A LYS 612.A NZ PRO 596.A O no hydrogen 2.742 N/A LYS 612.A NZ GLU 608.A OE2 no hydrogen 3.173 N/A LEU 615.A N LYS 612.A O no hydrogen 2.801 N/A TYR 620.A OH ASP 593.A OD2 no hydrogen 2.908 N/A LYS 621.A N ASP 617.A O no hydrogen 2.801 N/A LYS 621.A NZ TYR 613.A O no hydrogen 3.034 N/A GLY 622.A N PRO 618.A O no hydrogen 2.801 N/A ARG 623.A N GLU 619.A O no hydrogen 3.097 N/A LEU 624.A N TYR 620.A O no hydrogen 2.799 N/A LEU 625.A N LYS 621.A O no hydrogen 2.801 N/A HIS 626.A N ARG 623.A O no hydrogen 3.311 N/A ASN 629.A ND2 HIS 626.A O no hydrogen 2.746 N/A PHE 631.A N ASN 629.A OD1 no hydrogen 3.092 N/A ILE 640.A N SER 636.A O no hydrogen 3.229 N/A GLU 642.A N GLU 638.A O no hydrogen 3.108 N/A ALA 643.A N MET 651.A O no hydrogen 2.802 N/A ILE 645.A N LYS 649.A O no hydrogen 3.179 N/A TYR 653.A N LYS 641.A O no hydrogen 2.802 N/A THR 659.A N LEU 624.A O no hydrogen 3.065 N/A THR 659.A OG1 LEU 624.A O no hydrogen 3.471 N/A HIS 660.A ND1 GLU 519.A OE1 no hydrogen 2.611 N/A HIS 660.A NE2 ASP 593.A OD2 no hydrogen 2.725 N/A SER 661.A N GLY 658.A O no hydrogen 2.801 N/A SER 661.A OG VAL 656.A O no hydrogen 3.453 N/A TRP 662.A NE1 GLU 519.A OE1 no hydrogen 3.152 N/A ARG 666.A NH1 GLU 682.A OE2 no hydrogen 2.782 N/A ARG 666.A NH2 GLU 682.A OE1 no hydrogen 3.190 N/A SER 669.A OG ASN 667.A OD1 no hydrogen 2.739 N/A LEU 671.A N ARG 668.A O no hydrogen 2.802 N/A THR 673.A OG1 ILE 670.A O no hydrogen 3.009 N/A ARG 676.A N THR 673.A O no hydrogen 3.380 N/A ARG 676.A NE LEU 671.A O no hydrogen 2.739 N/A ASN 677.A ND2 ASN 187.A OD1 no hydrogen 3.493 N/A MET 678.A N GLN 675.A O no hydrogen 3.134 N/A ILE 679.A N ARG 676.A O no hydrogen 2.801 N/A GLU 681.A N ASN 677.A O no hydrogen 3.330 N/A GLU 682.A N MET 678.A O no hydrogen 2.799 N/A GLN 683.A N ILE 679.A O no hydrogen 3.242 N/A CYS 684.A N LEU 680.A O no hydrogen 2.800 N/A TYR 685.A N GLU 681.A O no hydrogen 3.447 N/A ALA 686.A N GLU 682.A O no hydrogen 2.800 N/A LYS 687.A N GLN 683.A O no hydrogen 3.118 N/A CYS 688.A N CYS 684.A O no hydrogen 3.338 N/A CYS 688.A SG CYS 684.A O no hydrogen 3.290 N/A CYS 689.A N TYR 685.A O no hydrogen 2.800 N/A CYS 689.A SG TYR 685.A O no hydrogen 3.311 N/A ASN 690.A N ALA 686.A O no hydrogen 2.957 N/A LEU 691.A N LYS 687.A O no hydrogen 3.277 N/A PHE 692.A N CYS 688.A O no hydrogen 2.802 N/A GLU 693.A N CYS 689.A O no hydrogen 2.985 N/A ALA 694.A N ASN 690.A O no hydrogen 3.277 N/A ALA 694.A N LEU 691.A O no hydrogen 3.034 N/A CYS 695.A N LEU 691.A O no hydrogen 3.200 N/A CYS 695.A SG LEU 691.A O no hydrogen 3.630 N/A PHE 696.A N PHE 692.A O no hydrogen 2.800 N/A ALA 699.A N PHE 696.A O no hydrogen 3.224 N/A ARG 702.A N SER 698.A O no hydrogen 2.797 N/A LYS 703.A NZ ASP 121.A OD1 no hydrogen 3.156 N/A ALA 713.A N SER 709.A O no hydrogen 3.231 N/A MET 714.A N MET 710.A O no hydrogen 3.366 N/A ALA 715.A N LEU 711.A O no hydrogen 2.800 N/A HIS 716.A N GLU 712.A O no hydrogen 3.114 N/A ARG 717.A N ALA 713.A O no hydrogen 3.105 N/A ARG 717.A NE ASP 721.A OD1 no hydrogen 3.055 N/A ARG 717.A NH2 ASP 721.A OD1 no hydrogen 3.210 N/A LEU 718.A N MET 714.A O no hydrogen 3.015 N/A ARG 719.A N ALA 715.A O no hydrogen 2.801 N/A MET 720.A N HIS 716.A O no hydrogen 3.302 N/A ASP 721.A N ARG 717.A O no hydrogen 3.154 N/A ALA 722.A N LEU 718.A O no hydrogen 3.098 N/A ARG 723.A N ARG 719.A O no hydrogen 3.140 N/A ARG 723.A NE GLU 727.A OE2 no hydrogen 2.877 N/A LEU 724.A N MET 720.A O no hydrogen 2.802 N/A ASP 725.A N ASP 721.A O no hydrogen 3.381 N/A TYR 726.A N ALA 722.A O no hydrogen 2.978 N/A GLU 727.A N ARG 723.A O no hydrogen 3.171 N/A SER 728.A N LEU 724.A O no hydrogen 2.802 N/A SER 728.A OG LEU 724.A O no hydrogen 3.033 N/A SER 728.A OG ASP 725.A O no hydrogen 3.080 N/A GLY 729.A N ASP 725.A O no hydrogen 3.149 N/A ARG 730.A N SER 728.A OG no hydrogen 3.428 N/A MET 731.A N ASP 725.A O no hydrogen 2.800 N/A SER 732.A OG ASP 735.A OD2 no hydrogen 2.918 N/A ASP 735.A N SER 732.A OG no hydrogen 3.291 N/A PHE 736.A N SER 732.A O no hydrogen 2.800 N/A GLU 737.A N LYS 733.A O no hydrogen 3.211 N/A ALA 739.A N ASP 735.A O no hydrogen 2.970 N/A MET 740.A N PHE 736.A O no hydrogen 2.801 N/A ALA 741.A N GLU 737.A O no hydrogen 3.097 N/A HIS 742.A N LYS 738.A O no hydrogen 3.126 N/A LEU 743.A N ALA 739.A O no hydrogen 3.181 N/A GLY 744.A N MET 740.A O no hydrogen 3.367 N/A GLU 745.A N HIS 742.A O no hydrogen 3.081 N/A