Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5e7p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG LEU 34.A O no hydrogen 2.808 N/A HIS 5.A ND1 LEU 3.A O no hydrogen 3.323 N/A LEU 6.A N VAL 86.A O no hydrogen 2.930 N/A LEU 8.A N VAL 84.A O no hydrogen 2.830 N/A THR 9.A N GLY 64.A O no hydrogen 3.003 N/A ALA 10.A N ALA 82.A O no hydrogen 2.846 N/A ARG 11.A N ALA 66.A O no hydrogen 2.908 N/A ASN 13.A N LEU 68.A O no hydrogen 2.837 N/A ASN 13.A ND2 ASP 18.A OD2 no hydrogen 3.025 N/A SER 15.A N ASN 13.A OD1 no hydrogen 3.137 N/A ASP 18.A N SER 15.A O no hydrogen 3.124 N/A SER 19.A OG SER 15.A O no hydrogen 3.279 N/A SER 19.A OG ALA 16.A O no hydrogen 3.092 N/A ARG 20.A N ASP 69.A OD2 no hydrogen 2.846 N/A ARG 20.A NH2 ASP 70.A OD2 no hydrogen 2.755 N/A ARG 21.A NE GLU 413.A OE1 no hydrogen 3.064 N/A ARG 21.A NE GLU 413.A OE2 no hydrogen 2.820 N/A ARG 21.A NH1 ALA 16.A O no hydrogen 2.929 N/A ARG 21.A NH1 SER 19.A O no hydrogen 2.834 N/A ARG 21.A NH2 GLU 413.A OE2 no hydrogen 2.949 N/A VAL 24.A N VAL 53.A O no hydrogen 2.915 N/A ARG 25.A N LEU 67.A O no hydrogen 2.983 N/A ARG 25.A NE ASP 18.A OD2 no hydrogen 2.926 N/A ARG 25.A NH1 VAL 56.A O no hydrogen 2.896 N/A ARG 25.A NH2 ASP 18.A OD1 no hydrogen 2.808 N/A ARG 25.A NH2 THR 441.A O no hydrogen 2.755 N/A LEU 26.A N GLY 55.A O no hydrogen 2.863 N/A GLU 29.A N HIS 27.A ND1 no hydrogen 2.998 N/A VAL 30.A N HIS 27.A O no hydrogen 2.947 N/A LEU 31.A N HIS 27.A O no hydrogen 3.287 N/A ALA 32.A N PRO 28.A O no hydrogen 2.905 N/A ALA 33.A N GLU 29.A O no hydrogen 2.824 N/A LEU 34.A N VAL 30.A O no hydrogen 2.812 N/A GLY 35.A N LEU 31.A O no hydrogen 3.056 N/A GLY 35.A N ALA 32.A O no hydrogen 3.234 N/A ILE 36.A N LEU 31.A O no hydrogen 2.893 N/A ARG 37.A N ASP 40.A OD2 no hydrogen 3.182 N/A ARG 37.A NH1 SER 456.A O no hydrogen 3.098 N/A ARG 37.A NH2 SER 456.A O no hydrogen 3.497 N/A TRP 39.A N ALA 54.A O no hydrogen 2.712 N/A ASP 40.A N ARG 37.A O no hydrogen 3.462 N/A VAL 42.A N ALA 52.A O no hydrogen 2.807 N/A ALA 43.A N SER 87.A O no hydrogen 2.536 N/A LEU 44.A N THR 50.A O no hydrogen 2.910 N/A THR 45.A N LEU 85.A O no hydrogen 2.953 N/A GLY 46.A N ARG 48.A O no hydrogen 2.878 N/A THR 47.A N GLY 77.A O no hydrogen 3.183 N/A THR 47.A OG1 GLY 77.A O no hydrogen 3.325 N/A ARG 48.A N ALA 76.A O no hydrogen 3.252 N/A ARG 48.A NH1 GLY 126.A O no hydrogen 3.251 N/A THR 50.A N LEU 44.A O no hydrogen 2.902 N/A THR 50.A OG1 ASP 127.A OD1 no hydrogen 3.127 N/A THR 50.A OG1 ASP 127.A OD2 no hydrogen 2.628 N/A ALA 51.A N THR 50.A OG1 no hydrogen 2.731 N/A ALA 52.A N VAL 42.A O no hydrogen 3.077 N/A VAL 53.A N GLY 22.A O no hydrogen 3.093 N/A ALA 54.A N ASP 40.A O no hydrogen 2.814 N/A GLY 55.A N VAL 24.A O no hydrogen 2.830 N/A ALA 57.A N LEU 26.A O no hydrogen 2.820 N/A THR 65.A N PRO 62.A O no hydrogen 3.058 N/A ALA 66.A N THR 9.A O no hydrogen 2.790 N/A LEU 67.A N ARG 25.A O no hydrogen 2.965 N/A LEU 68.A N ARG 11.A O no hydrogen 2.982 N/A THR 72.A N ASP 69.A OD1 no hydrogen 2.912 N/A THR 72.A OG1 ASP 69.A OD1 no hydrogen 2.453 N/A LEU 73.A N ASP 69.A O no hydrogen 3.111 N/A SER 74.A N ASP 70.A O no hydrogen 3.194 N/A ASN 75.A N VAL 71.A O no hydrogen 2.805 N/A ASN 75.A ND2 THR 128.A O no hydrogen 3.283 N/A ALA 76.A N THR 72.A O no hydrogen 2.870 N/A GLY 77.A N SER 74.A O no hydrogen 3.362 N/A VAL 78.A N LEU 73.A O no hydrogen 2.993 N/A ASN 81.A N ALA 10.A O no hydrogen 2.729 N/A ALA 82.A N ARG 79.A O no hydrogen 3.260 N/A VAL 84.A N LEU 8.A O no hydrogen 2.790 N/A LEU 85.A N THR 45.A O no hydrogen 3.089 N/A VAL 86.A N LEU 6.A O no hydrogen 2.846 N/A SER 87.A N ALA 43.A O no hydrogen 3.146 N/A ALA 94.A N SER 167.A O no hydrogen 2.986 N/A ARG 95.A N ASP 161.A O no hydrogen 2.544 N/A SER 96.A N ASP 161.A O no hydrogen 3.339 N/A VAL 97.A N VAL 173.A O no hydrogen 2.943 N/A THR 98.A N ALA 159.A O no hydrogen 2.793 N/A VAL 99.A N SER 175.A O no hydrogen 3.089 N/A SER 100.A N THR 156.A O no hydrogen 2.814 N/A SER 102.A N GLU 153.A OE2 no hydrogen 2.984 N/A SER 102.A OG GLU 153.A OE1 no hydrogen 2.985 N/A SER 102.A OG GLU 153.A OE2 no hydrogen 2.586 N/A THR 106.A N SER 102.A O no hydrogen 3.052 N/A THR 106.A OG1 SER 102.A O no hydrogen 2.571 N/A GLN 107.A N LEU 104.A O no hydrogen 3.318 N/A GLN 107.A NE2 ALA 185.A O no hydrogen 3.022 N/A SER 108.A OG LEU 104.A O no hydrogen 2.781 N/A ILE 109.A N ALA 105.A O no hydrogen 3.018 N/A SER 110.A OG THR 113.A OG1 no hydrogen 2.901 N/A THR 113.A N SER 110.A OG no hydrogen 3.403 N/A THR 113.A OG1 SER 110.A OG no hydrogen 2.901 N/A LEU 114.A N SER 110.A O no hydrogen 3.055 N/A ARG 115.A N PRO 111.A O no hydrogen 3.043 N/A ARG 115.A NH1 SER 172.A O no hydrogen 2.731 N/A ARG 115.A NH1 ASP 270.A OD2 no hydrogen 3.346 N/A ARG 115.A NH2 ASP 270.A OD1 no hydrogen 3.483 N/A ARG 115.A NH2 ASP 270.A OD2 no hydrogen 3.456 N/A MET 116.A N ALA 112.A O no hydrogen 3.045 N/A ALA 117.A N THR 113.A O no hydrogen 2.922 N/A LEU 118.A N LEU 114.A O no hydrogen 3.028 N/A GLY 120.A N VAL 168.A O no hydrogen 2.707 N/A LYS 121.A N LEU 118.A O no hydrogen 3.107 N/A MET 123.A N VAL 166.A O no hydrogen 2.591 N/A THR 124.A OG1 THR 165.A OG1 no hydrogen 3.352 N/A GLY 126.A N VAL 157.A O no hydrogen 2.639 N/A ASP 127.A N THR 124.A O no hydrogen 3.037 N/A THR 128.A N ASN 75.A OD1 no hydrogen 2.860 N/A VAL 129.A N LEU 155.A O no hydrogen 2.962 N/A SER 130.A OG ARG 20.A O no hydrogen 3.251 N/A THR 139.A OG1 SER 136.A O no hydrogen 2.732 N/A SER 140.A N SER 136.A O no hydrogen 2.954 N/A SER 140.A OG SER 136.A O no hydrogen 3.136 N/A SER 140.A OG ALA 137.A O no hydrogen 3.087 N/A ALA 141.A N ALA 137.A O no hydrogen 3.370 N/A LEU 142.A N ALA 138.A O no hydrogen 3.085 N/A ALA 143.A N THR 139.A O no hydrogen 2.857 N/A SER 144.A N SER 140.A O no hydrogen 3.104 N/A SER 144.A OG SER 140.A O no hydrogen 3.262 N/A SER 145.A N ALA 141.A O no hydrogen 3.017 N/A SER 145.A OG ALA 141.A O no hydrogen 3.149 N/A SER 145.A OG LEU 142.A O no hydrogen 2.644 N/A VAL 146.A N LEU 142.A O no hydrogen 3.030 N/A GLY 147.A N SER 144.A O no hydrogen 3.208 N/A ILE 148.A N ALA 143.A O no hydrogen 2.598 N/A TRP 150.A NE1 LEU 131.A O no hydrogen 3.192 N/A SER 152.A OG ASP 135.A OD2 no hydrogen 2.673 N/A LEU 155.A N VAL 129.A O no hydrogen 2.842 N/A THR 156.A N SER 100.A O no hydrogen 3.228 N/A VAL 157.A N ASP 127.A O no hydrogen 2.946 N/A THR 158.A N THR 98.A O no hydrogen 2.868 N/A THR 158.A OG1 THR 98.A O no hydrogen 3.423 N/A ALA 159.A N THR 98.A O no hydrogen 3.340 N/A ASP 161.A N SER 96.A O no hydrogen 3.060 N/A THR 165.A OG1 THR 124.A OG1 no hydrogen 3.352 N/A VAL 166.A N MET 123.A O no hydrogen 3.046 N/A SER 167.A N TYR 92.A O no hydrogen 2.974 N/A VAL 168.A N LYS 121.A O no hydrogen 3.050 N/A GLN 169.A N SER 172.A OG no hydrogen 2.992 N/A GLN 169.A NE2 SER 167.A OG no hydrogen 2.905 N/A GLN 169.A NE2 SER 449.A OG no hydrogen 2.950 N/A ASN 171.A ND2 ASP 306.A OD2 no hydrogen 2.938 N/A SER 172.A N GLN 169.A O no hydrogen 2.934 N/A SER 172.A OG ALA 94.A O no hydrogen 2.428 N/A VAL 173.A N ARG 95.A O no hydrogen 3.192 N/A SER 175.A N VAL 97.A O no hydrogen 3.225 N/A TRP 176.A NE1 ILE 109.A O no hydrogen 2.902 N/A THR 178.A OG1 THR 178.A O no hydrogen 2.327 N/A GLY 190.A N GLU 273.A OE1 no hydrogen 3.065 N/A THR 193.A N GLU 268.A O no hydrogen 3.008 N/A SER 195.A N VAL 266.A O no hydrogen 3.004 N/A ARG 198.A NH1 GLN 197.A O no hydrogen 3.465 N/A SER 199.A OG PRO 196.A O no hydrogen 2.417 N/A GLU 200.A N GLU 200.A OE1 no hydrogen 2.465 N/A SER 204.A OG ASP 207.A OD2 no hydrogen 2.859 N/A ASP 207.A N SER 204.A OG no hydrogen 3.096 N/A VAL 208.A N SER 204.A O no hydrogen 3.230 N/A LYS 209.A N PHE 205.A O no hydrogen 3.230 N/A HIS 212.A N VAL 208.A O no hydrogen 3.006 N/A GLN 214.A N GLN 214.A OE1 no hydrogen 2.807 N/A GLN 214.A NE2 SER 552.A O no hydrogen 2.959 N/A ALA 215.A N HIS 212.A O no hydrogen 3.071 N/A VAL 216.A N PRO 213.A O no hydrogen 3.227 N/A LEU 218.A N GLN 214.A O no hydrogen 3.093 N/A ASP 219.A N ALA 215.A O no hydrogen 2.953 N/A GLU 220.A N VAL 216.A O no hydrogen 3.046 N/A TRP 221.A N LYS 217.A O no hydrogen 2.988 N/A LEU 222.A N LEU 218.A O no hydrogen 3.041 N/A ARG 223.A N ASP 219.A O no hydrogen 3.011 N/A ARG 223.A NE ASP 219.A OD1 no hydrogen 3.215 N/A ARG 223.A NE ASP 219.A OD2 no hydrogen 3.196 N/A LEU 224.A N GLU 220.A O no hydrogen 3.192 N/A SER 225.A N TRP 221.A O no hydrogen 3.096 N/A SER 225.A OG PRO 239.A O no hydrogen 2.570 N/A LEU 226.A N LEU 222.A O no hydrogen 2.830 N/A ASP 227.A N ARG 223.A O no hydrogen 2.732 N/A GLU 228.A N ARG 223.A O no hydrogen 2.974 N/A LEU 231.A N GLU 228.A O no hydrogen 3.263 N/A LYS 233.A N PRO 229.A O no hydrogen 3.049 N/A THR 234.A N GLU 230.A O no hydrogen 3.016 N/A THR 234.A OG1 GLU 230.A O no hydrogen 2.596 N/A LEU 235.A N LEU 231.A O no hydrogen 3.392 N/A LEU 235.A N LEU 232.A O no hydrogen 3.229 N/A GLY 236.A N LYS 233.A O no hydrogen 3.235 N/A ALA 237.A N LEU 232.A O no hydrogen 2.867 N/A HIS 240.A N THR 238.A OG1 no hydrogen 3.363 N/A GLY 242.A N ASP 361.A OD1 no hydrogen 3.221 N/A VAL 243.A N PHE 340.A O no hydrogen 2.744 N/A LEU 244.A N ARG 362.A O no hydrogen 3.077 N/A VAL 245.A N ALA 342.A O no hydrogen 2.751 N/A SER 246.A N LEU 364.A O no hydrogen 2.736 N/A GLY 247.A N ALA 345.A O no hydrogen 3.240 N/A VAL 251.A N PRO 248.A O no hydrogen 3.170 N/A LYS 253.A NZ GLY 247.A O no hydrogen 3.148 N/A LYS 253.A NZ PRO 248.A O no hydrogen 3.052 N/A MET 256.A N GLY 252.A O no hydrogen 3.110 N/A VAL 257.A N LYS 253.A O no hydrogen 3.222 N/A ARG 258.A N ALA 254.A O no hydrogen 3.079 N/A ARG 258.A NE GLU 268.A OE1 no hydrogen 3.186 N/A ARG 258.A NE GLU 268.A OE2 no hydrogen 3.291 N/A ARG 258.A NH2 GLU 268.A OE1 no hydrogen 2.758 N/A ALA 259.A N THR 255.A O no hydrogen 3.009 N/A VAL 260.A N MET 256.A O no hydrogen 2.888 N/A CYS 261.A N VAL 257.A O no hydrogen 2.986 N/A CYS 261.A SG VAL 257.A O no hydrogen 3.237 N/A ALA 262.A N ALA 259.A O no hydrogen 3.326 N/A ARG 264.A N CYS 261.A O no hydrogen 2.867 N/A ARG 264.A NH1 ASP 227.A OD1 no hydrogen 2.700 N/A ARG 264.A NH1 ASP 227.A OD2 no hydrogen 2.980 N/A ARG 264.A NH2 ASP 227.A OD2 no hydrogen 2.578 N/A ARG 265.A NH2 ALA 292.A O no hydrogen 3.246 N/A ARG 265.A NH2 GLY 297.A O no hydrogen 3.375 N/A VAL 266.A N SER 195.A O no hydrogen 2.925 N/A VAL 267.A N VAL 299.A O no hydrogen 2.792 N/A GLU 268.A N THR 193.A O no hydrogen 2.937 N/A LEU 269.A N PHE 301.A O no hydrogen 2.864 N/A GLY 271.A N ALA 303.A O no hydrogen 2.925 N/A VAL 274.A N ASP 270.A O no hydrogen 3.008 N/A GLY 275.A N GLY 271.A O no hydrogen 2.802 N/A ALA 276.A N PRO 272.A O no hydrogen 3.079 N/A LEU 277.A N VAL 274.A O no hydrogen 3.031 N/A GLN 278.A NE2 ASP 280.A OD2 no hydrogen 3.011 N/A ASP 280.A N GLN 278.A OE1 no hydrogen 2.941 N/A GLU 281.A N GLN 278.A OE1 no hydrogen 3.174 N/A ARG 282.A N GLN 278.A O no hydrogen 2.813 N/A LEU 283.A N VAL 279.A O no hydrogen 3.391 N/A ARG 284.A N ASP 280.A O no hydrogen 3.333 N/A ARG 284.A NE GLU 281.A OE1 no hydrogen 3.158 N/A ARG 284.A NE GLU 281.A OE2 no hydrogen 2.986 N/A ARG 284.A NH1 GLU 281.A OE2 no hydrogen 2.653 N/A SER 285.A N GLU 281.A O no hydrogen 3.141 N/A SER 285.A OG GLY 190.A O no hydrogen 2.337 N/A VAL 286.A N ARG 282.A O no hydrogen 3.275 N/A THR 287.A N LEU 283.A O no hydrogen 2.953 N/A THR 287.A OG1 LEU 283.A O no hydrogen 2.650 N/A SER 288.A N ARG 284.A O no hydrogen 2.821 N/A SER 288.A OG HIS 192.A NE2 no hydrogen 3.411 N/A ALA 289.A N SER 285.A O no hydrogen 3.062 N/A VAL 290.A N VAL 286.A O no hydrogen 2.945 N/A ALA 291.A N THR 287.A O no hydrogen 3.089 N/A ALA 292.A N SER 288.A O no hydrogen 3.185 N/A VAL 293.A N ALA 289.A O no hydrogen 3.152 N/A THR 294.A N VAL 290.A O no hydrogen 3.042 N/A THR 294.A OG1 VAL 290.A O no hydrogen 2.778 N/A THR 294.A OG1 ALA 291.A O no hydrogen 3.331 N/A GLY 297.A N VAL 293.A O no hydrogen 2.880 N/A GLY 298.A N GLY 337.A O no hydrogen 2.678 N/A VAL 299.A N ARG 265.A O no hydrogen 2.981 N/A LEU 300.A N ALA 339.A O no hydrogen 2.867 N/A PHE 301.A N VAL 267.A O no hydrogen 2.784 N/A ILE 302.A N ILE 341.A O no hydrogen 3.132 N/A ALA 303.A N LEU 269.A O no hydrogen 3.179 N/A ASP 304.A N THR 343.A OG1 no hydrogen 2.726 N/A VAL 305.A N THR 343.A O no hydrogen 2.821 N/A ALA 307.A N ASP 304.A O no hydrogen 3.413 N/A LEU 308.A N VAL 305.A O no hydrogen 3.022 N/A LEU 309.A N VAL 305.A O no hydrogen 2.608 N/A ALA 311.A N ASN 349.A O no hydrogen 2.933 N/A ASN 313.A N ARG 316.A O no hydrogen 3.046 N/A MET 315.A N ASN 313.A O no hydrogen 2.437 N/A ALA 322.A N GLU 319.A O no hydrogen 3.016 N/A THR 323.A N PRO 320.A O no hydrogen 3.200 N/A ILE 325.A N VAL 321.A O no hydrogen 2.920 N/A LEU 326.A N ALA 322.A O no hydrogen 2.858 N/A ALA 327.A N THR 323.A O no hydrogen 3.093 N/A GLU 328.A N LEU 324.A O no hydrogen 3.155 N/A LEU 329.A N ILE 325.A O no hydrogen 3.140 N/A ARG 330.A N LEU 326.A O no hydrogen 2.846 N/A LYS 331.A N ALA 327.A O no hydrogen 3.051 N/A ALA 332.A N GLU 328.A O no hydrogen 3.006 N/A VAL 333.A N LEU 329.A O no hydrogen 2.898 N/A ALA 334.A N ARG 330.A O no hydrogen 3.198 N/A THR 335.A N ALA 332.A O no hydrogen 3.022 N/A THR 335.A OG1 LYS 331.A O no hydrogen 2.814 N/A THR 335.A OG1 ALA 332.A O no hydrogen 3.436 N/A VAL 338.A N THR 335.A O no hydrogen 3.155 N/A ALA 339.A N GLY 298.A O no hydrogen 2.850 N/A PHE 340.A N LEU 241.A O no hydrogen 2.903 N/A ILE 341.A N LEU 300.A O no hydrogen 3.009 N/A ALA 342.A N VAL 243.A O no hydrogen 2.861 N/A THR 343.A N ILE 302.A O no hydrogen 3.167 N/A SER 344.A N VAL 245.A O no hydrogen 2.989 N/A SER 344.A OG VAL 346.A O no hydrogen 2.989 N/A GLU 348.A N GLU 348.A OE1 no hydrogen 2.983 N/A ASN 349.A N VAL 346.A O no hydrogen 3.019 N/A VAL 350.A N PRO 347.A O no hydrogen 3.077 N/A ASP 351.A N LEU 309.A O no hydrogen 2.661 N/A ARG 353.A N ASP 351.A OD1 no hydrogen 3.185 N/A ARG 353.A NE ASP 351.A OD1 no hydrogen 3.135 N/A ARG 353.A NH1 THR 323.A OG1 no hydrogen 2.820 N/A ARG 353.A NH2 ASP 351.A OD2 no hydrogen 2.868 N/A LEU 354.A N ASP 351.A O no hydrogen 2.967 N/A ARG 355.A NE VAL 350.A O no hydrogen 3.401 N/A ARG 355.A NH1 GLU 544.A OE1 no hydrogen 3.148 N/A ARG 355.A NH1 GLU 544.A OE2 no hydrogen 2.992 N/A ARG 355.A NH2 VAL 350.A O no hydrogen 3.161 N/A VAL 359.A N ALA 356.A O no hydrogen 3.091 N/A CYS 360.A N LEU 354.A O no hydrogen 2.935 N/A ARG 362.A N GLY 242.A O no hydrogen 3.348 N/A ARG 362.A NE ASP 361.A OD2 no hydrogen 2.772 N/A ARG 362.A NH2 ASP 361.A OD2 no hydrogen 3.088 N/A LEU 364.A N LEU 244.A O no hydrogen 2.953 N/A GLY 365.A N SER 552.A OG no hydrogen 2.555 N/A LEU 366.A N SER 246.A O no hydrogen 2.723 N/A SER 367.A OG LEU 368.A O no hydrogen 3.106 N/A ALA 373.A N ASP 370.A OD1 no hydrogen 2.785 N/A ARG 374.A N ASP 370.A O no hydrogen 2.776 N/A ARG 374.A NE ALA 396.A O no hydrogen 2.857 N/A ARG 374.A NH1 PRO 369.A O no hydrogen 2.930 N/A ARG 374.A NH2 ALA 396.A O no hydrogen 2.695 N/A ARG 375.A N ALA 371.A O no hydrogen 3.105 N/A ARG 375.A NE GLU 379.A OE2 no hydrogen 3.191 N/A SER 376.A N THR 372.A O no hydrogen 3.102 N/A SER 376.A OG THR 372.A O no hydrogen 3.472 N/A LEU 377.A N ALA 373.A O no hydrogen 2.976 N/A LEU 378.A N ARG 374.A O no hydrogen 2.975 N/A GLU 379.A N ARG 375.A O no hydrogen 3.098 N/A MET 380.A N SER 376.A O no hydrogen 3.126 N/A LEU 381.A N LEU 377.A O no hydrogen 2.782 N/A LEU 382.A N GLU 379.A O no hydrogen 3.244 N/A ARG 383.A N MET 380.A O no hydrogen 3.470 N/A ARG 383.A NH1 ASP 207.A OD1 no hydrogen 3.364 N/A ARG 383.A NH1 ASP 207.A OD2 no hydrogen 3.407 N/A ARG 383.A NH2 ASP 207.A OD1 no hydrogen 3.046 N/A VAL 385.A N LEU 382.A O no hydrogen 3.107 N/A SER 387.A OG VAL 385.A O no hydrogen 3.497 N/A GLU 388.A N LEU 431.A O no hydrogen 2.806 N/A ASP 394.A N ASP 391.A O no hydrogen 3.134 N/A ILE 395.A N ASP 391.A O no hydrogen 3.475 N/A ALA 396.A N LEU 392.A O no hydrogen 2.883 N/A ASP 397.A N GLY 393.A O no hydrogen 2.964 N/A HIS 398.A N ASP 394.A O no hydrogen 3.125 N/A HIS 398.A N ILE 395.A O no hydrogen 3.267 N/A HIS 398.A ND1 ASP 394.A O no hydrogen 2.957 N/A THR 399.A N ALA 396.A O no hydrogen 3.383 N/A THR 399.A OG1 ILE 395.A O no hydrogen 3.059 N/A THR 399.A OG1 ALA 396.A O no hydrogen 3.179 N/A PHE 402.A N THR 399.A O no hydrogen 3.268 N/A VAL 403.A N ASP 406.A OD2 no hydrogen 3.112 N/A ALA 405.A N GLY 250.A O no hydrogen 3.315 N/A LEU 407.A N VAL 403.A O no hydrogen 2.940 N/A ALA 408.A N VAL 404.A O no hydrogen 2.739 N/A ALA 409.A N ALA 405.A O no hydrogen 3.053 N/A VAL 410.A N ASP 406.A O no hydrogen 2.713 N/A VAL 411.A N LEU 407.A O no hydrogen 2.942 N/A ARG 412.A N ALA 408.A O no hydrogen 2.907 N/A GLU 413.A N ALA 409.A O no hydrogen 2.995 N/A GLY 414.A N VAL 410.A O no hydrogen 2.946 N/A ALA 415.A N VAL 411.A O no hydrogen 2.924 N/A LEU 416.A N ARG 412.A O no hydrogen 3.249 N/A LEU 416.A N GLU 413.A O no hydrogen 3.005 N/A ARG 417.A N GLU 413.A O no hydrogen 3.067 N/A ARG 417.A NE GLU 413.A OE2 no hydrogen 3.282 N/A ALA 418.A N GLY 414.A O no hydrogen 3.082 N/A ALA 419.A N ALA 415.A O no hydrogen 2.978 N/A ALA 420.A N LEU 416.A O no hydrogen 2.863 N/A ARG 421.A N ARG 417.A O no hydrogen 3.061 N/A ARG 421.A NH1 VAL 430.A O no hydrogen 3.162 N/A ARG 421.A NH2 VAL 430.A O no hydrogen 3.349 N/A ARG 421.A NH2 ASP 435.A OD1 no hydrogen 2.977 N/A ALA 422.A N ALA 418.A O no hydrogen 2.853 N/A SER 423.A N ALA 419.A O no hydrogen 3.110 N/A SER 423.A OG ALA 419.A O no hydrogen 3.396 N/A SER 424.A OG ARG 421.A O no hydrogen 2.893 N/A SER 425.A N ARG 421.A O no hydrogen 3.273 N/A SER 425.A OG ARG 421.A O no hydrogen 3.169 N/A ASP 428.A N ASP 428.A OD1 no hydrogen 2.336 N/A LEU 431.A N PRO 386.A O no hydrogen 2.977 N/A ARG 432.A N ASP 435.A OD2 no hydrogen 2.949 N/A HIS 433.A ND1 LEU 390.A O no hydrogen 2.758 N/A ASP 435.A N ARG 432.A O no hydrogen 3.182 N/A GLU 437.A N HIS 433.A O no hydrogen 3.017 N/A GLY 438.A N ALA 434.A O no hydrogen 2.811 N/A ALA 439.A N ASP 435.A O no hydrogen 2.872 N/A LEU 440.A N LEU 436.A O no hydrogen 3.257 N/A LEU 440.A N GLU 437.A O no hydrogen 3.267 N/A THR 441.A N GLY 438.A O no hydrogen 3.202 N/A THR 441.A OG1 GLY 438.A O no hydrogen 2.690 N/A VAL 442.A N ALA 439.A O no hydrogen 3.061 N/A ILE 443.A N ALA 439.A O no hydrogen 3.047 N/A ARG 444.A NH1 TRP 39.A O no hydrogen 2.897 N/A ARG 444.A NH2 GLY 120.A O no hydrogen 2.546 N/A LEU 446.A N ASP 406.A OD1 no hydrogen 2.868 N/A LEU 446.A N ASP 406.A OD2 no hydrogen 3.044 N/A SER 447.A OG GLY 401.A O no hydrogen 2.786 N/A ARG 448.A N PRO 445.A O no hydrogen 2.825 N/A ARG 448.A NH2 GLU 38.A O no hydrogen 3.163 N/A SER 449.A N LEU 446.A O no hydrogen 3.105 N/A SER 449.A OG LEU 446.A O no hydrogen 2.738 N/A SER 456.A N SER 453.A O no hydrogen 3.068 N/A SER 456.A OG SER 453.A O no hydrogen 2.999 N/A THR 458.A N ASP 461.A OD2 no hydrogen 3.121 N/A THR 458.A OG1 ASP 461.A OD2 no hydrogen 3.359 N/A ASP 461.A N THR 458.A O no hydrogen 2.955 N/A VAL 462.A N LEU 459.A O no hydrogen 3.209 N/A LYS 469.A N MET 465.A O no hydrogen 2.681 N/A LYS 469.A NZ LEU 459.A O no hydrogen 3.021 N/A LYS 469.A NZ VAL 462.A O no hydrogen 3.043 N/A LYS 469.A NZ ASP 464.A O no hydrogen 3.468 N/A ARG 470.A N VAL 466.A O no hydrogen 2.935 N/A ARG 470.A NH1 GLU 474.A OE1 no hydrogen 3.086 N/A ARG 470.A NH2 GLU 467.A OE1 no hydrogen 2.544 N/A ARG 470.A NH2 GLU 467.A OE2 no hydrogen 3.335 N/A ALA 471.A N GLU 467.A O no hydrogen 2.925 N/A LEU 472.A N THR 468.A O no hydrogen 2.887 N/A THR 473.A N LYS 469.A O no hydrogen 2.795 N/A THR 473.A OG1 LYS 469.A O no hydrogen 2.752 N/A GLU 474.A N ARG 470.A O no hydrogen 3.071 N/A ALA 475.A N ALA 471.A O no hydrogen 2.872 N/A VAL 476.A N LEU 472.A O no hydrogen 2.728 N/A TRP 478.A N THR 473.A O no hydrogen 2.813 N/A LEU 480.A N VAL 476.A O no hydrogen 3.498 N/A GLN 481.A N LEU 477.A O no hydrogen 2.843 N/A PHE 486.A N HIS 482.A O no hydrogen 3.464 N/A SER 487.A N PRO 483.A O no hydrogen 3.228 N/A SER 487.A OG PRO 483.A O no hydrogen 3.534 N/A SER 487.A OG ASP 484.A O no hydrogen 2.777 N/A ARG 488.A N ASP 484.A O no hydrogen 2.919 N/A ARG 488.A NH1 ASP 484.A OD2 no hydrogen 3.214 N/A LEU 489.A N THR 485.A O no hydrogen 3.033 N/A GLY 490.A N SER 487.A O no hydrogen 3.165 N/A ILE 491.A N PHE 486.A O no hydrogen 2.910 N/A VAL 497.A N VAL 600.A O no hydrogen 3.022 N/A LEU 498.A N ARG 622.A O no hydrogen 3.009 N/A LEU 499.A N GLY 602.A O no hydrogen 2.651 N/A TYR 500.A N VAL 624.A O no hydrogen 3.117 N/A CYS 505.A SG PRO 502.A O no hydrogen 3.479 N/A CYS 505.A SG PRO 503.A O no hydrogen 3.586 N/A LYS 507.A NZ THR 508.A OG1 no hydrogen 3.300 N/A THR 508.A OG1 ASP 560.A OD1 no hydrogen 3.264 N/A THR 508.A OG1 ASP 560.A OD2 no hydrogen 3.321 N/A VAL 510.A N GLY 506.A O no hydrogen 2.807 N/A ARG 512.A N THR 508.A O no hydrogen 3.194 N/A ARG 512.A NH2 GLU 451.A OE2 no hydrogen 2.680 N/A ALA 513.A N PHE 509.A O no hydrogen 3.156 N/A LEU 514.A N VAL 510.A O no hydrogen 2.881 N/A ALA 515.A N VAL 511.A O no hydrogen 2.842 N/A SER 516.A N ALA 513.A O no hydrogen 3.362 N/A SER 516.A OG VAL 457.A O no hydrogen 2.628 N/A SER 516.A OG ARG 512.A O no hydrogen 2.950 N/A SER 517.A N LEU 514.A O no hydrogen 3.425 N/A SER 517.A OG LEU 514.A O no hydrogen 2.722 N/A ARG 519.A N LEU 368.A O no hydrogen 3.045 N/A ARG 519.A NE ASP 370.A OD2 no hydrogen 2.606 N/A ARG 519.A NH1 ASP 370.A OD1 no hydrogen 3.442 N/A LEU 520.A N SER 367.A OG no hydrogen 2.862 N/A SER 521.A N PRO 554.A O no hydrogen 2.947 N/A SER 521.A OG HIS 523.A NE2 no hydrogen 3.014 N/A SER 521.A OG SER 552.A O no hydrogen 2.889 N/A SER 521.A OG PRO 554.A O no hydrogen 3.122 N/A HIS 523.A N LEU 556.A O no hydrogen 2.929 N/A HIS 523.A NE2 SER 521.A OG no hydrogen 3.014 N/A VAL 525.A N PHE 558.A O no hydrogen 2.940 N/A GLY 527.A N ASP 560.A O no hydrogen 2.848 N/A SER 528.A OG GLU 561.A OE1 no hydrogen 2.878 N/A SER 528.A OG GLU 561.A OE2 no hydrogen 2.784 N/A LEU 530.A N LYS 526.A O no hydrogen 3.210 N/A ASP 532.A N SER 528.A O no hydrogen 2.759 N/A LYS 533.A N GLU 529.A O no hydrogen 3.008 N/A TRP 534.A N GLU 529.A O no hydrogen 2.949 N/A SER 538.A OG LEU 530.A O no hydrogen 3.153 N/A ALA 541.A N SER 537.A O no hydrogen 3.147 N/A VAL 542.A N SER 538.A O no hydrogen 3.122 N/A ARG 543.A N GLU 539.A O no hydrogen 3.402 N/A ARG 543.A NE GLU 539.A OE2 no hydrogen 3.202 N/A GLU 544.A N LYS 540.A O no hydrogen 2.880 N/A LEU 545.A N ALA 541.A O no hydrogen 2.964 N/A PHE 546.A N VAL 542.A O no hydrogen 3.124 N/A ALA 547.A N ARG 543.A O no hydrogen 2.946 N/A ARG 548.A N GLU 544.A O no hydrogen 2.889 N/A ARG 548.A NE GLU 363.A OE1 no hydrogen 2.732 N/A ARG 548.A NH1 HIS 523.A ND1 no hydrogen 3.522 N/A ARG 548.A NH2 GLU 544.A OE2 no hydrogen 3.524 N/A ALA 549.A N LEU 545.A O no hydrogen 3.075 N/A ARG 550.A N PHE 546.A O no hydrogen 2.805 N/A ARG 550.A NH2 GLU 588.A OE2 no hydrogen 3.300 N/A ASP 551.A N ALA 547.A O no hydrogen 3.120 N/A SER 552.A N ALA 549.A O no hydrogen 3.196 N/A SER 552.A OG GLY 365.A O no hydrogen 3.385 N/A SER 552.A OG ARG 548.A O no hydrogen 2.639 N/A SER 555.A N ASP 597.A O no hydrogen 2.751 N/A SER 555.A OG SER 521.A OG no hydrogen 2.828 N/A SER 555.A OG HIS 523.A NE2 no hydrogen 3.365 N/A SER 555.A OG ALA 549.A O no hydrogen 2.671 N/A LEU 556.A N SER 521.A O no hydrogen 2.908 N/A VAL 557.A N VAL 599.A O no hydrogen 2.715 N/A PHE 558.A N HIS 523.A O no hydrogen 2.975 N/A LEU 559.A N LEU 601.A O no hydrogen 2.787 N/A ASP 560.A N VAL 525.A O no hydrogen 2.988 N/A GLU 561.A N ASP 560.A OD1 no hydrogen 2.826 N/A ILE 562.A N ALA 603.A O no hydrogen 2.972 N/A ALA 564.A N GLU 561.A O no hydrogen 3.095 N/A ALA 566.A N ILE 562.A O no hydrogen 2.939 N/A ARG 568.A N LEU 609.A O no hydrogen 3.241 N/A ARG 568.A NE ASP 608.A O no hydrogen 2.553 N/A ARG 568.A NH2 ASP 608.A O no hydrogen 3.462 N/A GLN 571.A N ARG 568.A O no hydrogen 3.111 N/A VAL 577.A N ASP 574.A O no hydrogen 3.305 N/A THR 578.A N ASP 574.A OD1 no hydrogen 3.020 N/A THR 578.A OG1 ASP 574.A OD1 no hydrogen 3.483 N/A THR 578.A OG1 ASP 574.A OD2 no hydrogen 2.818 N/A LYS 580.A N GLY 576.A O no hydrogen 3.183 N/A VAL 581.A N VAL 577.A O no hydrogen 3.192 N/A VAL 582.A N THR 578.A O no hydrogen 2.934 N/A ALA 583.A N ASP 579.A O no hydrogen 2.897 N/A SER 584.A N LYS 580.A O no hydrogen 2.884 N/A SER 584.A OG GLU 539.A OE2 no hydrogen 3.167 N/A LEU 585.A N VAL 581.A O no hydrogen 2.709 N/A LEU 586.A N VAL 582.A O no hydrogen 2.805 N/A THR 587.A N ALA 583.A O no hydrogen 3.056 N/A THR 587.A OG1 ALA 583.A O no hydrogen 2.775 N/A GLU 588.A N SER 584.A O no hydrogen 2.894 N/A LEU 589.A N LEU 585.A O no hydrogen 2.810 N/A ASP 590.A N LEU 586.A O no hydrogen 3.031 N/A GLY 591.A N THR 587.A O no hydrogen 3.206 N/A GLY 591.A N GLU 588.A O no hydrogen 3.117 N/A ILE 592.A N GLU 588.A O no hydrogen 3.145 N/A ILE 592.A N LEU 589.A O no hydrogen 3.312 N/A GLU 593.A N LEU 589.A O no hydrogen 3.178 N/A LEU 595.A N ILE 592.A O no hydrogen 2.961 N/A ARG 596.A NH1 ILE 491.A O no hydrogen 2.955 N/A ARG 596.A NH2 ILE 491.A O no hydrogen 2.771 N/A VAL 599.A N SER 555.A O no hydrogen 2.930 N/A LEU 601.A N VAL 557.A O no hydrogen 2.749 N/A GLY 602.A N VAL 497.A O no hydrogen 2.750 N/A ALA 603.A N LEU 559.A O no hydrogen 3.076 N/A THR 604.A N LEU 499.A O no hydrogen 3.021 N/A THR 604.A OG1 ASP 563.A OD1 no hydrogen 3.045 N/A ARG 606.A N THR 604.A OG1 no hydrogen 2.910 N/A ARG 606.A NE ASP 608.A OD1 no hydrogen 3.511 N/A ARG 606.A NH2 ASP 608.A OD2 no hydrogen 3.450 N/A ASP 608.A N ASP 608.A OD1 no hydrogen 2.563 N/A LEU 609.A N ARG 606.A O no hydrogen 3.286 N/A ILE 610.A N PRO 607.A O no hydrogen 3.182 N/A ASP 611.A N ALA 566.A O no hydrogen 3.206 N/A LEU 614.A N ASP 611.A O no hydrogen 2.817 N/A LEU 615.A N PRO 612.A O no hydrogen 2.932 N/A GLY 618.A N GLU 621.A OE1 no hydrogen 2.710 N/A ARG 619.A N ARG 616.A O no hydrogen 2.993 N/A ARG 619.A NE ASP 590.A OD1 no hydrogen 2.959 N/A ARG 619.A NH1 ALA 613.A O no hydrogen 2.814 N/A ARG 619.A NH2 ASP 590.A OD2 no hydrogen 3.114 N/A LEU 620.A N LEU 614.A O no hydrogen 3.037 N/A GLU 621.A N GLY 496.A O no hydrogen 3.132 N/A ARG 622.A N GLY 496.A O no hydrogen 2.961 N/A VAL 624.A N LEU 498.A O no hydrogen 2.969 N/A VAL 626.A N TYR 500.A O no hydrogen 2.879 N/A ALA 633.A N ASP 630.A OD1 no hydrogen 2.972 N/A ARG 634.A N ASP 630.A O no hydrogen 2.732 N/A ARG 634.A NE ALA 657.A O no hydrogen 2.710 N/A ARG 634.A NH1 PRO 629.A O no hydrogen 2.916 N/A ARG 634.A NH2 ALA 657.A O no hydrogen 2.763 N/A ARG 635.A N ALA 631.A O no hydrogen 3.248 N/A ARG 635.A NH1 ALA 631.A O no hydrogen 3.161 N/A ARG 635.A NH1 ASP 658.A OD1 no hydrogen 3.480 N/A ARG 635.A NH2 ASP 658.A OD2 no hydrogen 2.467 N/A ASP 636.A N ALA 632.A O no hydrogen 3.393 N/A ILE 637.A N ALA 633.A O no hydrogen 3.058 N/A LEU 638.A N ARG 634.A O no hydrogen 2.966 N/A ARG 639.A N ARG 635.A O no hydrogen 2.893 N/A ARG 639.A NH1 ASP 654.A OD1 no hydrogen 2.388 N/A ARG 639.A NH2 ASP 654.A OD2 no hydrogen 2.841 N/A THR 640.A N ASP 636.A O no hydrogen 2.705 N/A THR 640.A OG1 ASP 636.A O no hydrogen 3.043 N/A ALA 641.A N ILE 637.A O no hydrogen 3.032 N/A GLY 642.A N LEU 638.A O no hydrogen 2.685 N/A ILE 645.A N GLY 642.A O no hydrogen 3.357 N/A ALA 648.A N VAL 689.A O no hydrogen 2.885 N/A VAL 651.A N ALA 648.A O no hydrogen 3.011 N/A ASP 654.A N ASP 652.A OD1 no hydrogen 3.269 N/A SER 655.A N ASP 652.A OD2 no hydrogen 3.406 N/A SER 655.A OG ASP 652.A O no hydrogen 3.097 N/A SER 655.A OG ASP 652.A OD2 no hydrogen 2.841 N/A LEU 656.A N ASP 652.A O no hydrogen 2.997 N/A ALA 657.A N LEU 653.A O no hydrogen 3.026 N/A ASP 658.A N ASP 654.A O no hydrogen 3.293 N/A ASP 659.A N SER 655.A O no hydrogen 3.293 N/A ASP 659.A N LEU 656.A O no hydrogen 3.146 N/A LEU 660.A N ALA 657.A O no hydrogen 3.169 N/A TYR 663.A N LEU 660.A O no hydrogen 3.205 N/A TYR 663.A OH VAL 701.A O no hydrogen 2.660 N/A SER 664.A N ASP 667.A OD2 no hydrogen 3.096 N/A SER 664.A OG GLY 504.A O no hydrogen 3.219 N/A ALA 666.A N GLY 504.A O no hydrogen 2.889 N/A ASP 667.A N SER 664.A OG no hydrogen 3.165 N/A CYS 668.A N SER 664.A O no hydrogen 3.073 N/A CYS 668.A SG SER 664.A O no hydrogen 3.287 N/A VAL 669.A N ALA 665.A O no hydrogen 3.122 N/A ALA 670.A N ALA 666.A O no hydrogen 2.969 N/A LEU 671.A N ASP 667.A O no hydrogen 2.925 N/A LEU 672.A N CYS 668.A O no hydrogen 3.173 N/A ARG 673.A N VAL 669.A O no hydrogen 3.120 N/A GLU 674.A N ALA 670.A O no hydrogen 2.864 N/A SER 675.A N LEU 671.A O no hydrogen 2.905 N/A SER 675.A OG LEU 671.A O no hydrogen 2.568 N/A ALA 676.A N LEU 672.A O no hydrogen 2.898 N/A MET 677.A N ARG 673.A O no hydrogen 3.086 N/A THR 678.A N GLU 674.A O no hydrogen 2.818 N/A THR 678.A OG1 GLU 674.A O no hydrogen 2.843 N/A ALA 679.A N SER 675.A O no hydrogen 3.001 N/A MET 680.A N ALA 676.A O no hydrogen 2.936 N/A ARG 681.A N MET 677.A O no hydrogen 3.010 N/A ARG 681.A NH1 HIS 5.A O no hydrogen 3.435 N/A ARG 681.A NH2 HIS 5.A O no hydrogen 3.552 N/A ARG 682.A N THR 678.A O no hydrogen 3.091 N/A ARG 682.A NE ASP 693.A OD1 no hydrogen 2.891 N/A ARG 682.A NH2 ALA 686.A O no hydrogen 3.444 N/A ARG 682.A NH2 ASP 693.A OD2 no hydrogen 2.840 N/A SER 683.A N ALA 679.A O no hydrogen 3.127 N/A ALA 686.A N SER 683.A OG no hydrogen 3.225 N/A VAL 689.A N PRO 646.A O no hydrogen 3.150 N/A THR 690.A N ASP 693.A OD2 no hydrogen 2.791 N/A ASP 693.A N THR 690.A OG1 no hydrogen 3.169 N/A VAL 694.A N THR 690.A O no hydrogen 3.253 N/A ALA 695.A N ALA 691.A O no hydrogen 2.924 N/A LYS 696.A N ALA 692.A O no hydrogen 2.870 N/A ALA 697.A N ASP 693.A O no hydrogen 2.977 N/A ARG 698.A N VAL 694.A O no hydrogen 2.931 N/A GLU 699.A N LYS 696.A O no hydrogen 2.961 N/A THR 700.A N ALA 697.A O no hydrogen 3.120 N/A THR 700.A OG1 ALA 697.A O no hydrogen 3.178 N/A VAL 701.A N ALA 697.A O no hydrogen 2.864 N/A ARG 702.A NH1 ARG 698.A O no hydrogen 2.396 N/A SER 704.A N GLY 662.A O no hydrogen 3.214 N/A SER 704.A OG ASP 667.A OD2 no hydrogen 2.332 N/A LEU 705.A N GLY 662.A O no hydrogen 3.147 N/A ALA 708.A N ASP 706.A OD1 no hydrogen 2.941 N/A VAL 710.A N ASP 706.A O no hydrogen 2.795 N/A GLU 711.A N PRO 707.A O no hydrogen 3.073 N/A SER 712.A N ALA 708.A O no hydrogen 2.882 N/A LEU 713.A N GLN 709.A O no hydrogen 3.078 N/A ARG 714.A N VAL 710.A O no hydrogen 3.111 N/A ARG 714.A NE GLU 627.A OE1 no hydrogen 3.481 N/A ARG 714.A NE GLU 627.A OE2 no hydrogen 2.927 N/A ARG 714.A NH2 GLU 627.A OE1 no hydrogen 3.046 N/A GLU 715.A N GLU 711.A O no hydrogen 3.100 N/A PHE 716.A N LEU 713.A O no hydrogen 3.258 N/A GLU 718.A N GLU 715.A O no hydrogen 3.161 N/A LYS 719.A N GLU 715.A O no hydrogen 3.126 N/A