Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ihp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N GLU 7.A OE1 no hydrogen 3.233 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.693 N/A ALA 8.A N LEU 4.A O no hydrogen 3.203 N/A LEU 9.A N SER 5.A O no hydrogen 2.884 N/A LEU 10.A N GLU 6.A O no hydrogen 2.857 N/A SER 11.A N GLU 7.A O no hydrogen 3.070 N/A SER 11.A OG ALA 8.A O no hydrogen 2.955 N/A VAL 12.A N ALA 8.A O no hydrogen 3.308 N/A VAL 12.A N LEU 9.A O no hydrogen 3.219 N/A THR 15.A N VAL 12.A O no hydrogen 2.987 N/A THR 15.A OG1 VAL 12.A O no hydrogen 2.570 N/A THR 15.A OG1 GLN 67.A OE1 no hydrogen 3.384 N/A ILE 16.A N LEU 13.A O no hydrogen 2.779 N/A ARG 17.A N MET 47.A O no hydrogen 2.997 N/A HIS 26.A N PHE 50.A O no hydrogen 2.788 N/A LYS 27.A NZ LEU 114.A O no hydrogen 3.436 N/A CYS 30.A N ASP 35.A O no hydrogen 2.795 N/A CYS 30.A SG SER 33.A OG no hydrogen 3.263 N/A ALA 31.A N GLY 52.A O no hydrogen 3.057 N/A ASP 35.A N SER 33.A OG no hydrogen 3.173 N/A THR 36.A N SER 39.A OG no hydrogen 2.925 N/A THR 36.A OG1 ASP 28.A O no hydrogen 3.170 N/A THR 36.A OG1 PHE 34.A O no hydrogen 3.517 N/A SER 39.A N THR 36.A O no hydrogen 2.760 N/A SER 39.A OG THR 36.A O no hydrogen 3.162 N/A GLY 42.A N SER 39.A O no hydrogen 2.893 N/A LEU 43.A N LEU 73.A O no hydrogen 2.808 N/A TYR 44.A N PHE 53.A O no hydrogen 2.749 N/A ILE 45.A N LEU 71.A O no hydrogen 2.752 N/A CYS 46.A N LEU 51.A O no hydrogen 2.872 N/A CYS 46.A SG THR 49.A OG1 no hydrogen 3.312 N/A MET 47.A N VAL 69.A O no hydrogen 3.385 N/A PHE 50.A N CYS 46.A O no hydrogen 3.010 N/A LEU 51.A N THR 49.A OG1 no hydrogen 3.239 N/A PHE 53.A N TYR 44.A O no hydrogen 2.750 N/A TYR 57.A N GLY 54.A O no hydrogen 2.928 N/A VAL 58.A N GLY 54.A O no hydrogen 3.157 N/A ARG 60.A N TYR 57.A O no hydrogen 2.905 N/A HIS 61.A ND1 TYR 70.A OH no hydrogen 3.310 N/A PHE 62.A N VAL 58.A O no hydrogen 2.973 N/A ASN 63.A N GLU 59.A O no hydrogen 2.999 N/A LYS 64.A N ARG 60.A O no hydrogen 3.027 N/A LYS 64.A NZ ALA 273.A O no hydrogen 2.733 N/A THR 65.A N HIS 61.A O no hydrogen 2.859 N/A THR 65.A N PHE 62.A O no hydrogen 3.300 N/A GLY 66.A N PHE 62.A O no hydrogen 2.762 N/A GLN 67.A NE2 VAL 69.A O no hydrogen 2.762 N/A ARG 68.A NE LEU 85.A O no hydrogen 2.791 N/A ARG 68.A NH2 GLU 3.A OE1 no hydrogen 3.341 N/A ARG 68.A NH2 GLU 3.A OE2 no hydrogen 3.350 N/A ARG 68.A NH2 LEU 85.A O no hydrogen 3.473 N/A TYR 70.A N VAL 83.A O no hydrogen 2.889 N/A TYR 70.A OH HIS 61.A ND1 no hydrogen 3.310 N/A TYR 70.A OH GLN 67.A O no hydrogen 2.760 N/A LEU 71.A N ILE 45.A O no hydrogen 2.887 N/A HIS 72.A N LYS 81.A O no hydrogen 2.681 N/A HIS 72.A NE2 GLY 41.A O no hydrogen 2.726 N/A LEU 73.A N LEU 43.A O no hydrogen 2.810 N/A ARG 74.A N ASP 79.A O no hydrogen 3.213 N/A ARG 75.A N PRO 37.A O no hydrogen 3.004 N/A THR 76.A N ASP 77.A O no hydrogen 3.057 N/A ASP 79.A N ARG 74.A O no hydrogen 2.789 N/A LYS 81.A N HIS 72.A O no hydrogen 3.039 N/A LYS 81.A NZ GLU 90.A OE2 no hydrogen 3.089 N/A ILE 82.A N ILE 91.A O no hydrogen 2.962 N/A VAL 83.A N TYR 70.A O no hydrogen 2.788 N/A ILE 84.A N LEU 89.A O no hydrogen 2.993 N/A LEU 85.A N ARG 68.A O no hydrogen 2.707 N/A TYR 88.A OH GLU 59.A OE1 no hydrogen 2.803 N/A LEU 89.A N ILE 84.A O no hydrogen 3.244 N/A ILE 91.A N ILE 82.A O no hydrogen 2.914 N/A GLY 95.A N ALA 92.A O no hydrogen 2.897 N/A LEU 99.A N LEU 96.A O no hydrogen 3.357 N/A ARG 104.A N PRO 100.A O no hydrogen 3.190 N/A ASP 105.A N ASP 101.A O no hydrogen 2.768 N/A ARG 106.A N ILE 102.A O no hydrogen 3.064 N/A ARG 106.A NH2 LEU 13.A O no hydrogen 3.013 N/A VAL 107.A N VAL 103.A O no hydrogen 2.830 N/A THR 108.A N ARG 104.A O no hydrogen 3.089 N/A THR 108.A OG1 ARG 104.A O no hydrogen 2.606 N/A SER 109.A N ASP 105.A O no hydrogen 3.136 N/A ALA 110.A N ARG 106.A O no hydrogen 3.044 N/A VAL 111.A N VAL 107.A O no hydrogen 3.083 N/A GLU 112.A N THR 108.A O no hydrogen 2.857 N/A ALA 113.A N SER 109.A O no hydrogen 3.023 N/A LEU 114.A N ALA 110.A O no hydrogen 2.984 N/A LEU 114.A N VAL 111.A O no hydrogen 2.998 N/A LEU 115.A N VAL 111.A O no hydrogen 3.086 N/A SER 116.A OG GLU 112.A O no hydrogen 3.319 N/A ARG 118.A NH1 ASP 200.A OD1 no hydrogen 3.186 N/A ARG 118.A NH2 ASP 200.A OD1 no hydrogen 3.127 N/A SER 121.A N LEU 211.A O no hydrogen 2.931 N/A SER 121.A OG GLU 206.A OE2 no hydrogen 2.842 N/A LYS 122.A N GLU 206.A OE1 no hydrogen 2.705 N/A HIS 123.A N SER 121.A OG no hydrogen 3.098 N/A HIS 123.A NE2 ASP 205.A OD1 no hydrogen 3.184 N/A ALA 124.A N SER 121.A O no hydrogen 3.321 N/A GLN 129.A NE2 LEU 156.A O no hydrogen 3.047 N/A GLN 129.A NE2 HIS 218.A O no hydrogen 2.955 N/A LEU 130.A N THR 157.A O no hydrogen 2.856 N/A ILE 136.A N PHE 222.A O no hydrogen 3.297 N/A CYS 139.A SG MET 631.A O no hydrogen 2.968 N/A TRP 141.A NE1 PRO 137.A O no hydrogen 2.792 N/A CYS 143.A N MET 148.A O no hydrogen 3.121 N/A CYS 143.A SG HIS 175.A ND1 no hydrogen 3.120 N/A SER 144.A N ILE 161.A O no hydrogen 2.802 N/A CYS 146.A SG HIS 175.A ND1 no hydrogen 3.779 N/A ARG 149.A NH1 GLY 140.A O no hydrogen 3.491 N/A TRP 153.A N LEU 162.A O no hydrogen 2.719 N/A LEU 154.A N VAL 189.A O no hydrogen 2.782 N/A ASN 155.A N SER 160.A O no hydrogen 2.985 N/A ASN 155.A ND2 TYR 185.A O no hydrogen 3.001 N/A LEU 156.A N LEU 187.A O no hydrogen 2.797 N/A THR 157.A N ASN 155.A OD1 no hydrogen 2.958 N/A THR 157.A OG1 LYS 128.A O no hydrogen 3.555 N/A ASP 158.A N ASN 155.A O no hydrogen 3.368 N/A GLY 159.A N ASN 155.A O no hydrogen 2.958 N/A SER 160.A N ASP 158.A OD1 no hydrogen 3.345 N/A SER 160.A OG ASP 158.A OD1 no hydrogen 3.097 N/A LEU 162.A N TRP 153.A O no hydrogen 2.992 N/A CYS 163.A SG HIS 175.A ND1 no hydrogen 3.281 N/A GLY 164.A N ASN 151.A O no hydrogen 2.838 N/A ARG 165.A NH2 TYR 204.A OH no hydrogen 2.555 N/A ARG 166.A N ASN 174.A OD1 no hydrogen 2.613 N/A SER 170.A OG ASP 168.A OD2 no hydrogen 2.993 N/A GLY 172.A N ARG 165.A O no hydrogen 3.283 N/A ASN 174.A N GLY 164.A O no hydrogen 2.980 N/A ALA 176.A N CYS 163.A O no hydrogen 3.096 N/A GLU 178.A N ASN 174.A O no hydrogen 3.302 N/A HIS 179.A N HIS 175.A O no hydrogen 3.017 N/A HIS 179.A NE2 ASP 158.A OD2 no hydrogen 2.710 N/A TYR 180.A N ALA 176.A O no hydrogen 3.004 N/A TYR 180.A OH ASP 205.A OD2 no hydrogen 3.203 N/A ARG 181.A N VAL 177.A O no hydrogen 2.748 N/A GLU 182.A N GLU 178.A O no hydrogen 3.004 N/A THR 183.A N HIS 179.A O no hydrogen 3.105 N/A THR 183.A N TYR 180.A O no hydrogen 3.162 N/A THR 183.A OG1 HIS 179.A O no hydrogen 2.844 N/A THR 183.A OG1 TYR 180.A O no hydrogen 3.564 N/A GLY 184.A N TYR 180.A O no hydrogen 2.657 N/A TYR 185.A N THR 183.A OG1 no hydrogen 2.997 N/A ALA 188.A N TYR 202.A O no hydrogen 2.985 N/A VAL 189.A N LEU 154.A O no hydrogen 2.697 N/A LYS 190.A N ASP 200.A O no hydrogen 2.948 N/A LEU 191.A N LEU 152.A O no hydrogen 2.898 N/A THR 193.A N LYS 190.A O no hydrogen 2.938 N/A THR 193.A OG1 LYS 190.A O no hydrogen 2.626 N/A THR 195.A N GLY 198.A O no hydrogen 3.119 N/A ASP 197.A N THR 195.A OG1 no hydrogen 3.021 N/A GLY 198.A N THR 195.A O no hydrogen 3.344 N/A ASP 200.A N THR 193.A OG1 no hydrogen 2.991 N/A TYR 202.A N ALA 188.A O no hydrogen 2.728 N/A TYR 202.A OH ASP 207.A OD1 no hydrogen 2.413 N/A SER 203.A N ASP 208.A O no hydrogen 2.800 N/A SER 203.A OG GLU 206.A OE2 no hydrogen 2.568 N/A TYR 204.A N PRO 186.A O no hydrogen 2.943 N/A GLU 206.A N SER 203.A OG no hydrogen 2.990 N/A ASP 207.A N TYR 204.A O no hydrogen 3.445 N/A ASP 208.A N SER 203.A O no hydrogen 3.205 N/A VAL 210.A N VAL 201.A O no hydrogen 2.902 N/A LEU 211.A N GLN 119.A O no hydrogen 2.764 N/A SER 214.A N ASP 212.A OD1 no hydrogen 2.712 N/A LEU 215.A N ASP 212.A O no hydrogen 2.937 N/A HIS 218.A N SER 214.A O no hydrogen 2.858 N/A HIS 218.A ND1 ASP 212.A OD2 no hydrogen 2.613 N/A LEU 219.A N LEU 215.A O no hydrogen 2.605 N/A SER 220.A N ALA 216.A O no hydrogen 2.751 N/A HIS 221.A N GLU 217.A O no hydrogen 3.112 N/A HIS 221.A NE2 LEU 130.A O no hydrogen 2.742 N/A PHE 222.A N LEU 219.A O no hydrogen 2.927 N/A GLY 223.A N SER 220.A O no hydrogen 2.913 N/A ILE 224.A N LEU 219.A O no hydrogen 3.043 N/A LEU 228.A N VAL 653.A O no hydrogen 2.832 N/A GLY 232.A N LEU 292.A O no hydrogen 3.043 N/A TYR 233.A N GLY 230.A O no hydrogen 2.973 N/A TYR 233.A OH GLU 642.A OE2 no hydrogen 3.244 N/A THR 234.A OG1 GLY 291.A O no hydrogen 3.187 N/A THR 234.A OG1 LEU 292.A O no hydrogen 3.200 N/A ILE 236.A N ASP 650.A O no hydrogen 2.804 N/A ARG 237.A N ILE 299.A O no hydrogen 2.799 N/A ARG 237.A NH1 GLY 298.A O no hydrogen 3.206 N/A ASN 238.A ND2 ASP 650.A OD2 no hydrogen 3.372 N/A LEU 239.A N SER 242.A OG no hydrogen 3.128 N/A GLY 240.A N ASN 238.A OD1 no hydrogen 2.937 N/A ASN 241.A ND2 ASN 318.A O no hydrogen 2.936 N/A CYS 243.A SG HIS 634.A ND1 no hydrogen 4.013 N/A ASN 246.A N SER 242.A O no hydrogen 2.930 N/A ASN 246.A ND2 ASP 650.A OD1 no hydrogen 3.219 N/A SER 247.A N CYS 243.A O no hydrogen 2.818 N/A SER 247.A OG CYS 243.A O no hydrogen 3.338 N/A VAL 248.A N TYR 244.A O no hydrogen 3.144 N/A VAL 249.A N LEU 245.A O no hydrogen 2.992 N/A GLN 250.A N ASN 246.A O no hydrogen 3.010 N/A VAL 251.A N VAL 248.A O no hydrogen 2.758 N/A LEU 252.A N VAL 248.A O no hydrogen 2.982 N/A PHE 253.A N VAL 249.A O no hydrogen 3.227 N/A SER 254.A N VAL 251.A O no hydrogen 2.854 N/A SER 254.A OG GLN 250.A O no hydrogen 2.798 N/A ILE 255.A N LEU 252.A O no hydrogen 2.930 N/A PHE 258.A N ILE 255.A O no hydrogen 2.899 N/A GLN 259.A N ILE 255.A O no hydrogen 3.106 N/A GLN 259.A NE2 PHE 253.A O no hydrogen 2.782 N/A ARG 260.A N PRO 256.A O no hydrogen 2.791 N/A LYS 261.A N ASP 257.A O no hydrogen 3.161 N/A LYS 261.A NZ GLU 342.A O no hydrogen 2.774 N/A LYS 261.A NZ GLU 342.A OE1 no hydrogen 3.500 N/A TYR 262.A N PHE 258.A O no hydrogen 3.198 N/A VAL 263.A N GLN 259.A O no hydrogen 2.804 N/A ASP 264.A N GLN 259.A O no hydrogen 2.930 N/A LEU 266.A N VAL 263.A O no hydrogen 3.429 N/A ILE 269.A N LYS 265.A O no hydrogen 3.109 N/A PHE 270.A N LEU 266.A O no hydrogen 2.709 N/A GLN 271.A N GLU 267.A O no hydrogen 2.879 N/A ASN 272.A N LYS 268.A O no hydrogen 2.999 N/A ALA 273.A N PHE 270.A O no hydrogen 3.326 N/A THR 278.A N ASP 276.A OD1 no hydrogen 2.826 N/A THR 278.A OG1 ASP 276.A OD1 no hydrogen 2.637 N/A THR 278.A OG1 ASP 276.A OD2 no hydrogen 3.514 N/A THR 278.A OG1 GLN 279.A OE1 no hydrogen 3.254 N/A ASP 280.A N PRO 277.A O no hydrogen 3.223 N/A THR 283.A N ASP 280.A OD2 no hydrogen 3.274 N/A THR 283.A OG1 ASP 280.A OD2 no hydrogen 2.683 N/A GLN 284.A N ASP 280.A O no hydrogen 3.017 N/A GLN 284.A NE2 ALA 31.A O no hydrogen 3.294 N/A GLN 284.A NE2 PRO 277.A O no hydrogen 2.935 N/A VAL 285.A N PHE 281.A O no hydrogen 2.970 N/A ALA 286.A N SER 282.A O no hydrogen 2.853 N/A LYS 287.A N THR 283.A O no hydrogen 2.783 N/A LYS 287.A NZ GLU 29.A OE2 no hydrogen 2.989 N/A LYS 287.A NZ CYS 30.A O no hydrogen 2.911 N/A LYS 287.A NZ SER 33.A O no hydrogen 2.742 N/A LEU 288.A N GLN 284.A O no hydrogen 2.939 N/A GLY 289.A N VAL 285.A O no hydrogen 3.017 N/A HIS 290.A N ALA 286.A O no hydrogen 2.895 N/A GLY 291.A N LYS 287.A O no hydrogen 3.045 N/A LEU 292.A N GLY 289.A O no hydrogen 3.094 N/A LEU 293.A N GLY 289.A O no hydrogen 3.084 N/A LEU 293.A N HIS 290.A O no hydrogen 3.144 N/A SER 294.A N HIS 290.A O no hydrogen 3.196 N/A SER 294.A OG HIS 290.A O no hydrogen 2.639 N/A ILE 299.A N GLY 235.A O no hydrogen 3.048 N/A ARG 302.A N ALA 300.A O no hydrogen 2.894 N/A LYS 305.A N PRO 301.A O no hydrogen 2.959 N/A LYS 305.A NZ THR 317.A O no hydrogen 3.397 N/A ALA 306.A N ARG 302.A O no hydrogen 2.825 N/A LEU 307.A N MET 303.A O no hydrogen 3.164 N/A ILE 308.A N PHE 304.A O no hydrogen 2.914 N/A LYS 310.A N LEU 307.A O no hydrogen 3.207 N/A HIS 312.A N GLY 309.A O no hydrogen 2.993 N/A GLU 314.A N HIS 312.A ND1 no hydrogen 2.950 N/A PHE 315.A N HIS 312.A ND1 no hydrogen 3.168 N/A SER 316.A OG HIS 312.A O no hydrogen 2.553 N/A THR 317.A N GLU 314.A O no hydrogen 3.160 N/A THR 317.A OG1 GLU 314.A O no hydrogen 3.163 N/A ARG 319.A N THR 317.A OG1 no hydrogen 3.070 N/A GLN 320.A NE2 ASN 241.A OD1 no hydrogen 3.330 N/A GLN 321.A NE2 GLU 314.A OE1 no hydrogen 2.984 N/A GLN 321.A NE2 ARG 319.A O no hydrogen 3.440 N/A ALA 323.A N TYR 635.A OH no hydrogen 3.018 N/A GLN 324.A NE2 GLN 459.A OE1 no hydrogen 3.309 N/A GLU 325.A N ASP 322.A OD2 no hydrogen 2.867 N/A PHE 326.A N ASP 322.A O no hydrogen 3.058 N/A PHE 327.A N ALA 323.A O no hydrogen 2.908 N/A LEU 328.A N GLN 324.A O no hydrogen 2.981 N/A HIS 329.A N GLU 325.A O no hydrogen 3.041 N/A LEU 330.A N PHE 326.A O no hydrogen 2.899 N/A ILE 331.A N PHE 327.A O no hydrogen 2.840 N/A ASN 332.A N.A LEU 328.A O no hydrogen 2.955 N/A ASN 332.A N.B LEU 328.A O no hydrogen 2.929 N/A ASN 332.A ND2.A LEU 328.A O no hydrogen 3.047 N/A MET 333.A N HIS 329.A O no hydrogen 3.000 N/A VAL 334.A N LEU 330.A O no hydrogen 2.815 N/A GLU 335.A N ILE 331.A O no hydrogen 3.011 N/A ARG 336.A N ASN 332.A O.A no hydrogen 3.080 N/A ARG 336.A N ASN 332.A O.B no hydrogen 3.021 N/A ARG 336.A NH1 ASP 591.A OD1 no hydrogen 2.639 N/A ASN 337.A N MET 333.A O no hydrogen 3.265 N/A ASN 337.A N VAL 334.A O no hydrogen 3.044 N/A ASN 337.A ND2 MET 333.A O no hydrogen 2.818 N/A CYS 338.A N GLU 335.A O no hydrogen 3.336 N/A CYS 338.A SG TYR 262.A OH no hydrogen 3.783 N/A CYS 338.A SG VAL 334.A O no hydrogen 3.423 N/A CYS 338.A SG GLU 342.A O no hydrogen 3.457 N/A ARG 339.A NE GLY 569.A O no hydrogen 2.857 N/A ARG 339.A NH2 GLY 569.A O no hydrogen 3.519 N/A SER 341.A N CYS 338.A O no hydrogen 3.291 N/A SER 341.A OG ARG 339.A O no hydrogen 3.226 N/A ASN 343.A ND2 GLU 335.A OE1 no hydrogen 3.133 N/A ASN 345.A N ASN 343.A OD1 no hydrogen 2.958 N/A ASN 345.A ND2 ILE 331.A O no hydrogen 2.768 N/A ASN 345.A ND2 GLU 335.A OE1 no hydrogen 2.807 N/A GLU 346.A N ASN 343.A O no hydrogen 3.226 N/A VAL 347.A N PRO 344.A O no hydrogen 3.026 N/A PHE 348.A N ASN 345.A O no hydrogen 2.864 N/A ARG 349.A N ASN 345.A O no hydrogen 2.996 N/A ARG 349.A NE TYR 372.A OH no hydrogen 3.109 N/A ARG 349.A NH1 LYS 609.A O no hydrogen 2.632 N/A ARG 349.A NH2 GLU 335.A OE1 no hydrogen 3.387 N/A PHE 350.A N ASP 371.A O no hydrogen 2.889 N/A LEU 351.A N SER 451.A OG no hydrogen 3.329 N/A VAL 352.A N ARG 369.A O no hydrogen 2.734 N/A GLU 353.A N ARG 448.A O no hydrogen 2.933 N/A GLU 354.A N THR 367.A O no hydrogen 3.066 N/A LYS 355.A N THR 446.A O no hydrogen 3.111 N/A LYS 355.A NZ TYR 366.A OH no hydrogen 3.174 N/A LYS 355.A NZ GLU 498.A OE2 no hydrogen 2.889 N/A ILE 356.A N LYS 365.A O no hydrogen 2.911 N/A LYS 357.A N VAL 444.A O no hydrogen 2.944 N/A CYS 358.A N LYS 363.A O no hydrogen 2.808 N/A CYS 358.A SG THR 361.A OG1 no hydrogen 2.760 N/A CYS 358.A SG SER 434.A OG no hydrogen 3.132 N/A LEU 359.A N VAL 442.A O no hydrogen 3.289 N/A GLU 362.A N CYS 358.A O no hydrogen 2.740 N/A VAL 364.A N GLU 499.A O no hydrogen 2.894 N/A LYS 365.A N ILE 356.A O no hydrogen 3.045 N/A TYR 366.A OH GLU 498.A OE1 no hydrogen 2.873 N/A TYR 366.A OH GLU 498.A OE2 no hydrogen 3.359 N/A THR 367.A N GLU 354.A O no hydrogen 2.853 N/A ARG 369.A N VAL 352.A O no hydrogen 3.048 N/A ARG 369.A NE GLU 354.A OE2 no hydrogen 3.065 N/A ARG 369.A NH1 ASP 371.A OD2 no hydrogen 2.657 N/A ASP 371.A N PHE 350.A O no hydrogen 2.837 N/A TYR 372.A N ASP 371.A OD1 no hydrogen 2.687 N/A ILE 373.A N ASP 371.A OD1 no hydrogen 3.366 N/A MET 374.A N VAL 457.A O no hydrogen 2.728 N/A LEU 376.A N GLN 459.A O no hydrogen 2.612 N/A ALA 382.A N PRO 379.A O no hydrogen 2.913 N/A ALA 383.A N MET 380.A O no hydrogen 2.890 N/A LEU 384.A N GLN 413.A O no hydrogen 2.782 N/A ASN 385.A ND2 ARG 411.A O no hydrogen 3.003 N/A LYS 386.A NZ ASP 381.A O no hydrogen 3.307 N/A GLU 388.A N GLU 388.A OE1 no hydrogen 2.619 N/A LEU 389.A N ASN 385.A O no hydrogen 2.958 N/A LEU 390.A N LYS 386.A O no hydrogen 3.115 N/A GLU 391.A N GLU 387.A O no hydrogen 3.123 N/A GLU 393.A N LEU 389.A O no hydrogen 2.924 N/A GLU 394.A N LEU 390.A O no hydrogen 3.144 N/A LYS 395.A N GLU 391.A O no hydrogen 3.070 N/A LYS 396.A N TYR 392.A O no hydrogen 2.916 N/A ARG 397.A N GLU 393.A O no hydrogen 3.121 N/A ARG 397.A NH1 GLU 394.A OE2 no hydrogen 2.659 N/A GLN 398.A N GLU 394.A O no hydrogen 2.989 N/A ALA 399.A N LYS 395.A O no hydrogen 2.883 N/A GLU 400.A N LYS 396.A O no hydrogen 2.913 N/A GLU 401.A N ARG 397.A O no hydrogen 3.259 N/A GLU 402.A N GLN 398.A O no hydrogen 3.204 N/A LYS 403.A N GLU 400.A O no hydrogen 2.816 N/A MET 404.A N ALA 399.A O no hydrogen 2.773 N/A ARG 411.A NE ASP 475.A OD1 no hydrogen 2.495 N/A GLN 413.A N ASN 385.A OD1 no hydrogen 3.221 N/A GLN 413.A NE2 GLN 413.A O no hydrogen 3.398 N/A VAL 414.A N SER 477.A O no hydrogen 2.947 N/A PHE 416.A N GLU 479.A OE2.A no hydrogen 3.432 N/A SER 418.A N PRO 415.A O no hydrogen 3.238 N/A CYS 419.A N PRO 415.A O no hydrogen 3.492 N/A CYS 419.A SG PRO 415.A O no hydrogen 3.523 N/A LEU 420.A N PHE 416.A O no hydrogen 2.957 N/A GLU 421.A N SER 417.A O no hydrogen 3.124 N/A ALA 422.A N SER 418.A O no hydrogen 2.828 N/A TYR 423.A N CYS 419.A O no hydrogen 2.892 N/A GLY 424.A N LEU 420.A O no hydrogen 3.030 N/A ALA 425.A N GLU 421.A O no hydrogen 2.725 N/A GLU 427.A N LYS 445.A O no hydrogen 2.999 N/A VAL 429.A N ALA 443.A O no hydrogen 2.768 N/A PHE 432.A N SER 441.A O no hydrogen 2.854 N/A SER 434.A N ALA 439.A O no hydrogen 3.337 N/A THR 435.A OG1 PRO 502.A O no hydrogen 2.515 N/A LEU 437.A N SER 434.A OG no hydrogen 3.182 N/A GLN 438.A N SER 434.A O no hydrogen 2.701 N/A SER 441.A N PHE 432.A O no hydrogen 2.704 N/A ALA 443.A N VAL 429.A O no hydrogen 2.764 N/A VAL 444.A N LYS 357.A O no hydrogen 2.752 N/A LYS 445.A N GLU 427.A O no hydrogen 2.962 N/A LYS 445.A NZ GLU 354.A OE1 no hydrogen 3.561 N/A THR 446.A N LYS 355.A O no hydrogen 2.972 N/A THR 447.A OG1 GLU 354.A OE1 no hydrogen 3.121 N/A ARG 448.A N GLU 353.A O no hydrogen 3.006 N/A ARG 448.A NE THR 447.A O no hydrogen 3.150 N/A ARG 448.A NH1 GLY 424.A O no hydrogen 2.667 N/A PHE 449.A N LEU 489.A O no hydrogen 2.921 N/A ALA 450.A N LEU 351.A O no hydrogen 2.707 N/A PHE 452.A N ASP 612.A OD1 no hydrogen 2.995 N/A TYR 455.A N VAL 347.A O no hydrogen 2.928 N/A LEU 456.A N TYR 669.A O no hydrogen 2.709 N/A ILE 458.A N TYR 667.A O no hydrogen 2.725 N/A GLN 459.A N MET 374.A O no hydrogen 2.829 N/A GLN 459.A NE2 TYR 665.A OH no hydrogen 2.906 N/A ILE 460.A N TYR 665.A O no hydrogen 3.051 N/A LYS 461.A N LEU 376.A O no hydrogen 2.871 N/A LYS 462.A N ILE 460.A O no hydrogen 2.647 N/A LYS 462.A NZ LEU 663.A O no hydrogen 3.116 N/A LYS 462.A NZ GLY 664.A O no hydrogen 2.875 N/A PHE 463.A N LYS 461.A O no hydrogen 2.833 N/A THR 464.A N LYS 472.A O no hydrogen 3.018 N/A GLY 466.A N VAL 470.A O no hydrogen 2.717 N/A VAL 470.A N LEU 467.A O no hydrogen 3.268 N/A LYS 472.A N THR 464.A O no hydrogen 2.768 N/A LYS 473.A NZ HIS 625.A ND1 no hydrogen 3.032 N/A LYS 473.A NZ HIS 625.A O no hydrogen 2.737 N/A LYS 473.A NZ GLY 627.A O no hydrogen 2.909 N/A LEU 474.A N LYS 462.A O no hydrogen 2.976 N/A SER 477.A N ALA 412.A O no hydrogen 2.864 N/A SER 477.A OG ASP 662.A OD2 no hydrogen 3.007 N/A ILE 478.A N ASP 662.A O no hydrogen 3.104 N/A LEU 484.A N TYR 617.A O no hydrogen 2.940 N/A ILE 486.A N GLY 615.A O no hydrogen 2.690 N/A SER 487.A N ASP 485.A OD1 no hydrogen 3.320 N/A SER 487.A OG ASP 485.A OD1 no hydrogen 2.652 N/A SER 487.A OG ASP 485.A OD2 no hydrogen 3.345 N/A LEU 489.A N ILE 486.A O no hydrogen 3.069 N/A ARG 490.A N SER 487.A O no hydrogen 2.959 N/A ARG 490.A NH1 ASP 612.A OD2 no hydrogen 3.028 N/A ARG 490.A NH2 ASP 612.A OD1 no hydrogen 2.913 N/A ARG 490.A NH2 ASP 612.A OD2 no hydrogen 3.186 N/A GLY 491.A N PHE 449.A O no hydrogen 2.580 N/A GLY 493.A N GLU 353.A OE1 no hydrogen 2.947 N/A GLN 495.A N GLU 498.A OE1 no hydrogen 3.249 N/A GLN 495.A NE2 GLY 493.A O no hydrogen 3.635 N/A GLN 495.A NE2 LEU 494.A O no hydrogen 3.385 N/A GLU 498.A N GLN 495.A O no hydrogen 3.110 N/A LEU 501.A N VAL 364.A O no hydrogen 2.871 N/A GLN 510.A N VAL 507.A O no hydrogen 2.983 N/A LEU 511.A N VAL 507.A O no hydrogen 3.134 N/A VAL 512.A N ILE 508.A O no hydrogen 3.046 N/A GLU 513.A N ILE 509.A O no hydrogen 3.239 N/A MET 514.A N GLN 510.A O no hydrogen 3.419 N/A GLY 515.A N LEU 511.A O no hydrogen 3.335 N/A GLY 515.A N VAL 512.A O no hydrogen 3.299 N/A PHE 516.A N LEU 511.A O no hydrogen 3.403 N/A CYS 521.A N PRO 517.A O no hydrogen 3.022 N/A CYS 521.A SG PRO 517.A O no hydrogen 3.457 N/A ARG 522.A N MET 518.A O no hydrogen 2.935 N/A LYS 523.A N ASP 519.A O no hydrogen 3.342 N/A LYS 523.A NZ ASP 548.A O no hydrogen 3.276 N/A TYR 526.A N ARG 522.A O no hydrogen 3.367 N/A TYR 527.A N LYS 523.A O no hydrogen 3.136 N/A TYR 527.A OH PRO 552.A O no hydrogen 2.601 N/A THR 528.A OG1 ALA 524.A O no hydrogen 2.696 N/A THR 528.A OG1 VAL 525.A O no hydrogen 3.557 N/A GLY 529.A N TYR 526.A O no hydrogen 3.321 N/A ASN 530.A N VAL 525.A O no hydrogen 3.029 N/A ASN 530.A ND2 GLU 505.A OE2 no hydrogen 2.780 N/A SER 531.A OG THR 528.A O no hydrogen 2.854 N/A ALA 536.A N GLY 532.A O no hydrogen 3.443 N/A MET 537.A N ALA 533.A O no hydrogen 2.825 N/A ASN 538.A N GLU 534.A O no hydrogen 3.080 N/A TRP 539.A N ALA 535.A O no hydrogen 3.214 N/A VAL 540.A N ALA 536.A O no hydrogen 3.147 N/A MET 541.A N MET 537.A O no hydrogen 3.213 N/A SER 542.A N ASN 538.A O no hydrogen 3.180 N/A SER 542.A OG ASN 538.A O no hydrogen 3.188 N/A HIS 543.A N TRP 539.A O no hydrogen 2.836 N/A HIS 543.A ND1 ASP 546.A OD2 no hydrogen 2.691 N/A MET 544.A N VAL 540.A O no hydrogen 2.862 N/A ASP 546.A N HIS 543.A O no hydrogen 3.219 N/A ALA 550.A N PRO 547.A O no hydrogen 2.976 N/A ASN 551.A N ASP 548.A O no hydrogen 3.355 N/A ASN 551.A ND2 ASP 546.A OD2 no hydrogen 3.073 N/A VAL 562.A N PRO 558.A O no hydrogen 3.394 N/A THR 563.A N GLU 559.A O no hydrogen 3.375 N/A THR 563.A OG1 GLU 559.A O no hydrogen 3.223 N/A THR 563.A OG1 ASP 560.A O no hydrogen 3.269 N/A THR 564.A N CYS 561.A O no hydrogen 2.975 N/A THR 564.A OG1 ASP 560.A O no hydrogen 2.473 N/A THR 564.A OG1 CYS 561.A O no hydrogen 3.422 N/A ILE 565.A N CYS 561.A O no hydrogen 3.257 N/A VAL 566.A N VAL 562.A O no hydrogen 3.033 N/A SER 567.A N THR 563.A O no hydrogen 2.993 N/A SER 567.A OG THR 563.A O no hydrogen 3.258 N/A MET 568.A N ILE 565.A O no hydrogen 2.704 N/A GLY 569.A N VAL 566.A O no hydrogen 3.042 N/A PHE 570.A N VAL 566.A O no hydrogen 3.409 N/A SER 571.A N GLN 574.A OE1 no hydrogen 2.978 N/A ARG 572.A NH1 GLU 559.A OE1 no hydrogen 3.511 N/A ARG 572.A NH1 GLU 559.A OE2 no hydrogen 2.816 N/A ARG 572.A NH2 GLU 559.A OE1 no hydrogen 3.501 N/A GLN 574.A N SER 571.A OG no hydrogen 3.010 N/A ALA 575.A N SER 571.A O no hydrogen 3.177 N/A LEU 576.A N ARG 572.A O no hydrogen 2.929 N/A LYS 577.A N ASP 573.A O no hydrogen 3.162 N/A ALA 578.A N GLN 574.A O no hydrogen 3.199 N/A LEU 579.A N ALA 575.A O no hydrogen 3.207 N/A ARG 580.A N LEU 576.A O no hydrogen 2.983 N/A ALA 581.A N LYS 577.A O no hydrogen 2.929 N/A ALA 581.A N ALA 578.A O no hydrogen 3.153 N/A THR 582.A N ALA 578.A O no hydrogen 2.993 N/A THR 582.A N LEU 579.A O no hydrogen 3.164 N/A THR 582.A OG1 ALA 578.A O no hydrogen 2.696 N/A THR 582.A OG1 LEU 579.A O no hydrogen 3.413 N/A THR 582.A OG1 SER 585.A O no hydrogen 3.412 N/A ASN 584.A N LEU 579.A O no hydrogen 2.831 N/A SER 585.A N THR 582.A O no hydrogen 2.818 N/A ALA 589.A N SER 585.A O no hydrogen 2.916 N/A VAL 590.A N LEU 586.A O no hydrogen 2.988 N/A ASP 591.A N GLU 587.A O no hydrogen 3.101 N/A TRP 592.A N ARG 588.A O no hydrogen 2.813 N/A ILE 593.A N ALA 589.A O no hydrogen 3.020 N/A PHE 594.A N VAL 590.A O no hydrogen 3.358 N/A SER 595.A N ASP 591.A O no hydrogen 3.296 N/A SER 595.A OG ASP 591.A O no hydrogen 2.879 N/A SER 595.A OG TRP 592.A O no hydrogen 2.811 N/A SER 595.A OG HIS 596.A ND1 no hydrogen 3.288 N/A HIS 596.A N ILE 593.A O no hydrogen 3.176 N/A HIS 596.A ND1 TRP 592.A O no hydrogen 2.710 N/A ILE 597.A N ILE 593.A O no hydrogen 2.676 N/A ASP 599.A N HIS 596.A O no hydrogen 2.991 N/A LEU 600.A N HIS 596.A O no hydrogen 3.075 N/A ASP 601.A N ILE 597.A O no hydrogen 2.812 N/A ALA 602.A N ASP 599.A O no hydrogen 3.082 N/A GLU 603.A N ASP 599.A O no hydrogen 3.279 N/A GLU 603.A N LEU 600.A O no hydrogen 3.309 N/A ALA 604.A N LEU 600.A O no hydrogen 3.127 N/A ALA 605.A N ASP 601.A O no hydrogen 2.856 N/A MET 606.A N ALA 602.A O no hydrogen 3.248 N/A ARG 611.A NE ASP 454.A OD2 no hydrogen 2.963 N/A ARG 611.A NH1 GLU 346.A OE2 no hydrogen 3.470 N/A ARG 611.A NH2 ASP 257.A OD1 no hydrogen 2.614 N/A ARG 611.A NH2 ASP 454.A OD2 no hydrogen 3.092 N/A GLY 613.A N ASP 612.A OD1 no hydrogen 2.939 N/A TYR 617.A N LEU 484.A O no hydrogen 2.744 N/A TYR 617.A OH PRO 453.A O no hydrogen 2.581 N/A GLN 618.A N GLN 670.A O no hydrogen 2.855 N/A LEU 619.A N GLU 482.A O no hydrogen 2.971 N/A PHE 620.A N PHE 668.A O no hydrogen 2.857 N/A ALA 621.A N PHE 668.A O no hydrogen 3.121 N/A PHE 622.A N HIS 638.A O no hydrogen 2.840 N/A ILE 623.A N ILE 666.A O no hydrogen 2.633 N/A SER 624.A N VAL 636.A O no hydrogen 2.899 N/A MET 626.A N HIS 634.A O no hydrogen 2.755 N/A THR 630.A OG1 PRO 471.A O no hydrogen 3.328 N/A MET 631.A N SER 629.A OG no hydrogen 2.797 N/A CYS 632.A SG CYS 139.A O no hydrogen 3.508 N/A GLY 633.A N GLN 320.A OE1 no hydrogen 2.841 N/A HIS 634.A N MET 626.A O no hydrogen 3.129 N/A HIS 634.A NE2 ASN 649.A OD1 no hydrogen 2.747 N/A VAL 636.A N SER 624.A O no hydrogen 3.220 N/A CYS 637.A N TYR 648.A O no hydrogen 3.380 N/A CYS 637.A SG SER 247.A O no hydrogen 3.623 N/A HIS 638.A N PHE 622.A O no hydrogen 2.925 N/A ILE 639.A N VAL 646.A O no hydrogen 2.872 N/A LYS 640.A N PHE 620.A O no hydrogen 2.852 N/A LYS 641.A N ARG 644.A O no hydrogen 2.964 N/A LYS 641.A NZ GLY 232.A O no hydrogen 3.430 N/A LYS 641.A NZ SER 254.A OG no hydrogen 3.192 N/A ARG 644.A N LYS 641.A O no hydrogen 2.708 N/A ARG 644.A NE ARG 644.A O no hydrogen 3.261 N/A ARG 644.A NH1 TYR 233.A OH no hydrogen 2.560 N/A ARG 644.A NH1 LYS 641.A O no hydrogen 3.271 N/A VAL 646.A N ILE 639.A O no hydrogen 2.987 N/A ILE 647.A N CYS 654.A O no hydrogen 2.778 N/A TYR 648.A N CYS 637.A O no hydrogen 2.859 N/A TYR 648.A OH GLY 232.A O no hydrogen 2.578 N/A ASN 649.A N LYS 652.A O no hydrogen 2.723 N/A LYS 652.A N ASN 649.A O no hydrogen 2.653 N/A CYS 654.A N ILE 647.A O no hydrogen 3.036 N/A SER 656.A N TRP 645.A O no hydrogen 3.110 N/A LYS 661.A N PRO 659.A O no hydrogen 2.679 N/A LEU 663.A N PRO 660.A O no hydrogen 3.026 N/A TYR 665.A N ILE 623.A O no hydrogen 2.777 N/A TYR 665.A OH ASP 322.A OD1 no hydrogen 2.703 N/A ILE 666.A N ILE 623.A O no hydrogen 2.974 N/A TYR 667.A N ILE 458.A O no hydrogen 2.777 N/A TYR 667.A OH LYS 661.A O no hydrogen 2.535 N/A PHE 668.A N ALA 621.A O no hydrogen 2.677 N/A TYR 669.A N LEU 456.A O no hydrogen 2.844 N/A TYR 669.A OH PRO 481.A O no hydrogen 2.623 N/A GLN 670.A N GLN 618.A O no hydrogen 2.833 N/A GLN 670.A NE2 TYR 455.A OH no hydrogen 2.773 N/A ARG 671.A N ASP 454.A O no hydrogen 2.811 N/A ARG 671.A NE ASP 454.A OD1 no hydrogen 3.092 N/A ARG 671.A NH1 PHE 452.A O no hydrogen 2.778 N/A ARG 671.A NH1 ASP 454.A OD1 no hydrogen 2.972 N/A ARG 671.A NH2 PHE 452.A O no hydrogen 3.151 N/A ARG 671.A NH2 PRO 614.A O no hydrogen 2.686 N/A VAL 672.A N LYS 616.A O no hydrogen 3.057 N/A