Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f5f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N ASP 55.A OD1 no hydrogen 2.760 N/A GLY 5.A N ASN 272.A OD1 no hydrogen 3.355 N/A LEU 7.A N LYS 34.A O no hydrogen 2.964 N/A VAL 8.A N ASP 58.A OD1 no hydrogen 2.654 N/A ILE 9.A N THR 36.A O no hydrogen 2.796 N/A TRP 10.A N ILE 59.A O no hydrogen 2.975 N/A ILE 11.A N GLU 38.A O no hydrogen 3.026 N/A ASN 12.A ND2 ASP 14.A OD1 no hydrogen 2.997 N/A ASN 12.A ND2 ASP 14.A OD2 no hydrogen 3.109 N/A LYS 15.A N ASN 12.A O no hydrogen 3.203 N/A LYS 15.A NZ ASP 14.A OD1 no hydrogen 3.175 N/A TYR 17.A N LYS 15.A O no hydrogen 3.022 N/A GLY 19.A N ASP 296.A OD2 no hydrogen 2.792 N/A LEU 20.A N GLY 16.A O no hydrogen 3.176 N/A ALA 21.A N TYR 17.A O no hydrogen 2.961 N/A GLU 22.A N ASN 18.A O no hydrogen 3.271 N/A VAL 23.A N GLY 19.A O no hydrogen 3.366 N/A GLY 24.A N LEU 20.A O no hydrogen 3.053 N/A LYS 25.A N ALA 21.A O no hydrogen 2.776 N/A LYS 26.A N GLU 22.A O no hydrogen 3.018 N/A LYS 26.A NZ ASP 30.A OD2 no hydrogen 2.558 N/A PHE 27.A N VAL 23.A O no hydrogen 3.070 N/A GLU 28.A N GLY 24.A O no hydrogen 2.879 N/A LYS 29.A N LYS 25.A O no hydrogen 2.998 N/A THR 31.A N PHE 27.A O no hydrogen 3.103 N/A THR 31.A OG1 PHE 27.A O no hydrogen 2.555 N/A GLY 32.A N GLU 28.A O no hydrogen 2.646 N/A ILE 33.A N THR 31.A OG1 no hydrogen 3.402 N/A LYS 34.A NZ VAL 35.A O no hydrogen 3.408 N/A THR 36.A N LEU 7.A O no hydrogen 2.772 N/A GLU 38.A N ILE 9.A O no hydrogen 2.767 N/A GLU 44.A N GLU 44.A OE1 no hydrogen 2.698 N/A GLU 45.A N LYS 42.A O no hydrogen 3.027 N/A LYS 46.A N LYS 42.A O no hydrogen 2.758 N/A PHE 47.A N LEU 43.A O no hydrogen 3.103 N/A GLN 49.A N LYS 46.A O no hydrogen 3.038 N/A VAL 50.A N LYS 46.A O no hydrogen 2.986 N/A ALA 51.A N PHE 47.A O no hydrogen 2.699 N/A ALA 52.A N GLN 49.A O no hydrogen 2.724 N/A THR 53.A OG1 VAL 50.A O no hydrogen 3.345 N/A GLY 54.A N ALA 51.A O no hydrogen 3.001 N/A ASP 58.A N VAL 8.A O no hydrogen 2.638 N/A ILE 59.A N VAL 8.A O no hydrogen 3.205 N/A ILE 60.A N GLY 265.A O no hydrogen 2.843 N/A PHE 61.A N TRP 10.A O no hydrogen 2.850 N/A TRP 62.A N SER 263.A O no hydrogen 2.898 N/A HIS 64.A N VAL 261.A O no hydrogen 2.813 N/A HIS 64.A NE2 MET 330.A O no hydrogen 2.539 N/A ARG 66.A NH1 SER 337.A OG no hydrogen 2.969 N/A PHE 67.A N HIS 64.A O no hydrogen 3.126 N/A TYR 70.A N ARG 66.A O no hydrogen 3.323 N/A TYR 70.A OH GLU 44.A O no hydrogen 2.687 N/A ALA 71.A N PHE 67.A O no hydrogen 2.879 N/A GLN 72.A N GLY 68.A O no hydrogen 2.879 N/A SER 73.A N GLY 69.A O no hydrogen 2.992 N/A SER 73.A N TYR 70.A O no hydrogen 3.300 N/A SER 73.A OG GLY 69.A O no hydrogen 3.214 N/A GLY 74.A N ALA 71.A O no hydrogen 2.663 N/A LEU 75.A N TYR 70.A O no hydrogen 2.952 N/A ALA 77.A N ILE 266.A O no hydrogen 3.068 N/A ILE 79.A N LEU 103.A O no hydrogen 2.987 N/A PHE 85.A N ASP 82.A O no hydrogen 2.697 N/A PHE 85.A N ASP 82.A OD1 no hydrogen 3.024 N/A GLN 86.A N ASP 82.A O no hydrogen 3.015 N/A GLN 86.A NE2 PRO 81.A O no hydrogen 2.643 N/A ASP 87.A N LYS 83.A O no hydrogen 2.993 N/A LYS 88.A N PHE 85.A O no hydrogen 2.978 N/A LEU 89.A N GLN 86.A O no hydrogen 3.333 N/A TYR 90.A N ALA 303.A O no hydrogen 2.994 N/A THR 93.A N TYR 90.A O no hydrogen 3.028 N/A THR 93.A OG1 TYR 90.A O no hydrogen 2.607 N/A TRP 94.A N PRO 91.A O no hydrogen 3.226 N/A TRP 94.A NE1 GLN 86.A O no hydrogen 2.853 N/A VAL 97.A N TRP 94.A O no hydrogen 3.267 N/A ARG 98.A N ASP 95.A O no hydrogen 3.103 N/A ARG 98.A NH1 ASP 95.A OD1 no hydrogen 2.718 N/A TYR 99.A N LYS 102.A O no hydrogen 2.957 N/A LYS 102.A N TYR 99.A O no hydrogen 3.142 N/A ILE 104.A N VAL 97.A O no hydrogen 2.905 N/A TYR 106.A N ALA 264.A O no hydrogen 2.917 N/A TYR 106.A OH GLU 281.A OE2 no hydrogen 2.941 N/A ILE 108.A N LEU 262.A O no hydrogen 2.695 N/A ALA 109.A N LEU 262.A O no hydrogen 3.457 N/A VAL 110.A N ALA 301.A O no hydrogen 2.783 N/A GLU 111.A N GLY 260.A O no hydrogen 2.740 N/A SER 114.A N ASN 227.A O no hydrogen 3.148 N/A LEU 115.A N THR 245.A O no hydrogen 2.984 N/A ILE 116.A N THR 225.A O no hydrogen 2.801 N/A TYR 117.A N GLY 243.A O no hydrogen 3.193 N/A ASN 118.A N ALA 223.A O no hydrogen 2.671 N/A LYS 119.A N ASN 241.A O no hydrogen 2.813 N/A ASP 120.A N ASN 118.A OD1 no hydrogen 3.119 N/A LEU 121.A N ASN 118.A OD1 no hydrogen 3.376 N/A LEU 122.A N ASN 118.A O no hydrogen 2.609 N/A LYS 127.A N GLU 131.A OE2 no hydrogen 2.943 N/A THR 128.A OG1 GLU 131.A OE1 no hydrogen 2.975 N/A TRP 129.A N THR 249.A O no hydrogen 2.689 N/A TRP 129.A NE1 SER 255.A OG no hydrogen 3.348 N/A GLU 130.A N GLU 130.A OE1 no hydrogen 2.477 N/A ILE 132.A N TRP 129.A O no hydrogen 2.853 N/A LEU 135.A N GLU 131.A O no hydrogen 3.446 N/A ASP 136.A N ILE 132.A O no hydrogen 3.074 N/A LYS 137.A N PRO 133.A O no hydrogen 3.201 N/A GLU 138.A N ALA 134.A O no hydrogen 3.238 N/A LEU 139.A N LEU 135.A O no hydrogen 2.850 N/A LYS 140.A N ASP 136.A O no hydrogen 2.667 N/A LYS 140.A NZ ASP 136.A OD2 no hydrogen 3.394 N/A ALA 141.A N LYS 137.A O no hydrogen 3.307 N/A LYS 142.A N LEU 139.A O no hydrogen 3.275 N/A GLY 143.A N LYS 140.A O no hydrogen 2.938 N/A LYS 144.A N LEU 139.A O no hydrogen 2.746 N/A LYS 144.A NZ GLY 220.A O no hydrogen 2.838 N/A SER 145.A N GLU 221.A O no hydrogen 3.160 N/A ALA 146.A N ASP 136.A OD1 no hydrogen 2.757 N/A MET 148.A N MET 224.A O no hydrogen 3.271 N/A LEU 151.A N THR 208.A O no hydrogen 3.015 N/A GLN 152.A N ASN 150.A OD1 no hydrogen 2.757 N/A GLN 152.A NE2 ALA 206.A O no hydrogen 3.085 N/A GLN 152.A NE2 THR 208.A O no hydrogen 3.046 N/A PHE 156.A N GLU 153.A O no hydrogen 3.122 N/A TRP 158.A N PRO 154.A O no hydrogen 2.797 N/A LEU 160.A N THR 157.A O no hydrogen 3.069 N/A ILE 161.A N THR 157.A O no hydrogen 3.374 N/A ALA 162.A N TRP 158.A O no hydrogen 2.873 N/A ALA 163.A N PRO 159.A O no hydrogen 3.162 N/A GLY 165.A N ALA 162.A O no hydrogen 3.050 N/A TYR 167.A N GLY 182.A O no hydrogen 2.909 N/A TYR 167.A OH ASP 180.A OD1 no hydrogen 2.411 N/A PHE 169.A N ASP 180.A O no hydrogen 3.104 N/A ASP 177.A N ILE 653.A O no hydrogen 3.116 N/A LYS 179.A N TYR 650.A O no hydrogen 3.260 N/A LYS 179.A NZ ASP 177.A OD1 no hydrogen 3.273 N/A LYS 179.A NZ ILE 178.A O no hydrogen 3.497 N/A GLY 182.A N TYR 167.A O no hydrogen 2.959 N/A VAL 183.A N GLN 365.A OE1 no hydrogen 2.954 N/A ASN 185.A ND2 GLY 165.A O no hydrogen 3.019 N/A ALA 188.A N ASN 185.A OD1 no hydrogen 2.976 N/A LYS 189.A N ASN 185.A O no hydrogen 3.172 N/A LYS 189.A NZ ASP 358.A OD1 no hydrogen 3.478 N/A ALA 190.A N ALA 186.A O no hydrogen 2.762 N/A GLY 191.A N GLY 187.A O no hydrogen 2.915 N/A LEU 192.A N ALA 188.A O no hydrogen 2.967 N/A THR 193.A N LYS 189.A O no hydrogen 2.784 N/A THR 193.A OG1 LYS 189.A O no hydrogen 2.670 N/A PHE 194.A N ALA 190.A O no hydrogen 3.260 N/A LEU 195.A N GLY 191.A O no hydrogen 3.271 N/A VAL 196.A N LEU 192.A O no hydrogen 2.832 N/A ASP 197.A N THR 193.A O no hydrogen 2.835 N/A LEU 198.A N PHE 194.A O no hydrogen 3.086 N/A ILE 199.A N LEU 195.A O no hydrogen 3.298 N/A ILE 199.A N VAL 196.A O no hydrogen 3.026 N/A LYS 200.A N VAL 196.A O no hydrogen 2.898 N/A ASN 201.A N ASP 197.A O no hydrogen 2.821 N/A LYS 202.A N ILE 199.A O no hydrogen 3.050 N/A HIS 203.A N LEU 198.A O no hydrogen 2.739 N/A HIS 203.A ND1 ASP 136.A OD2 no hydrogen 3.191 N/A MET 204.A N LEU 198.A O no hydrogen 2.981 N/A THR 208.A N ASN 205.A O no hydrogen 2.949 N/A THR 208.A OG1 ASN 205.A O no hydrogen 2.898 N/A ILE 212.A N ASP 209.A OD1 no hydrogen 3.080 N/A ALA 213.A N ASP 209.A O no hydrogen 3.170 N/A GLU 214.A N TYR 210.A O no hydrogen 3.013 N/A ALA 215.A N SER 211.A O no hydrogen 2.805 N/A ALA 216.A N ILE 212.A O no hydrogen 2.924 N/A PHE 217.A N ALA 213.A O no hydrogen 3.001 N/A ASN 218.A N GLU 214.A O no hydrogen 2.843 N/A LYS 219.A N ALA 216.A O no hydrogen 3.199 N/A GLY 220.A N PHE 217.A O no hydrogen 2.819 N/A GLU 221.A N ALA 216.A O no hydrogen 2.860 N/A THR 222.A OG1 SER 145.A O no hydrogen 3.301 N/A ALA 223.A N SER 145.A O no hydrogen 2.838 N/A MET 224.A N ALA 146.A O no hydrogen 2.746 N/A THR 225.A OG1 MET 148.A O no hydrogen 2.692 N/A ASN 227.A N SER 114.A O no hydrogen 3.370 N/A GLY 228.A N ASN 227.A OD1 no hydrogen 2.795 N/A ALA 231.A N GLY 228.A O no hydrogen 3.025 N/A TRP 232.A N PRO 229.A O no hydrogen 2.975 N/A SER 233.A OG ASP 296.A O no hydrogen 2.965 N/A ASN 234.A ND2 GLU 214.A OE2 no hydrogen 2.840 N/A ILE 235.A N ALA 231.A O no hydrogen 3.406 N/A ASP 236.A N TRP 232.A O no hydrogen 2.961 N/A THR 237.A OG1 SER 233.A O no hydrogen 3.352 N/A SER 238.A N ILE 235.A O no hydrogen 3.173 N/A SER 238.A OG ILE 235.A O no hydrogen 2.752 N/A LYS 239.A N ASP 236.A O no hydrogen 3.448 N/A TYR 242.A OH ASP 236.A OD2 no hydrogen 2.565 N/A GLY 243.A N TYR 117.A O no hydrogen 3.105 N/A THR 245.A N LEU 115.A O no hydrogen 2.913 N/A LEU 247.A N ASN 323.A OD1 no hydrogen 2.737 N/A THR 249.A N LYS 127.A O no hydrogen 2.714 N/A THR 249.A OG1 LYS 127.A O no hydrogen 3.473 N/A PHE 250.A N GLN 253.A O no hydrogen 2.691 N/A LYS 251.A N GLU 130.A OE2 no hydrogen 2.715 N/A GLN 253.A N PHE 250.A O no hydrogen 2.913 N/A GLN 253.A NE2 ASP 164.A OD1 no hydrogen 2.620 N/A GLN 253.A NE2 LYS 251.A O no hydrogen 3.652 N/A SER 255.A OG PRO 248.A O no hydrogen 2.530 N/A LYS 256.A N PRO 159.A O no hydrogen 3.224 N/A VAL 259.A N GLU 328.A O no hydrogen 2.609 N/A GLY 260.A N GLU 111.A O no hydrogen 3.176 N/A VAL 261.A N HIS 64.A ND1 no hydrogen 2.997 N/A LEU 262.A N ALA 109.A O no hydrogen 2.796 N/A SER 263.A N TRP 62.A O no hydrogen 2.741 N/A SER 263.A OG VAL 261.A O no hydrogen 2.737 N/A ALA 264.A N TYR 106.A O no hydrogen 2.868 N/A GLY 265.A N ILE 60.A O no hydrogen 2.824 N/A ASN 267.A N ASP 58.A O no hydrogen 2.606 N/A ASN 267.A ND2 ASP 55.A O no hydrogen 3.006 N/A ASN 267.A ND2 PRO 57.A O no hydrogen 2.867 N/A ALA 268.A N LEU 75.A O no hydrogen 2.850 N/A ALA 269.A N ASN 267.A OD1 no hydrogen 2.857 N/A SER 270.A N ASN 267.A O no hydrogen 2.783 N/A SER 270.A OG ASP 58.A OD2 no hydrogen 2.746 N/A ASN 272.A N SER 270.A OG no hydrogen 3.115 N/A ASN 272.A ND2 GLU 3.A O no hydrogen 3.089 N/A ASN 272.A ND2 ASP 58.A OD2 no hydrogen 3.349 N/A LYS 273.A NZ ALA 268.A O no hydrogen 2.914 N/A LYS 273.A NZ SER 270.A O no hydrogen 3.017 N/A ALA 276.A N ASN 272.A O no hydrogen 2.956 N/A LYS 277.A N LYS 273.A O no hydrogen 3.163 N/A LYS 277.A NZ THR 80.A O no hydrogen 2.900 N/A GLU 278.A N GLU 274.A O no hydrogen 2.832 N/A PHE 279.A N LEU 275.A O no hydrogen 2.947 N/A LEU 280.A N ALA 276.A O no hydrogen 3.115 N/A GLU 281.A N LYS 277.A O no hydrogen 2.962 N/A ASN 282.A N GLU 278.A O no hydrogen 2.952 N/A TYR 283.A N PHE 279.A O no hydrogen 2.919 N/A TYR 283.A OH ASP 30.A OD2 no hydrogen 2.885 N/A LEU 284.A N PHE 279.A O no hydrogen 2.838 N/A LEU 285.A N LEU 280.A O no hydrogen 2.930 N/A THR 286.A N LEU 284.A O no hydrogen 2.866 N/A THR 286.A OG1 TYR 283.A O no hydrogen 3.009 N/A THR 286.A OG1 GLU 288.A OE1 no hydrogen 3.127 N/A GLY 289.A N THR 286.A OG1 no hydrogen 2.943 N/A LEU 290.A N THR 286.A O no hydrogen 3.026 N/A GLU 291.A N ASP 287.A O no hydrogen 3.148 N/A ALA 292.A N GLU 288.A O no hydrogen 3.238 N/A VAL 293.A N GLY 289.A O no hydrogen 3.298 N/A ASN 294.A N LEU 290.A O no hydrogen 2.608 N/A LYS 295.A N GLU 291.A O no hydrogen 2.907 N/A LYS 295.A NZ GLU 291.A OE1 no hydrogen 3.399 N/A ASP 296.A N VAL 293.A O no hydrogen 2.843 N/A LYS 297.A N VAL 293.A O no hydrogen 3.252 N/A LEU 299.A N ASN 294.A OD1 no hydrogen 2.731 N/A ALA 301.A N VAL 110.A O no hydrogen 3.180 N/A ALA 303.A N ILE 108.A O no hydrogen 2.720 N/A LYS 305.A N LYS 88.A O no hydrogen 2.997 N/A LYS 305.A NZ ASP 87.A O no hydrogen 2.707 N/A SER 306.A OG ASP 287.A OD1 no hydrogen 2.657 N/A TYR 307.A N LEU 304.A O no hydrogen 3.113 N/A GLU 308.A N LEU 304.A O no hydrogen 2.918 N/A GLU 308.A N LYS 305.A O no hydrogen 3.141 N/A GLU 309.A N LYS 305.A O no hydrogen 3.197 N/A LEU 311.A N TYR 307.A O no hydrogen 3.310 N/A ALA 312.A N GLU 308.A O no hydrogen 2.666 N/A LYS 313.A N GLU 310.A O no hydrogen 3.066 N/A ASP 314.A N LEU 311.A O no hydrogen 2.931 N/A ARG 316.A N ASP 314.A OD1 no hydrogen 2.700 N/A ARG 316.A NE ASP 314.A OD1 no hydrogen 3.192 N/A ARG 316.A NE ASP 314.A OD2 no hydrogen 3.043 N/A ARG 316.A NH1 TYR 242.A OH no hydrogen 2.868 N/A ARG 316.A NH2 ASP 314.A OD2 no hydrogen 2.701 N/A ALA 318.A N ASP 314.A O no hydrogen 2.986 N/A ALA 319.A N PRO 315.A O no hydrogen 2.798 N/A THR 320.A N ARG 316.A O no hydrogen 2.927 N/A THR 320.A OG1 ARG 316.A O no hydrogen 2.904 N/A MET 321.A N ILE 317.A O no hydrogen 2.861 N/A GLU 322.A N ALA 318.A O no hydrogen 2.852 N/A ASN 323.A N ALA 319.A O no hydrogen 2.968 N/A ASN 323.A ND2 SER 114.A OG no hydrogen 2.701 N/A ASN 323.A ND2 THR 245.A O no hydrogen 3.230 N/A ALA 324.A N THR 320.A O no hydrogen 2.682 N/A GLN 325.A N MET 321.A O no hydrogen 2.791 N/A LYS 326.A N GLU 322.A O no hydrogen 3.077 N/A GLY 327.A N ASN 323.A O no hydrogen 3.161 N/A GLY 327.A N ALA 324.A O no hydrogen 3.064 N/A MET 330.A N VAL 259.A O no hydrogen 2.794 N/A ASN 332.A ND2 ARG 98.A O no hydrogen 3.137 N/A MET 336.A N ILE 333.A O no hydrogen 2.973 N/A SER 337.A N PRO 334.A O no hydrogen 3.253 N/A PHE 339.A N GLN 335.A O no hydrogen 3.090 N/A TRP 340.A N MET 336.A O no hydrogen 3.044 N/A TRP 340.A NE1 ASP 65.A OD2 no hydrogen 2.919 N/A TYR 341.A N SER 337.A O no hydrogen 3.240 N/A ALA 342.A N ALA 338.A O no hydrogen 2.981 N/A VAL 343.A N PHE 339.A O no hydrogen 3.023 N/A ARG 344.A N.A TRP 340.A O no hydrogen 2.778 N/A ARG 344.A N.B TRP 340.A O no hydrogen 2.798 N/A ARG 344.A NH2.A GLU 153.A OE1 no hydrogen 3.296 N/A THR 345.A N TYR 341.A O no hydrogen 3.008 N/A THR 345.A OG1 TYR 341.A O no hydrogen 3.112 N/A ALA 346.A N ALA 342.A O no hydrogen 3.095 N/A VAL 347.A N VAL 343.A O no hydrogen 3.139 N/A ILE 348.A N ARG 344.A O.A no hydrogen 3.308 N/A ILE 348.A N ARG 344.A O.B no hydrogen 3.125 N/A ASN 349.A N THR 345.A O no hydrogen 3.000 N/A ASN 349.A ND2 THR 345.A O no hydrogen 2.782 N/A ALA 350.A N ALA 346.A O no hydrogen 2.805 N/A ALA 351.A N VAL 347.A O no hydrogen 2.740 N/A SER 352.A N ILE 348.A O no hydrogen 3.069 N/A SER 352.A OG ILE 348.A O no hydrogen 3.463 N/A SER 352.A OG ASN 349.A O no hydrogen 3.430 N/A GLY 353.A N ALA 350.A O no hydrogen 3.169 N/A ARG 354.A NH1 ASN 349.A OD1 no hydrogen 2.863 N/A ARG 354.A NH1 ASN 402.A OD1 no hydrogen 3.308 N/A ARG 354.A NH2 ASN 402.A OD1 no hydrogen 2.524 N/A GLN 355.A N ASN 349.A O no hydrogen 3.104 N/A GLN 355.A NE2 GLU 567.A OE2 no hydrogen 2.621 N/A ALA 359.A N THR 356.A OG1 no hydrogen 3.238 N/A ALA 360.A N THR 356.A O no hydrogen 2.829 N/A LEU 361.A N VAL 357.A O no hydrogen 2.945 N/A ALA 362.A N ASP 358.A O no hydrogen 2.863 N/A ALA 363.A N ALA 359.A O no hydrogen 3.110 N/A ALA 364.A N ALA 360.A O no hydrogen 3.080 N/A GLN 365.A N LEU 361.A O no hydrogen 2.911 N/A GLN 365.A NE2 VAL 181.A O no hydrogen 3.332 N/A GLN 365.A NE2 GLN 646.A OE1 no hydrogen 3.005 N/A THR 366.A N ALA 362.A O no hydrogen 3.302 N/A THR 366.A OG1 ALA 362.A O no hydrogen 3.417 N/A THR 366.A OG1 ALA 568.A O no hydrogen 2.831 N/A ASN 367.A N ALA 363.A O no hydrogen 2.736 N/A ASN 367.A ND2 GLU 372.A OE2 no hydrogen 2.861 N/A ALA 368.A N ALA 364.A O no hydrogen 2.821 N/A ALA 369.A N THR 366.A O no hydrogen 3.129 N/A ILE 378.A N GLY 439.A O no hydrogen 2.707 N/A ILE 379.A N ILE 460.A O no hydrogen 2.674 N/A TYR 380.A N TYR 441.A O no hydrogen 2.693 N/A ASN 381.A ND2 VAL 445.A O no hydrogen 2.843 N/A ASN 381.A ND2 PHE 522.A O no hydrogen 3.463 N/A ARG 382.A N TYR 380.A O no hydrogen 2.855 N/A ARG 382.A NE SER 388.A OG no hydrogen 2.990 N/A ARG 382.A NH1 HIS 442.A ND1 no hydrogen 2.982 N/A ARG 382.A NH2 SER 388.A OG no hydrogen 3.019 N/A THR 386.A OG1 VAL 383.A O no hydrogen 2.618 N/A THR 386.A OG1 VAL 464.A O no hydrogen 3.366 N/A SER 390.A OG SER 587.A O no hydrogen 2.937 N/A PHE 391.A N ALA 387.A O no hydrogen 3.184 N/A THR 392.A N SER 388.A O no hydrogen 2.856 N/A THR 392.A OG1 SER 388.A O no hydrogen 2.768 N/A ASN 393.A N THR 389.A O no hydrogen 3.009 N/A ASN 393.A ND2 LYS 586.A O no hydrogen 3.532 N/A ILE 394.A N SER 390.A O no hydrogen 3.287 N/A ILE 394.A N PHE 391.A O no hydrogen 2.633 N/A ALA 395.A N PHE 391.A O no hydrogen 3.340 N/A TYR 396.A N THR 392.A O no hydrogen 3.194 N/A TYR 396.A OH HIS 442.A NE2 no hydrogen 3.161 N/A ASP 397.A N ASN 393.A O no hydrogen 2.938 N/A LEU 398.A N ILE 394.A O no hydrogen 3.034 N/A CYS 399.A N ALA 395.A O no hydrogen 2.800 N/A CYS 399.A SG TYR 396.A O no hydrogen 3.306 N/A ASN 402.A N LEU 398.A O no hydrogen 2.940 N/A ASN 402.A ND2 ARG 572.A O no hydrogen 3.563 N/A ASN 402.A ND2 PHE 573.A O no hydrogen 3.329 N/A ASN 402.A ND2 ARG 575.A O no hydrogen 3.225 N/A ARG 403.A N ALA 400.A O no hydrogen 3.419 N/A TYR 404.A N CYS 399.A O no hydrogen 3.081 N/A TYR 404.A OH PHE 573.A O no hydrogen 2.698 N/A HIS 405.A N PRO 438.A O no hydrogen 2.988 N/A LEU 407.A N PHE 440.A O no hydrogen 2.810 N/A ILE 409.A N HIS 442.A O no hydrogen 2.774 N/A THR 411.A OG1 ASN 415.A O no hydrogen 3.010 N/A ASN 414.A N THR 411.A O no hydrogen 2.555 N/A VAL 417.A N ASN 415.A OD1 no hydrogen 3.094 N/A MET 418.A N HIS 526.A NE2 no hydrogen 2.940 N/A GLN 421.A N GLN 421.A OE1 no hydrogen 2.603 N/A ASP 422.A N SER 419.A OG no hydrogen 2.870 N/A GLN 423.A N SER 419.A O no hydrogen 2.897 N/A GLN 423.A NE2 MET 418.A O no hydrogen 3.253 N/A GLN 423.A NE2 SER 419.A O no hydrogen 3.439 N/A VAL 424.A N LEU 420.A O no hydrogen 3.116 N/A ARG 425.A N GLN 421.A O no hydrogen 2.924 N/A PHE 426.A N ASP 422.A O no hydrogen 2.640 N/A VAL 427.A N GLN 423.A O no hydrogen 2.853 N/A LYS 428.A N VAL 424.A O no hydrogen 2.926 N/A ASN 429.A N ARG 425.A O no hydrogen 2.973 N/A VAL 430.A N PHE 426.A O no hydrogen 2.981 N/A THR 431.A N VAL 427.A O no hydrogen 2.982 N/A THR 431.A OG1 VAL 427.A O no hydrogen 3.133 N/A SER 432.A N LYS 428.A O no hydrogen 3.065 N/A SER 432.A OG LYS 428.A O no hydrogen 2.672 N/A TRP 433.A N ASN 429.A O no hydrogen 2.804 N/A LYS 434.A N SER 432.A O no hydrogen 2.522 N/A MET 436.A N TRP 433.A O no hydrogen 2.929 N/A LYS 437.A N LYS 434.A O no hydrogen 3.004 N/A LYS 437.A NZ ASP 375.A OD1 no hydrogen 3.513 N/A LYS 437.A NZ THR 431.A O no hydrogen 2.844 N/A GLY 439.A N VAL 376.A O no hydrogen 3.106 N/A PHE 440.A N HIS 405.A O no hydrogen 2.748 N/A TYR 441.A N ILE 378.A O no hydrogen 2.857 N/A HIS 442.A N LEU 407.A O no hydrogen 3.092 N/A HIS 442.A NE2 TYR 396.A OH no hydrogen 3.161 N/A GLY 443.A N TYR 380.A O no hydrogen 3.352 N/A HIS 444.A ND1.A ASN 414.A O no hydrogen 2.954 N/A VAL 445.A N GLY 443.A O no hydrogen 2.921 N/A SER 446.A N PRO 416.A O no hydrogen 2.974 N/A SER 446.A OG PRO 416.A O no hydrogen 3.210 N/A TYR 447.A N PHE 522.A O no hydrogen 2.697 N/A TYR 447.A OH ASP 449.A OD1 no hydrogen 3.068 N/A LEU 448.A N TYR 461.A OH no hydrogen 3.291 N/A LYS 452.A N ASP 449.A OD2 no hydrogen 3.298 N/A PHE 453.A N PHE 450.A O no hydrogen 3.076 N/A GLY 454.A N ALA 451.A O no hydrogen 3.164 N/A LYS 458.A NZ GLU 549.A OE1 no hydrogen 3.061 N/A ILE 460.A N VAL 377.A O no hydrogen 2.710 N/A TYR 461.A OH LEU 448.A O no hydrogen 2.865 N/A ILE 462.A N ILE 379.A O no hydrogen 3.305 N/A ASN 463.A N LEU 552.A O no hydrogen 3.224 N/A ASN 463.A ND2 ASN 381.A O no hydrogen 2.639 N/A ASN 463.A ND2 ASN 381.A OD1 no hydrogen 3.019 N/A VAL 464.A N ASN 463.A OD1 no hydrogen 2.517 N/A ILE 465.A N GLY 554.A O no hydrogen 2.980 N/A ARG 466.A N GLN 519.A OE1 no hydrogen 2.891 N/A ARG 466.A NE LYS 385.A O no hydrogen 3.108 N/A ARG 466.A NH2 LYS 385.A O no hydrogen 3.511 N/A GLU 470.A N ASP 467.A OD1 no hydrogen 2.819 N/A ARG 471.A N ASP 467.A O no hydrogen 3.008 N/A ARG 471.A NH1 PRO 384.A O no hydrogen 3.157 N/A LEU 472.A N PRO 468.A O no hydrogen 3.282 N/A VAL 473.A N ILE 469.A O no hydrogen 2.840 N/A SER 474.A N GLU 470.A O no hydrogen 2.953 N/A TYR 475.A N ARG 471.A O no hydrogen 2.883 N/A TYR 476.A N LEU 472.A O no hydrogen 2.738 N/A TYR 476.A OH LYS 498.A O no hydrogen 2.786 N/A TYR 477.A N VAL 473.A O no hydrogen 3.144 N/A TYR 477.A OH LYS 596.A O no hydrogen 2.956 N/A PHE 478.A N SER 474.A O no hydrogen 3.026 N/A LEU 479.A N TYR 475.A O no hydrogen 3.337 N/A ARG 480.A N TYR 477.A O no hydrogen 3.231 N/A ARG 480.A NH2 ASP 510.A OD2 no hydrogen 3.022 N/A PHE 481.A N TYR 477.A O no hydrogen 2.866 N/A GLY 482.A N PHE 478.A O no hydrogen 2.808 N/A ASP 484.A N LYS 591.A O no hydrogen 3.016 N/A TYR 485.A N ASP 483.A OD2 no hydrogen 2.881 N/A ARG 486.A N ASP 483.A OD2 no hydrogen 2.906 N/A ARG 491.A N GLN 494.A OE1 no hydrogen 2.843 N/A ARG 491.A NH2 ASP 483.A OD2 no hydrogen 3.425 N/A LYS 493.A N LEU 479.A O no hydrogen 3.083 N/A LYS 493.A NZ ASP 510.A OD2 no hydrogen 2.668 N/A GLN 494.A N ARG 491.A O no hydrogen 2.778 N/A GLY 495.A N ARG 480.A O no hydrogen 3.176 N/A LYS 498.A N ASP 496.A OD1 no hydrogen 2.598 N/A THR 499.A N GLU 502.A OE1 no hydrogen 3.142 N/A PHE 500.A N TYR 477.A OH no hydrogen 2.814 N/A GLU 502.A N THR 499.A OG1 no hydrogen 3.023 N/A CYS 503.A N THR 499.A O no hydrogen 3.024 N/A VAL 504.A N PHE 500.A O no hydrogen 2.919 N/A ALA 505.A N ASP 501.A O no hydrogen 3.114 N/A ALA 506.A N GLU 502.A O no hydrogen 2.989 N/A ALA 506.A N CYS 503.A O no hydrogen 3.238 N/A GLY 507.A N VAL 504.A O no hydrogen 2.801 N/A GLY 508.A N CYS 503.A O no hydrogen 2.866 N/A CYS 511.A SG GLY 508.A O no hydrogen 3.528 N/A ALA 512.A N SER 509.A O no hydrogen 3.135 N/A GLU 514.A N GLU 514.A OE2 no hydrogen 2.847 N/A LYS 515.A N ALA 512.A O no hydrogen 2.967 N/A LEU 516.A N PRO 513.A O no hydrogen 2.817 N/A TRP 517.A NE1 CYS 530.A O no hydrogen 3.181 N/A LEU 518.A N GLU 615.A OE2 no hydrogen 2.847 N/A GLN 519.A NE2 ARG 466.A O no hydrogen 3.050 N/A ILE 520.A N GLU 615.A OE2 no hydrogen 3.100 N/A PHE 522.A N LEU 518.A O no hydrogen 3.124 N/A PHE 523.A N ILE 520.A O no hydrogen 3.178 N/A CYS 524.A N ILE 520.A O no hydrogen 2.887 N/A CYS 524.A SG ALA 538.A O no hydrogen 3.916 N/A GLY 525.A N PRO 521.A O no hydrogen 2.982 N/A HIS 526.A ND1 TYR 447.A O no hydrogen 2.987 N/A CYS 530.A N SER 527.A O no hydrogen 3.006 N/A CYS 530.A SG GLY 525.A O no hydrogen 3.674 N/A TRP 531.A N SER 528.A O no hydrogen 2.796 N/A TRP 531.A NE1 GLY 525.A O no hydrogen 3.166 N/A ASN 532.A N GLU 529.A O no hydrogen 3.162 N/A ASN 532.A ND2 GLU 529.A OE2 no hydrogen 3.449 N/A SER 535.A N ASN 532.A O no hydrogen 2.958 N/A SER 535.A OG GLU 529.A OE2 no hydrogen 2.851 N/A ALA 538.A N SER 535.A OG no hydrogen 3.274 N/A LEU 539.A N SER 535.A O no hydrogen 3.280 N/A GLU 540.A N ARG 536.A O no hydrogen 3.053 N/A GLN 541.A N TRP 537.A O no hydrogen 2.850 N/A ALA 542.A N ALA 538.A O no hydrogen 2.846 N/A LYS 543.A N LEU 539.A O no hydrogen 3.343 N/A LYS 543.A NZ GLU 617.A OE2 no hydrogen 2.784 N/A TYR 544.A N GLU 540.A O no hydrogen 2.916 N/A ASN 545.A N GLN 541.A O no hydrogen 2.831 N/A ASN 545.A ND2 PHE 523.A O no hydrogen 2.816 N/A LEU 546.A N ALA 542.A O no hydrogen 2.905 N/A ILE 547.A N LYS 543.A O no hydrogen 2.899 N/A ASN 548.A N TYR 544.A O no hydrogen 2.620 N/A GLU 549.A N ASN 545.A O no hydrogen 2.833 N/A TYR 550.A N ASN 545.A O no hydrogen 3.391 N/A TYR 550.A OH ASN 381.A OD1 no hydrogen 2.685 N/A PHE 551.A N TYR 461.A O no hydrogen 2.637 N/A GLY 554.A N ASN 463.A O no hydrogen 2.953 N/A THR 556.A N ILE 465.A O no hydrogen 2.817 N/A THR 556.A OG1 THR 386.A O no hydrogen 2.632 N/A GLU 558.A N VAL 555.A O no hydrogen 2.855 N/A LEU 559.A N THR 556.A O no hydrogen 3.302 N/A PHE 562.A N GLU 558.A O no hydrogen 3.197 N/A ILE 563.A N LEU 559.A O no hydrogen 2.968 N/A MET 564.A N GLU 560.A O no hydrogen 2.908 N/A LEU 565.A N ASP 561.A O no hydrogen 3.176 N/A LEU 566.A N PHE 562.A O no hydrogen 3.032 N/A GLU 567.A N ILE 563.A O no hydrogen 2.865 N/A ALA 568.A N LEU 565.A O no hydrogen 2.976 N/A ALA 569.A N LEU 565.A O no hydrogen 2.967 N/A LEU 570.A N LEU 566.A O no hydrogen 2.825 N/A ARG 572.A NE ASN 402.A O no hydrogen 2.985 N/A ARG 572.A NE ARG 403.A O no hydrogen 3.330 N/A ARG 572.A NH1 GLU 372.A OE1 no hydrogen 2.644 N/A ARG 572.A NH1 GLU 373.A O no hydrogen 3.279 N/A ARG 572.A NH1 ASP 374.A OD1 no hydrogen 3.513 N/A ARG 572.A NH2 ASP 374.A OD1 no hydrogen 2.952 N/A ARG 572.A NH2 ARG 403.A O no hydrogen 2.953 N/A PHE 573.A N LEU 570.A O no hydrogen 3.140 N/A PHE 574.A N LEU 570.A O no hydrogen 3.046 N/A ARG 575.A NH2 ASN 367.A OD1 no hydrogen 2.741 N/A GLY 576.A N GLU 567.A OE2 no hydrogen 2.524 N/A ALA 577.A N PHE 574.A O no hydrogen 2.985 N/A THR 578.A N GLU 567.A OE1 no hydrogen 2.793 N/A THR 578.A OG1 GLU 567.A OE1 no hydrogen 2.602 N/A LEU 580.A N GLY 576.A O no hydrogen 3.153 N/A TYR 581.A N ALA 577.A O no hydrogen 2.886 N/A ARG 582.A N THR 578.A O no hydrogen 2.768 N/A ARG 582.A NH1 GLU 560.A OE2 no hydrogen 2.843 N/A THR 583.A N GLU 579.A O no hydrogen 2.933 N/A THR 583.A OG1 GLU 579.A O no hydrogen 2.954 N/A THR 583.A OG1 GLU 579.A OE1 no hydrogen 3.558 N/A LEU 589.A N SER 390.A OG no hydrogen 2.993 N/A ARG 590.A NE THR 389.A OG1 no hydrogen 2.784 N/A ARG 590.A NH1 ASP 483.A OD1 no hydrogen 2.871 N/A LYS 591.A N ASP 484.A OD1 no hydrogen 3.328 N/A THR 593.A N GLY 482.A O no hydrogen 3.290 N/A THR 593.A OG1 PHE 481.A O no hydrogen 2.494 N/A THR 593.A OG1 GLY 482.A O no hydrogen 3.552 N/A THR 599.A OG1 ASP 501.A OD1 no hydrogen 2.577 N/A THR 602.A OG1 ASP 501.A OD1 no hydrogen 2.900 N/A ILE 603.A N THR 599.A O no hydrogen 2.762 N/A ALA 604.A N ALA 600.A O no hydrogen 3.261 N/A LYS 605.A N ALA 601.A O no hydrogen 3.119 N/A LYS 605.A NZ VAL 504.A O no hydrogen 3.209 N/A LEU 606.A N THR 602.A O no hydrogen 3.277 N/A GLN 607.A N ILE 603.A O no hydrogen 2.859 N/A GLN 608.A N LYS 605.A O no hydrogen 3.206 N/A SER 609.A N LEU 606.A O no hydrogen 3.030 N/A ILE 611.A N SER 609.A OG no hydrogen 3.084 N/A LYS 613.A N SER 609.A O no hydrogen 3.091 N/A LYS 613.A NZ GLU 610.A OE2 no hydrogen 3.005 N/A MET 614.A N GLU 610.A O no hydrogen 3.017 N/A GLU 615.A N ILE 611.A O no hydrogen 3.085 N/A ASN 616.A N TRP 612.A O no hydrogen 2.722 N/A GLU 617.A N LYS 613.A O no hydrogen 2.862 N/A PHE 618.A N MET 614.A O no hydrogen 2.946 N/A TYR 619.A N GLU 615.A O no hydrogen 3.165 N/A GLU 620.A N ASN 616.A O no hydrogen 2.988 N/A PHE 621.A N GLU 617.A O no hydrogen 2.941 N/A ALA 622.A N PHE 618.A O no hydrogen 2.954 N/A LEU 623.A N TYR 619.A O no hydrogen 2.790 N/A GLU 624.A N GLU 620.A O no hydrogen 2.799 N/A GLN 625.A N PHE 621.A O no hydrogen 3.016 N/A PHE 626.A N ALA 622.A O no hydrogen 2.943 N/A GLN 627.A N LEU 623.A O no hydrogen 2.915 N/A PHE 628.A N GLU 624.A O no hydrogen 2.886 N/A VAL 629.A N GLN 625.A O no hydrogen 3.080 N/A ARG 630.A N PHE 626.A O no hydrogen 2.844 N/A ARG 630.A NH1 GLU 558.A OE2 no hydrogen 3.461 N/A ARG 630.A NH1 ASP 561.A OD1 no hydrogen 2.464 N/A ALA 631.A N GLN 627.A O no hydrogen 2.797 N/A HIS 632.A N PHE 628.A O no hydrogen 2.944 N/A ALA 633.A N ARG 630.A O no hydrogen 2.997 N/A VAL 634.A N ARG 630.A O no hydrogen 2.873 N/A ARG 635.A N TYR 642.A O no hydrogen 2.875 N/A LYS 637.A N GLU 640.A O no hydrogen 2.719 N/A GLU 640.A N LYS 637.A O no hydrogen 3.062 N/A TYR 642.A N ARG 635.A O no hydrogen 2.776 N/A ILE 643.A N ASP 358.A OD2 no hydrogen 2.883 N/A LEU 644.A N ALA 633.A O no hydrogen 2.973 N/A GLN 646.A N ASP 184.A OD2 no hydrogen 2.843 N/A GLN 646.A NE2 PHE 648.A O no hydrogen 2.905 N/A TYR 650.A N LYS 179.A O no hydrogen 3.109 N/A ILE 653.A N ASP 177.A O no hydrogen 3.272 N/A