Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vxo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N GLN 41.A O no hydrogen 3.465 N/A GLU 1.A N GLY 42.A O no hydrogen 3.303 N/A VAL 4.A N GLN 25.A O no hydrogen 2.901 N/A VAL 5.A N ALA 45.A O no hydrogen 3.142 N/A ILE 6.A N GLU 27.A O no hydrogen 2.925 N/A LEU 7.A N ILE 47.A O no hydrogen 2.706 N/A ALA 9.A N SER 49.A O no hydrogen 2.852 N/A GLY 12.A N ASP 8.A OD2 no hydrogen 2.391 N/A ILE 15.A N TYR 11.A O no hydrogen 2.833 N/A ASP 16.A N GLY 12.A O no hydrogen 2.803 N/A ARG 17.A N LYS 13.A O no hydrogen 2.920 N/A ARG 18.A N VAL 14.A O no hydrogen 2.973 N/A ARG 18.A NE GLU 21.A OE1 no hydrogen 2.923 N/A ARG 18.A NH1 GLU 152.A O no hydrogen 3.132 N/A ARG 18.A NH2 GLU 21.A OE1 no hydrogen 3.045 N/A ARG 18.A NH2 GLU 21.A OE2 no hydrogen 3.037 N/A VAL 19.A N ILE 15.A O no hydrogen 2.822 N/A ARG 20.A N ASP 16.A O no hydrogen 3.046 N/A ARG 20.A NE GLU 368.A OE2 no hydrogen 3.113 N/A GLU 21.A N ARG 17.A O no hydrogen 2.836 N/A LEU 22.A N ARG 18.A O no hydrogen 3.013 N/A LEU 22.A N VAL 19.A O no hydrogen 3.040 N/A PHE 23.A N ARG 20.A O no hydrogen 2.873 N/A VAL 24.A N VAL 19.A O no hydrogen 3.202 N/A GLU 27.A N VAL 4.A O no hydrogen 3.218 N/A PHE 29.A N ILE 6.A O no hydrogen 2.855 N/A THR 33.A N PRO 30.A O no hydrogen 3.004 N/A THR 33.A OG1 PRO 30.A O no hydrogen 2.664 N/A ALA 35.A N ASP 57.A OD2 no hydrogen 3.034 N/A ILE 38.A N PRO 34.A O no hydrogen 3.354 N/A LYS 39.A N ALA 35.A O no hydrogen 2.750 N/A GLU 40.A N PHE 36.A O no hydrogen 2.763 N/A GLN 41.A N ALA 37.A O no hydrogen 3.289 N/A GLY 42.A N LYS 39.A O no hydrogen 3.139 N/A ARG 44.A N ALA 3.A O no hydrogen 2.663 N/A ARG 44.A NE ALA 171.A O no hydrogen 2.995 N/A ARG 44.A NH2 ALA 171.A O no hydrogen 3.244 N/A ILE 46.A N PRO 66.A O no hydrogen 3.021 N/A ILE 47.A N VAL 5.A O no hydrogen 2.802 N/A ILE 48.A N LEU 68.A O no hydrogen 2.788 N/A SER 49.A N LEU 7.A O no hydrogen 3.004 N/A ALA 59.A N ASP 57.A OD1 no hydrogen 2.877 N/A ILE 60.A N ASP 57.A O no hydrogen 3.013 N/A PHE 61.A N PRO 58.A O no hydrogen 3.203 N/A THR 62.A N ALA 59.A O no hydrogen 2.948 N/A THR 62.A OG1 ALA 59.A O no hydrogen 3.453 N/A ILE 63.A N ALA 59.A O no hydrogen 3.116 N/A VAL 67.A N LYS 143.A O no hydrogen 3.073 N/A LEU 68.A N ILE 46.A O no hydrogen 2.943 N/A GLY 69.A N TYR 145.A O no hydrogen 2.646 N/A ILE 70.A N ILE 48.A O no hydrogen 2.706 N/A CYS 71.A N ALA 147.A O no hydrogen 2.705 N/A CYS 71.A SG THR 112.A OG1 no hydrogen 3.477 N/A CYS 71.A SG GLN 148.A O no hydrogen 2.830 N/A CYS 71.A SG HIS 150.A NE2 no hydrogen 2.942 N/A TYR 72.A N GLY 50.A O no hydrogen 3.355 N/A GLY 73.A N ILE 70.A O no hydrogen 3.274 N/A GLN 75.A N CYS 71.A O no hydrogen 2.986 N/A GLN 75.A NE2 GLN 148.A OE1 no hydrogen 2.949 N/A MET 76.A N TYR 72.A O no hydrogen 2.751 N/A MET 77.A N GLY 73.A O no hydrogen 2.916 N/A ASN 78.A N MET 74.A O no hydrogen 2.950 N/A ASN 78.A ND2 LYS 119.A O no hydrogen 3.425 N/A LYS 79.A N GLN 75.A O no hydrogen 2.844 N/A VAL 80.A N MET 76.A O no hydrogen 2.819 N/A PHE 81.A N MET 77.A O no hydrogen 3.262 N/A PHE 81.A N ASN 78.A O no hydrogen 3.099 N/A GLY 82.A N LYS 79.A O no hydrogen 3.135 N/A THR 84.A N LYS 119.A O no hydrogen 2.987 N/A HIS 86.A ND1 ASP 118.A OD1 no hydrogen 2.704 N/A PHE 89.A N VAL 109.A O no hydrogen 2.887 N/A ASN 90.A ND2 GLU 106.A OE1 no hydrogen 2.618 N/A ILE 91.A N GLU 107.A O no hydrogen 2.673 N/A SER 92.A N ARG 129.A O no hydrogen 2.880 N/A SER 92.A OG ARG 129.A O no hydrogen 3.065 N/A VAL 93.A N LYS 105.A O no hydrogen 2.719 N/A ASP 94.A N VAL 127.A O no hydrogen 2.796 N/A ASN 95.A ND2 LEU 103.A O no hydrogen 3.112 N/A THR 96.A N ASP 94.A OD1 no hydrogen 2.880 N/A THR 96.A OG1 ASP 94.A OD1 no hydrogen 2.684 N/A THR 96.A OG1 ASP 94.A OD2 no hydrogen 3.094 N/A CYS 97.A N ASP 94.A O no hydrogen 3.115 N/A CYS 97.A SG GLU 140.A OE2 no hydrogen 3.720 N/A SER 98.A N GLU 140.A OE2 no hydrogen 2.971 N/A SER 98.A OG GLU 140.A OE1 no hydrogen 2.803 N/A PHE 100.A N CYS 97.A O no hydrogen 2.813 N/A LEU 103.A N PHE 100.A O no hydrogen 3.201 N/A GLU 107.A N ILE 91.A O no hydrogen 2.801 N/A VAL 109.A N PHE 89.A O no hydrogen 2.844 N/A LEU 110.A N THR 156.A OG1 no hydrogen 3.035 N/A SER 116.A OG HIS 86.A NE2 no hydrogen 3.179 N/A ASP 118.A N THR 84.A O no hydrogen 3.022 N/A LYS 119.A N THR 84.A OG1 no hydrogen 3.015 N/A LYS 119.A NZ ASP 122.A OD1 no hydrogen 3.434 N/A ALA 121.A N ASN 78.A OD1 no hydrogen 2.902 N/A PHE 124.A N ALA 121.A O no hydrogen 3.078 N/A LYS 125.A N ALA 138.A O no hydrogen 2.844 N/A VAL 127.A N GLY 136.A O no hydrogen 2.823 N/A ARG 129.A N SER 92.A O no hydrogen 2.773 N/A SER 130.A N ILE 133.A O no hydrogen 2.948 N/A ALA 135.A N ALA 128.A O no hydrogen 2.807 N/A GLY 136.A N ALA 128.A O no hydrogen 3.200 N/A ILE 137.A N GLY 146.A O no hydrogen 2.919 N/A ALA 138.A N LYS 125.A O no hydrogen 2.852 N/A ASN 139.A N LEU 144.A O no hydrogen 2.964 N/A SER 141.A OG ASN 139.A OD1 no hydrogen 2.961 N/A LYS 142.A N ASN 139.A OD1 no hydrogen 3.348 N/A LYS 143.A N GLU 140.A O no hydrogen 2.966 N/A LYS 143.A NZ ILE 170.A O no hydrogen 3.209 N/A LEU 144.A N ASN 139.A O no hydrogen 3.065 N/A TYR 145.A N VAL 67.A O no hydrogen 2.824 N/A TYR 145.A OH GLU 140.A OE1 no hydrogen 2.750 N/A GLY 146.A N ILE 137.A O no hydrogen 2.868 N/A ALA 147.A N GLY 69.A O no hydrogen 2.729 N/A GLN 148.A N ALA 135.A O no hydrogen 2.839 N/A HIS 150.A N LEU 110.A O no hydrogen 3.265 N/A HIS 150.A ND1 GLU 152.A OE2 no hydrogen 2.658 N/A GLU 152.A N GLU 152.A OE1 no hydrogen 2.770 N/A THR 156.A OG1 HIS 150.A O no hydrogen 2.691 N/A ASN 158.A ND2 GLU 107.A OE1 no hydrogen 2.536 N/A GLY 159.A N THR 156.A O no hydrogen 3.113 N/A VAL 161.A N ASN 158.A O no hydrogen 3.108 N/A ILE 162.A N ASN 158.A O no hydrogen 3.318 N/A LEU 163.A N GLY 159.A O no hydrogen 3.018 N/A LYS 164.A N LYS 160.A O no hydrogen 2.996 N/A ASN 165.A N VAL 161.A O no hydrogen 2.859 N/A ASN 165.A ND2 LEU 99.A O no hydrogen 2.884 N/A ASN 165.A ND2 ARG 101.A O no hydrogen 3.050 N/A PHE 166.A N ILE 162.A O no hydrogen 2.967 N/A LEU 167.A N LEU 163.A O no hydrogen 2.849 N/A TYR 168.A N LYS 164.A O no hydrogen 2.871 N/A TYR 168.A OH LEU 22.A O no hydrogen 2.369 N/A ILE 170.A N ASN 165.A O no hydrogen 3.025 N/A ALA 171.A N PHE 166.A O no hydrogen 2.953 N/A GLY 172.A N TYR 168.A O no hydrogen 2.914 N/A CYS 173.A N LEU 167.A O no hydrogen 2.878 N/A CYS 173.A SG LEU 167.A O no hydrogen 3.391 N/A PHE 177.A N PHE 23.A O no hydrogen 2.853 N/A GLN 180.A NE2 GLN 180.A O no hydrogen 2.890 N/A ASN 181.A N THR 178.A OG1 no hydrogen 3.319 N/A ASN 181.A ND2 THR 176.A O no hydrogen 2.816 N/A ARG 182.A N THR 178.A O no hydrogen 2.956 N/A ARG 182.A NH1 GLU 368.A OE2 no hydrogen 2.697 N/A ARG 182.A NH2 ASP 363.A O no hydrogen 2.756 N/A ARG 182.A NH2 GLU 368.A OE1 no hydrogen 3.146 N/A GLU 183.A N VAL 179.A O no hydrogen 2.737 N/A LEU 184.A N GLN 180.A O no hydrogen 3.197 N/A GLU 185.A N ASN 181.A O no hydrogen 2.910 N/A CYS 186.A N ARG 182.A O no hydrogen 2.760 N/A CYS 186.A SG PRO 360.A O no hydrogen 3.646 N/A ILE 187.A N GLU 183.A O no hydrogen 2.833 N/A ARG 188.A N LEU 184.A O no hydrogen 3.151 N/A ARG 188.A NE GLU 185.A OE1 no hydrogen 3.152 N/A ARG 188.A NH2 GLU 185.A OE1 no hydrogen 2.841 N/A GLU 189.A N GLU 185.A O no hydrogen 2.937 N/A ILE 190.A N CYS 186.A O no hydrogen 2.935 N/A LYS 191.A N ILE 187.A O no hydrogen 2.852 N/A GLU 192.A N ARG 188.A O no hydrogen 2.947 N/A ARG 193.A N GLU 189.A O no hydrogen 2.941 N/A ARG 193.A NH1 GLY 355.A O no hydrogen 3.007 N/A VAL 194.A N ILE 190.A O no hydrogen 3.022 N/A GLY 195.A N LYS 191.A O no hydrogen 2.990 N/A SER 197.A N VAL 194.A O no hydrogen 3.068 N/A SER 197.A OG VAL 194.A O no hydrogen 3.445 N/A LYS 198.A N GLU 311.A O no hydrogen 3.008 N/A LYS 198.A NZ GLU 223.A O no hydrogen 3.170 N/A VAL 199.A N GLN 224.A O no hydrogen 2.648 N/A LEU 200.A N PHE 313.A O no hydrogen 2.719 N/A VAL 201.A N ILE 226.A O no hydrogen 2.869 N/A LEU 203.A N VAL 228.A O no hydrogen 2.976 N/A SER 204.A N SER 209.A OG no hydrogen 3.412 N/A GLY 206.A N SER 204.A OG no hydrogen 3.280 N/A THR 210.A N GLY 206.A O no hydrogen 3.213 N/A THR 210.A OG1 GLY 206.A O no hydrogen 2.696 N/A VAL 211.A N VAL 207.A O no hydrogen 3.015 N/A CYS 212.A N ASP 208.A O no hydrogen 2.856 N/A CYS 212.A SG GLN 316.A O no hydrogen 3.348 N/A THR 213.A N SER 209.A O no hydrogen 2.940 N/A THR 213.A OG1 SER 209.A O no hydrogen 2.701 N/A ALA 214.A N THR 210.A O no hydrogen 2.909 N/A LEU 215.A N VAL 211.A O no hydrogen 2.677 N/A LEU 216.A N CYS 212.A O no hydrogen 2.838 N/A ASN 217.A N THR 213.A O no hydrogen 3.013 N/A ARG 218.A N ALA 214.A O no hydrogen 2.939 N/A ARG 218.A NH1 ARG 218.A O no hydrogen 2.716 N/A ALA 219.A N LEU 215.A O no hydrogen 2.930 N/A LEU 220.A N LEU 216.A O no hydrogen 3.008 N/A ASN 221.A N GLN 224.A OE1 no hydrogen 3.136 N/A GLN 222.A NE2 GLY 251.A O no hydrogen 2.810 N/A GLN 224.A N ASN 221.A O no hydrogen 3.196 N/A GLN 224.A NE2 GLY 195.A O no hydrogen 2.849 N/A GLN 224.A NE2 SER 197.A O no hydrogen 2.881 N/A ILE 226.A N VAL 199.A O no hydrogen 2.834 N/A VAL 228.A N VAL 201.A O no hydrogen 2.981 N/A HIS 229.A N LYS 255.A O no hydrogen 2.813 N/A HIS 229.A ND1 LEU 203.A O no hydrogen 2.801 N/A ASP 231.A N ILE 257.A O no hydrogen 2.961 N/A ASN 232.A ND2 GLY 390.A O no hydrogen 2.987 N/A GLY 233.A N ASP 231.A OD1 no hydrogen 3.136 N/A PHE 234.A N ASN 232.A OD1 no hydrogen 2.971 N/A LYS 237.A NZ GLN 540.A OE1 no hydrogen 2.454 N/A SER 240.A OG GLU 244.A OE2 no hydrogen 3.217 N/A SER 242.A N ARG 238.A O no hydrogen 3.207 N/A VAL 243.A N SER 240.A O no hydrogen 3.120 N/A GLU 244.A N SER 240.A O no hydrogen 3.213 N/A GLU 245.A N GLN 241.A O no hydrogen 2.885 N/A ALA 246.A N SER 242.A O no hydrogen 3.128 N/A LEU 247.A N VAL 243.A O no hydrogen 3.024 N/A LYS 248.A N GLU 244.A O no hydrogen 2.815 N/A LYS 249.A N GLU 245.A O no hydrogen 3.006 N/A LEU 250.A N LEU 247.A O no hydrogen 3.129 N/A GLY 251.A N LYS 248.A O no hydrogen 2.801 N/A ILE 252.A N LEU 247.A O no hydrogen 2.897 N/A LYS 255.A N ALA 227.A O no hydrogen 2.818 N/A ILE 257.A N HIS 229.A O no hydrogen 2.814 N/A ALA 259.A N ASP 231.A O no hydrogen 3.200 N/A PHE 263.A N ALA 259.A O no hydrogen 3.232 N/A PHE 263.A N ALA 260.A O no hydrogen 2.964 N/A TYR 264.A N ALA 260.A O no hydrogen 2.838 N/A TYR 264.A OH GLY 233.A O no hydrogen 2.853 N/A ASN 265.A N HIS 261.A O no hydrogen 2.992 N/A ASN 265.A ND2 HIS 261.A O no hydrogen 3.026 N/A GLY 266.A N PHE 263.A O no hydrogen 2.845 N/A THR 267.A OG1 SER 274.A O no hydrogen 3.257 N/A THR 267.A OG1 SER 274.A OG no hydrogen 3.291 N/A THR 268.A N SER 274.A OG no hydrogen 3.041 N/A THR 268.A OG1 ASP 292.A OD2 no hydrogen 2.484 N/A LEU 270.A N ARG 272.A O no hydrogen 2.743 N/A SER 274.A N THR 268.A O no hydrogen 2.808 N/A SER 274.A OG THR 267.A OG1 no hydrogen 3.291 N/A SER 274.A OG THR 268.A O no hydrogen 3.377 N/A SER 274.A OG LYS 275.A O no hydrogen 2.654 N/A THR 276.A OG1 ASN 278.A OD1 no hydrogen 2.754 N/A LEU 277.A N GLY 266.A O no hydrogen 2.903 N/A ASN 278.A N TYR 264.A O no hydrogen 2.942 N/A ASN 278.A ND2 ASN 265.A OD1 no hydrogen 3.477 N/A MET 279.A N THR 276.A O no hydrogen 2.872 N/A THR 280.A N LEU 277.A O no hydrogen 3.197 N/A THR 280.A OG1 THR 276.A O no hydrogen 3.004 N/A GLU 285.A N SER 282.A OG no hydrogen 3.195 N/A LYS 286.A N SER 282.A O no hydrogen 2.808 N/A LYS 286.A NZ ALA 394.A O no hydrogen 2.777 N/A LYS 286.A NZ GLU 643.A OE1 no hydrogen 2.936 N/A ARG 287.A N PRO 283.A O no hydrogen 3.100 N/A ARG 287.A NH1 GLU 643.A O no hydrogen 2.957 N/A ARG 287.A NH2 GLU 643.A O no hydrogen 3.452 N/A ARG 287.A NH2 GLU 643.A OXT no hydrogen 2.848 N/A LYS 288.A N GLU 284.A O no hydrogen 3.149 N/A LYS 288.A NZ THR 269.A O no hydrogen 2.547 N/A LYS 288.A NZ ASP 292.A OD2 no hydrogen 2.794 N/A ILE 289.A N GLU 285.A O no hydrogen 3.038 N/A ILE 290.A N LYS 286.A O no hydrogen 3.059 N/A GLY 291.A N ARG 287.A O no hydrogen 2.722 N/A ASP 292.A N LYS 288.A O no hydrogen 2.662 N/A THR 293.A N ILE 289.A O no hydrogen 2.821 N/A THR 293.A OG1 ILE 289.A O no hydrogen 2.673 N/A PHE 294.A N ILE 290.A O no hydrogen 2.979 N/A VAL 295.A N GLY 291.A O no hydrogen 3.218 N/A LYS 296.A N ASP 292.A O no hydrogen 3.194 N/A LYS 296.A NZ THR 267.A O no hydrogen 3.561 N/A ILE 297.A N THR 293.A O no hydrogen 2.970 N/A ALA 298.A N PHE 294.A O no hydrogen 2.768 N/A ASN 299.A N VAL 295.A O no hydrogen 2.847 N/A GLU 300.A N LYS 296.A O no hydrogen 3.120 N/A VAL 301.A N ILE 297.A O no hydrogen 2.948 N/A ILE 302.A N ALA 298.A O no hydrogen 2.984 N/A GLY 303.A N ASN 299.A O no hydrogen 3.166 N/A GLU 304.A N GLU 300.A O no hydrogen 2.891 N/A MET 305.A N ILE 302.A O no hydrogen 3.229 N/A GLU 311.A N LYS 308.A O no hydrogen 2.806 N/A PHE 313.A N LYS 198.A O no hydrogen 2.802 N/A LEU 314.A N LYS 356.A O no hydrogen 2.728 N/A ALA 315.A N LEU 200.A O no hydrogen 2.791 N/A GLN 316.A N ILE 358.A O no hydrogen 3.040 N/A GLN 316.A NE2 GLU 359.A OE2 no hydrogen 2.973 N/A ASP 322.A N GLU 336.A OE2 no hydrogen 2.814 N/A GLU 325.A N LYS 339.A O no hydrogen 3.197 N/A SER 326.A N GLU 325.A OE1 no hydrogen 3.170 N/A LEU 329.A N SER 326.A O no hydrogen 3.182 N/A LEU 329.A N SER 326.A OG no hydrogen 3.279 N/A VAL 330.A N SER 326.A O no hydrogen 3.237 N/A ALA 331.A N ALA 327.A O no hydrogen 2.896 N/A SER 332.A N LEU 329.A O no hydrogen 3.148 N/A SER 332.A OG SER 328.A O no hydrogen 3.398 N/A GLY 333.A N LEU 329.A O no hydrogen 2.933 N/A GLU 336.A N GLU 325.A OE2 no hydrogen 2.798 N/A LYS 339.A N GLU 336.A O no hydrogen 3.049 N/A LYS 339.A NZ ASP 322.A O no hydrogen 2.840 N/A LYS 339.A NZ GLU 336.A OE1 no hydrogen 3.468 N/A THR 340.A N LEU 337.A O no hydrogen 3.324 N/A ILE 348.A N ASN 299.A OD1 no hydrogen 3.390 N/A ARG 349.A N THR 345.A O no hydrogen 2.972 N/A ARG 349.A NE GLU 346.A OE1 no hydrogen 2.735 N/A ARG 349.A NE GLU 346.A OE2 no hydrogen 3.521 N/A ARG 349.A NH2 GLU 346.A OE1 no hydrogen 2.710 N/A LYS 350.A N GLU 346.A O no hydrogen 2.809 N/A LEU 351.A N LEU 347.A O no hydrogen 2.973 N/A ARG 352.A N ILE 348.A O no hydrogen 2.960 N/A ARG 352.A NH1 ILE 338.A O no hydrogen 2.859 N/A ARG 352.A NH1 THR 340.A O no hydrogen 3.132 N/A GLU 353.A N ARG 349.A O no hydrogen 2.890 N/A GLU 354.A N LYS 350.A O no hydrogen 2.793 N/A GLY 355.A N ARG 352.A O no hydrogen 3.222 N/A LYS 356.A N LEU 351.A O no hydrogen 2.797 N/A LYS 356.A NZ GLU 310.A O no hydrogen 3.217 N/A ILE 358.A N LEU 314.A O no hydrogen 2.755 N/A LYS 362.A N GLU 359.A O no hydrogen 3.120 N/A LYS 362.A NZ ASP 363.A OD1 no hydrogen 3.386 N/A PHE 364.A N LEU 361.A O no hydrogen 3.008 N/A HIS 365.A N GLU 368.A OE1 no hydrogen 2.844 N/A VAL 369.A N HIS 365.A O no hydrogen 3.089 N/A ILE 371.A N ASP 367.A O no hydrogen 3.371 N/A LEU 372.A N GLU 368.A O no hydrogen 2.810 N/A GLY 373.A N VAL 369.A O no hydrogen 2.877 N/A ARG 374.A N ARG 370.A O no hydrogen 3.015 N/A GLU 375.A N ILE 371.A O no hydrogen 2.972 N/A LEU 376.A N LEU 372.A O no hydrogen 2.889 N/A GLY 377.A N ARG 374.A O no hydrogen 2.966 N/A LEU 378.A N GLY 373.A O no hydrogen 2.874 N/A VAL 383.A N PRO 379.A O no hydrogen 3.128 N/A SER 384.A N GLU 380.A O no hydrogen 3.108 N/A SER 384.A OG GLU 380.A O no hydrogen 2.658 N/A SER 384.A OG GLU 380.A OE2 no hydrogen 2.784 N/A ARG 385.A NH2 SER 242.A OG no hydrogen 3.260 N/A HIS 386.A NE2 ALA 555.A O no hydrogen 2.674 N/A GLY 392.A N PRO 389.A O no hydrogen 2.736 N/A LEU 393.A N PHE 234.A O no hydrogen 2.909 N/A ALA 394.A N PRO 391.A O no hydrogen 3.152 N/A ILE 395.A N GLY 392.A O no hydrogen 3.396 N/A ARG 396.A N LEU 393.A O no hydrogen 2.904 N/A ARG 396.A NE GLU 641.A OE2 no hydrogen 2.811 N/A ARG 396.A NH2 GLU 641.A OE1 no hydrogen 2.665 N/A ARG 396.A NH2 GLU 641.A OE2 no hydrogen 3.550 N/A ILE 398.A N LEU 565.A O no hydrogen 2.938 N/A CYS 399.A SG VAL 397.A O no hydrogen 3.642 N/A ALA 400.A N THR 528.A O no hydrogen 3.014 N/A TYR 404.A N PRO 463.A O no hydrogen 2.811 N/A CYS 406.A N TYR 478.A OH no hydrogen 2.843 N/A PHE 409.A N CYS 406.A O no hydrogen 3.008 N/A THR 412.A N ASP 408.A O no hydrogen 3.008 N/A THR 412.A OG1 ASP 408.A O no hydrogen 2.777 N/A ASN 413.A N PHE 409.A O no hydrogen 3.070 N/A ASN 414.A N PRO 410.A O no hydrogen 3.026 N/A ILE 415.A N GLU 411.A O no hydrogen 2.860 N/A LEU 416.A N THR 412.A O no hydrogen 2.930 N/A LYS 417.A N ASN 413.A O no hydrogen 2.942 N/A ILE 418.A N ASN 414.A O no hydrogen 3.256 N/A VAL 419.A N ILE 415.A O no hydrogen 3.105 N/A ALA 420.A N LEU 416.A O no hydrogen 2.952 N/A ASP 421.A N LYS 417.A O no hydrogen 3.101 N/A SER 423.A N THR 452.A OG1 no hydrogen 2.990 N/A SER 425.A N ASP 421.A O no hydrogen 2.847 N/A VAL 426.A N PHE 422.A O no hydrogen 2.951 N/A LYS 427.A N ALA 424.A O no hydrogen 3.014 N/A LYS 428.A N SER 425.A O no hydrogen 3.254 N/A GLN 434.A N HIS 430.A O no hydrogen 3.297 N/A ARG 435.A N THR 431.A O no hydrogen 3.152 N/A ARG 435.A NH1 GLU 411.A OE2 no hydrogen 2.922 N/A VAL 436.A N LEU 432.A O no hydrogen 3.037 N/A LYS 437.A N LEU 433.A O no hydrogen 2.859 N/A ALA 438.A N GLN 434.A O no hydrogen 2.871 N/A CYS 439.A N VAL 436.A O no hydrogen 3.185 N/A CYS 439.A SG ARG 435.A O no hydrogen 3.503 N/A THR 440.A OG1 VAL 436.A O no hydrogen 2.862 N/A ASP 444.A N THR 441.A OG1 no hydrogen 2.966 N/A GLN 445.A N THR 441.A O no hydrogen 2.767 N/A GLN 445.A NE2 THR 440.A O no hydrogen 2.788 N/A GLN 445.A NE2 THR 440.A OG1 no hydrogen 3.102 N/A GLU 446.A N GLU 442.A O no hydrogen 2.964 N/A LYS 447.A N GLU 443.A O no hydrogen 2.936 N/A LEU 448.A N ASP 444.A O no hydrogen 2.776 N/A MET 449.A N GLN 445.A O no hydrogen 2.918 N/A GLN 450.A N GLU 446.A O no hydrogen 3.419 N/A ILE 451.A N LYS 447.A O no hydrogen 3.064 N/A THR 452.A N LEU 448.A O no hydrogen 2.981 N/A THR 452.A OG1 LEU 448.A O no hydrogen 2.825 N/A THR 452.A OG1 MET 449.A O no hydrogen 3.545 N/A SER 453.A N GLN 450.A O no hydrogen 2.998 N/A SER 453.A OG MET 449.A O no hydrogen 2.860 N/A SER 453.A OG GLN 450.A O no hydrogen 2.849 N/A LEU 454.A N GLN 450.A O no hydrogen 2.845 N/A LEU 454.A N ILE 451.A O no hydrogen 3.246 N/A HIS 455.A N ILE 451.A O no hydrogen 3.138 N/A ASN 458.A N SER 483.A O no hydrogen 2.918 N/A PHE 460.A N GLY 481.A O no hydrogen 3.120 N/A LEU 461.A N ASN 413.A OD1 no hydrogen 2.713 N/A LEU 462.A N VAL 479.A O no hydrogen 2.783 N/A ILE 464.A N LEU 462.A O no hydrogen 2.772 N/A THR 466.A N SER 477.A O no hydrogen 2.816 N/A THR 466.A OG1 TRP 642.A O no hydrogen 2.943 N/A VAL 467.A N TRP 642.A O no hydrogen 2.858 N/A GLY 468.A N SER 475.A O no hydrogen 2.896 N/A VAL 469.A N PRO 637.A O no hydrogen 2.924 N/A GLN 470.A N CYS 473.A O no hydrogen 2.902 N/A GLN 470.A NE2 ASN 508.A OD1 no hydrogen 2.957 N/A CYS 473.A N GLN 470.A O no hydrogen 3.014 N/A ARG 474.A NH1 GLU 643.A O no hydrogen 3.067 N/A ARG 474.A NH2 GLU 643.A O no hydrogen 3.562 N/A SER 475.A N GLY 468.A O no hydrogen 2.785 N/A TYR 476.A OH GLU 643.A O no hydrogen 3.072 N/A SER 477.A N THR 466.A O no hydrogen 2.971 N/A SER 477.A OG ASN 506.A O no hydrogen 2.553 N/A TYR 478.A OH ASP 408.A OD1 no hydrogen 2.702 N/A CYS 480.A N ARG 509.A O no hydrogen 2.744 N/A CYS 480.A SG PHE 460.A O no hydrogen 3.649 N/A CYS 480.A SG GLY 481.A O no hydrogen 3.727 N/A GLY 481.A N PHE 460.A O no hydrogen 2.830 N/A ILE 482.A N VAL 511.A O no hydrogen 2.799 N/A SER 483.A N ASN 458.A O no hydrogen 3.176 N/A SER 483.A OG ASN 458.A OD1 no hydrogen 3.421 N/A SER 484.A OG ASP 486.A O no hydrogen 2.622 N/A SER 484.A OG TYR 512.A OH no hydrogen 2.862 N/A LYS 485.A N SER 456.A O no hydrogen 3.126 N/A SER 492.A OG ASP 489.A OD2 no hydrogen 2.378 N/A LEU 493.A N ASP 489.A O no hydrogen 3.261 N/A ILE 494.A N TRP 490.A O no hydrogen 2.858 N/A PHE 495.A N GLU 491.A O no hydrogen 3.084 N/A LEU 496.A N SER 492.A O no hydrogen 3.018 N/A ALA 497.A N LEU 493.A O no hydrogen 2.792 N/A ARG 498.A N ILE 494.A O no hydrogen 3.115 N/A ARG 498.A N PHE 495.A O no hydrogen 3.123 N/A ARG 498.A NH2 SER 634.A OG no hydrogen 3.341 N/A LEU 499.A N PHE 495.A O no hydrogen 2.863 N/A ILE 500.A N LEU 496.A O no hydrogen 2.861 N/A ARG 502.A NE ARG 498.A O no hydrogen 3.374 N/A MET 503.A N LEU 499.A O no hydrogen 3.019 N/A CYS 504.A N ILE 500.A O no hydrogen 2.706 N/A HIS 505.A ND1 PRO 501.A O no hydrogen 2.903 N/A ASN 506.A ND2 ASP 408.A OD2 no hydrogen 2.873 N/A ASN 506.A ND2 THR 412.A OG1 no hydrogen 3.020 N/A VAL 507.A N CYS 504.A O no hydrogen 3.018 N/A ASN 508.A N TYR 478.A O no hydrogen 2.987 N/A ASN 508.A ND2 THR 466.A O no hydrogen 3.083 N/A ASN 508.A ND2 SER 475.A O no hydrogen 3.071 N/A ARG 509.A NE THR 466.A OG1 no hydrogen 2.818 N/A ARG 509.A NH1 ASP 631.A OD2 no hydrogen 3.026 N/A ARG 509.A NH1 THR 639.A O no hydrogen 2.876 N/A ARG 509.A NH2 VAL 467.A O no hydrogen 2.856 N/A ARG 509.A NH2 THR 639.A O no hydrogen 3.184 N/A VAL 510.A N THR 633.A OG1 no hydrogen 2.932 N/A VAL 511.A N CYS 480.A O no hydrogen 2.773 N/A TYR 512.A N TYR 630.A O no hydrogen 2.816 N/A TYR 512.A OH SER 484.A OG no hydrogen 2.862 N/A ILE 513.A N ILE 482.A O no hydrogen 2.762 N/A PHE 514.A N ILE 628.A O no hydrogen 3.049 N/A VAL 518.A N SER 483.A OG no hydrogen 3.020 N/A THR 526.A N PRO 567.A O no hydrogen 2.647 N/A THR 526.A OG1 PRO 567.A O no hydrogen 3.489 N/A THR 526.A OG1 SER 580.A OG no hydrogen 2.805 N/A THR 526.A OG1 GLN 582.A O no hydrogen 2.572 N/A THR 528.A N ALA 400.A O no hydrogen 2.882 N/A THR 528.A OG1 THR 526.A O no hydrogen 2.743 N/A THR 531.A N PHE 529.A O no hydrogen 2.766 N/A THR 531.A OG1 PHE 529.A O no hydrogen 3.551 N/A LEU 535.A N THR 531.A O no hydrogen 3.000 N/A SER 536.A N THR 532.A O no hydrogen 3.046 N/A THR 537.A N GLY 533.A O no hydrogen 2.964 N/A THR 537.A OG1 GLY 533.A O no hydrogen 3.444 N/A LEU 538.A N VAL 534.A O no hydrogen 3.074 N/A ARG 539.A N LEU 535.A O no hydrogen 2.910 N/A GLN 540.A N SER 536.A O no hydrogen 3.226 N/A GLN 540.A NE2 GLU 544.A OE2 no hydrogen 3.123 N/A ALA 541.A N THR 537.A O no hydrogen 3.068 N/A ASP 542.A N LEU 538.A O no hydrogen 2.738 N/A PHE 543.A N ARG 539.A O no hydrogen 2.951 N/A GLU 544.A N GLN 540.A O no hydrogen 3.018 N/A ALA 545.A N ALA 541.A O no hydrogen 3.059 N/A HIS 546.A N ASP 542.A O no hydrogen 3.074 N/A HIS 546.A ND1 ASP 542.A O no hydrogen 2.875 N/A ASN 547.A N PHE 543.A O no hydrogen 2.895 N/A ILE 548.A N GLU 544.A O no hydrogen 2.902 N/A LEU 549.A N ALA 545.A O no hydrogen 2.901 N/A ARG 550.A N HIS 546.A O no hydrogen 2.887 N/A ARG 550.A NH1 GLU 381.A O no hydrogen 3.433 N/A GLU 551.A N ASN 547.A O no hydrogen 2.741 N/A SER 552.A N ILE 548.A O no hydrogen 3.147 N/A SER 552.A N LEU 549.A O no hydrogen 3.219 N/A SER 552.A OG LEU 549.A O no hydrogen 2.685 N/A GLY 553.A N ARG 550.A O no hydrogen 3.148 N/A TYR 554.A N SER 552.A OG no hydrogen 3.394 N/A LYS 557.A N TYR 554.A O no hydrogen 2.987 N/A SER 559.A N PHE 590.A O no hydrogen 2.820 N/A SER 559.A OG THR 592.A O no hydrogen 3.111 N/A GLN 560.A N PHE 590.A O no hydrogen 3.236 N/A ILE 564.A N VAL 586.A O no hydrogen 2.928 N/A LEU 565.A N ARG 396.A O no hydrogen 2.922 N/A THR 566.A N SER 584.A O no hydrogen 2.745 N/A THR 566.A OG1 SER 584.A O no hydrogen 2.738 N/A PHE 570.A N SER 626.A OG no hydrogen 2.650 N/A ARG 572.A NE HIS 569.A O no hydrogen 3.278 N/A ARG 572.A NH1 ASP 524.A OD1 no hydrogen 3.458 N/A ARG 572.A NH1 ASP 524.A OD2 no hydrogen 2.748 N/A ARG 572.A NH1 GLN 578.A O no hydrogen 3.195 N/A ARG 572.A NH2 ASP 524.A OD1 no hydrogen 2.653 N/A ARG 572.A NH2 ASP 524.A OD2 no hydrogen 3.516 N/A ARG 572.A NH2 HIS 569.A O no hydrogen 3.042 N/A LEU 575.A N ASP 573.A OD1 no hydrogen 2.798 N/A GLN 576.A N ASP 573.A O no hydrogen 3.008 N/A SER 580.A OG THR 526.A OG1 no hydrogen 2.805 N/A CYS 581.A N HIS 569.A ND1 no hydrogen 3.047 N/A GLN 582.A N HIS 569.A ND1 no hydrogen 3.032 N/A ARG 583.A N GLY 624.A O no hydrogen 2.775 N/A ARG 583.A NE THR 528.A OG1 no hydrogen 2.907 N/A ARG 583.A NH2 PRO 527.A O no hydrogen 2.760 N/A SER 584.A N THR 566.A O no hydrogen 2.893 N/A SER 584.A OG LEU 568.A O no hydrogen 2.842 N/A VAL 585.A N ARG 627.A O no hydrogen 3.026 N/A VAL 586.A N ILE 564.A O no hydrogen 2.720 N/A ILE 587.A N MET 629.A O no hydrogen 2.746 N/A ARG 588.A N PRO 562.A O no hydrogen 3.007 N/A ARG 588.A NE THR 639.A O no hydrogen 3.284 N/A ARG 588.A NE THR 640.A O no hydrogen 3.240 N/A ARG 588.A NH1 THR 589.A O no hydrogen 3.389 N/A ARG 588.A NH1 THR 633.A O no hydrogen 2.899 N/A ARG 588.A NH2 THR 633.A O no hydrogen 2.904 N/A ARG 588.A NH2 THR 639.A O no hydrogen 3.153 N/A THR 589.A OG1 TYR 630.A OH no hydrogen 2.923 N/A PHE 590.A N GLN 560.A O no hydrogen 2.797 N/A ILE 591.A N ILE 599.A O no hydrogen 2.766 N/A THR 592.A N SER 559.A OG no hydrogen 2.932 N/A THR 592.A OG1 THR 597.A O no hydrogen 2.525 N/A PHE 595.A N THR 592.A OG1 no hydrogen 2.846 N/A MET 596.A N ASP 594.A OD1 no hydrogen 2.894 N/A THR 597.A N ASP 594.A OD1 no hydrogen 3.439 N/A GLY 598.A N LYS 635.A O no hydrogen 3.129 N/A ILE 599.A N ILE 591.A O no hydrogen 2.985 N/A ALA 601.A N THR 589.A OG1 no hydrogen 2.800 N/A THR 602.A N GLU 606.A OE1 no hydrogen 2.881 N/A GLY 604.A N ILE 607.A O no hydrogen 2.687 N/A ASN 605.A N THR 602.A O no hydrogen 2.991 N/A GLU 606.A N GLU 606.A OE1 no hydrogen 2.690 N/A VAL 612.A N PRO 608.A O no hydrogen 3.341 N/A LEU 613.A N VAL 609.A O no hydrogen 2.879 N/A LYS 614.A N GLU 610.A O no hydrogen 2.839 N/A MET 615.A N VAL 611.A O no hydrogen 3.173 N/A VAL 616.A N VAL 612.A O no hydrogen 3.157 N/A THR 617.A N LEU 613.A O no hydrogen 2.851 N/A THR 617.A OG1 LEU 613.A O no hydrogen 3.178 N/A GLU 618.A N LYS 614.A O no hydrogen 2.999 N/A ILE 619.A N MET 615.A O no hydrogen 2.929 N/A LYS 620.A N VAL 616.A O no hydrogen 3.118 N/A LYS 620.A NZ ILE 625.A O no hydrogen 3.066 N/A LYS 620.A NZ SER 626.A O no hydrogen 3.035 N/A LYS 621.A N GLU 618.A O no hydrogen 3.195 N/A LYS 621.A NZ GLU 618.A OE2 no hydrogen 3.203 N/A ILE 622.A N ILE 619.A O no hydrogen 3.046 N/A ILE 625.A N ILE 622.A O no hydrogen 3.392 N/A SER 626.A N ARG 583.A O no hydrogen 2.685 N/A SER 626.A OG PHE 570.A O no hydrogen 3.548 N/A ARG 627.A N SER 584.A OG no hydrogen 2.985 N/A ARG 627.A NE ASP 571.A OD2 no hydrogen 2.790 N/A ARG 627.A NH1 PHE 514.A O no hydrogen 2.770 N/A ARG 627.A NH1 PRO 516.A O no hydrogen 2.943 N/A ARG 627.A NH2 PRO 516.A O no hydrogen 3.203 N/A ARG 627.A NH2 ASP 571.A OD1 no hydrogen 2.698 N/A ARG 627.A NH2 ASP 571.A OD2 no hydrogen 3.003 N/A MET 629.A N VAL 585.A O no hydrogen 2.693 N/A TYR 630.A N TYR 512.A O no hydrogen 2.743 N/A TYR 630.A OH ALA 601.A O no hydrogen 2.508 N/A ASP 631.A N ILE 587.A O no hydrogen 2.907 N/A LEU 632.A N VAL 510.A O no hydrogen 3.054 N/A THR 633.A N ASP 631.A OD1 no hydrogen 2.983 N/A THR 633.A OG1 VAL 510.A O no hydrogen 3.154 N/A THR 633.A OG1 ASP 631.A OD1 no hydrogen 2.659 N/A LYS 635.A N GLY 598.A O no hydrogen 2.818 N/A LYS 635.A NZ PHE 595.A O no hydrogen 2.826 N/A GLY 638.A N SER 634.A O no hydrogen 2.599 N/A THR 639.A OG1 GLU 641.A O no hydrogen 2.612 N/A TRP 642.A NE1 ASP 631.A OD2 no hydrogen 2.888 N/A