Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k4m_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ ASP 270.A OD1 no hydrogen 2.382 N/A TYR 3.A N LYS 268.A O no hydrogen 3.015 N/A VAL 5.A N LYS 27.A O no hydrogen 3.018 N/A VAL 6.A N VAL 271.A O no hydrogen 3.053 N/A ILE 7.A N ALA 29.A O no hydrogen 2.874 N/A VAL 8.A N VAL 273.A O no hydrogen 2.957 N/A GLY 9.A N PHE 31.A O no hydrogen 2.832 N/A SER 10.A N ASP 32.A OD2 no hydrogen 2.835 N/A SER 10.A OG ASP 32.A OD2 no hydrogen 2.431 N/A CYS 15.A N GLY 11.A O no hydrogen 2.975 N/A CYS 15.A SG SER 10.A O no hydrogen 3.536 N/A CYS 15.A SG GLY 11.A O no hydrogen 3.524 N/A CYS 15.A SG ALA 212.A O no hydrogen 3.983 N/A THR 16.A N PRO 12.A O no hydrogen 3.102 N/A THR 16.A OG1 PRO 12.A O no hydrogen 2.792 N/A TYR 17.A N ILE 13.A O no hydrogen 3.461 N/A TYR 17.A OH SER 561.A OG no hydrogen 2.834 N/A ALA 18.A N GLY 14.A O no hydrogen 2.921 N/A ARG 19.A N CYS 15.A O no hydrogen 2.848 N/A ARG 19.A NH1 VAL 215.A O no hydrogen 2.930 N/A GLU 20.A N THR 16.A O no hydrogen 2.911 N/A LEU 21.A N TYR 17.A O no hydrogen 2.839 N/A VAL 22.A N ALA 18.A O no hydrogen 2.618 N/A GLY 23.A N ARG 19.A O no hydrogen 3.314 N/A ALA 24.A N GLU 20.A O no hydrogen 3.098 N/A GLY 25.A N VAL 22.A O no hydrogen 2.987 N/A TYR 26.A N LEU 21.A O no hydrogen 3.068 N/A TYR 26.A OH PHE 569.A O no hydrogen 2.499 N/A LYS 27.A N ASP 4.A OD2 no hydrogen 2.858 N/A LYS 27.A NZ LYS 2.A O no hydrogen 2.687 N/A VAL 28.A N ARG 230.A O no hydrogen 3.043 N/A ALA 29.A N VAL 5.A O no hydrogen 2.889 N/A MET 30.A N ASN 232.A O no hydrogen 2.725 N/A PHE 31.A N ILE 7.A O no hydrogen 2.865 N/A ASP 32.A N PHE 234.A O no hydrogen 2.946 N/A GLY 34.A N ASP 32.A OD1 no hydrogen 2.762 N/A SER 38.A OG ALA 44.A O no hydrogen 2.875 N/A HIS 45.A NE2 TRP 124.A O no hydrogen 2.627 N/A LYS 46.A N THR 122.A O no hydrogen 2.933 N/A LYS 46.A NZ ASP 37.A OD2 no hydrogen 2.719 N/A LYS 46.A NZ GLN 66.A OE1 no hydrogen 2.632 N/A LYS 47.A N HIS 45.A ND1 no hydrogen 3.208 N/A ASN 48.A N HIS 45.A O no hydrogen 3.197 N/A ASN 48.A ND2 TRP 209.A O no hydrogen 2.942 N/A TYR 52.A N THR 49.A OG1 no hydrogen 3.120 N/A GLN 53.A N THR 49.A O no hydrogen 3.146 N/A GLN 53.A NE2 LYS 47.A O no hydrogen 3.076 N/A GLN 53.A NE2 VAL 207.A O no hydrogen 2.835 N/A LYS 54.A N VAL 50.A O no hydrogen 2.951 N/A LYS 54.A N GLU 51.A O no hydrogen 3.215 N/A ASN 55.A N TYR 52.A O no hydrogen 2.974 N/A ASN 55.A ND2 GLU 51.A O no hydrogen 2.649 N/A LYS 58.A N ASN 55.A O no hydrogen 2.744 N/A PHE 59.A N ILE 56.A O no hydrogen 2.987 N/A VAL 60.A N ASP 57.A O no hydrogen 3.299 N/A ASN 61.A N LYS 58.A O no hydrogen 3.147 N/A ILE 63.A N PHE 59.A O no hydrogen 3.217 N/A GLN 64.A N VAL 60.A O no hydrogen 2.964 N/A GLY 65.A N ASN 61.A O no hydrogen 3.132 N/A GLN 66.A N ILE 63.A O no hydrogen 2.916 N/A GLN 66.A NE2 THR 122.A OG1 no hydrogen 3.039 N/A GLN 66.A NE2 HIS 123.A ND1 no hydrogen 2.717 N/A LEU 67.A N GLN 64.A O no hydrogen 3.382 N/A MET 68.A N VAL 113.A O no hydrogen 2.913 N/A VAL 70.A N GLN 111.A O no hydrogen 3.057 N/A SER 71.A OG GLN 102.A OE1 no hydrogen 2.867 N/A SER 71.A OG PRO 456.A O no hydrogen 3.344 N/A LEU 77.A N ASN 75.A OD1 no hydrogen 3.134 N/A SER 83.A OG THR 85.A OG1 no hydrogen 2.888 N/A THR 85.A N SER 83.A OG no hydrogen 3.105 N/A THR 85.A OG1 SER 83.A OG no hydrogen 2.888 N/A SER 86.A N SER 83.A O no hydrogen 3.072 N/A GLN 88.A NE2 TRP 87.A O no hydrogen 2.754 N/A ARG 95.A NH1 ASN 75.A O no hydrogen 3.004 N/A ARG 95.A NH1 PHE 93.A O no hydrogen 2.830 N/A ARG 95.A NH2 ASN 75.A O no hydrogen 2.850 N/A SER 98.A N ARG 95.A O no hydrogen 2.896 N/A SER 98.A OG ARG 95.A O no hydrogen 2.908 N/A ASN 99.A N VAL 72.A O no hydrogen 2.732 N/A ASN 99.A ND2 SER 71.A OG no hydrogen 3.065 N/A ASN 99.A ND2 THR 457.A OG1 no hydrogen 2.913 N/A GLU 101.A N ASN 99.A OD1 no hydrogen 3.046 N/A GLN 102.A N ASN 99.A O no hydrogen 3.240 N/A GLN 102.A NE2 ASP 103.A O no hydrogen 3.231 N/A GLN 102.A NE2 ARG 106.A O no hydrogen 3.553 N/A GLN 102.A NE2 PHE 458.A O no hydrogen 2.746 N/A LEU 105.A N ASP 103.A OD1 no hydrogen 2.863 N/A ARG 106.A N ASP 103.A O no hydrogen 3.107 N/A ARG 106.A NE ASP 459.A OD1 no hydrogen 2.798 N/A ASN 107.A ND2 SER 71.A O no hydrogen 2.773 N/A SER 109.A OG GLU 498.A OE2 no hydrogen 2.862 N/A GLY 110.A N PRO 499.A O no hydrogen 2.724 N/A GLN 111.A N LEU 108.A O no hydrogen 2.945 N/A GLN 111.A NE2 GLU 314.A OE2 no hydrogen 2.894 N/A VAL 113.A N MET 68.A O no hydrogen 2.818 N/A THR 114.A OG1 GLN 66.A O no hydrogen 2.852 N/A VAL 117.A N GLU 35.A O no hydrogen 3.054 N/A GLY 118.A N SER 10.A OG no hydrogen 2.979 N/A GLY 119.A N VAL 116.A O no hydrogen 2.905 N/A SER 121.A N GLY 118.A O no hydrogen 3.078 N/A SER 121.A OG GLY 118.A O no hydrogen 2.495 N/A THR 122.A N GLY 119.A O no hydrogen 3.152 N/A THR 122.A OG1 GLY 119.A O no hydrogen 2.865 N/A HIS 123.A N MET 120.A O no hydrogen 2.948 N/A TRP 124.A NE1 SER 210.A O no hydrogen 2.832 N/A THR 125.A OG1 ASP 408.A OD1 no hydrogen 3.180 N/A THR 125.A OG1 ASP 408.A OD2 no hydrogen 3.260 N/A CYS 126.A SG TRP 124.A O no hydrogen 3.576 N/A CYS 126.A SG SER 210.A O no hydrogen 3.497 N/A THR 128.A N PRO 196.A O no hydrogen 2.914 N/A THR 128.A OG1 THR 164.A OG1 no hydrogen 2.589 N/A ARG 130.A NE GLU 159.A OE2 no hydrogen 2.872 N/A ARG 130.A NH1 ASP 152.A OD1 no hydrogen 2.899 N/A ARG 130.A NH2 ASP 152.A OD1 no hydrogen 3.441 N/A ARG 130.A NH2 THR 156.A OG1 no hydrogen 2.889 N/A ARG 130.A NH2 GLU 159.A OE1 no hydrogen 2.987 N/A PHE 131.A N TYR 155.A OH no hydrogen 2.842 N/A ARG 133.A NH2 ASP 148.A OD2 no hydrogen 2.418 N/A GLN 135.A N ASP 132.A O no hydrogen 3.175 N/A GLN 135.A NE2 ASP 132.A OD1 no hydrogen 3.072 N/A ARG 136.A N ARG 133.A O no hydrogen 3.165 N/A ARG 136.A NH2 ASP 147.A OD2 no hydrogen 3.139 N/A ARG 136.A NH2 ASP 148.A OD1 no hydrogen 2.686 N/A LEU 139.A N ASP 147.A OD1 no hydrogen 2.709 N/A VAL 140.A N ASP 147.A OD1 no hydrogen 3.185 N/A ALA 146.A N ASP 143.A OD1 no hydrogen 3.401 N/A ASP 147.A N ASP 143.A O no hydrogen 2.881 N/A ASP 148.A N ALA 144.A O no hydrogen 2.740 N/A ALA 149.A N ASP 145.A O no hydrogen 2.866 N/A GLU 150.A N ALA 146.A O no hydrogen 3.032 N/A TRP 151.A N ASP 147.A O no hydrogen 2.868 N/A ASP 152.A N ASP 148.A O no hydrogen 2.899 N/A ARG 153.A N ALA 149.A O no hydrogen 3.087 N/A ARG 153.A NE GLU 150.A OE1 no hydrogen 2.888 N/A ARG 153.A NH1 GLU 563.A OE2 no hydrogen 3.190 N/A ARG 153.A NH2 GLU 150.A OE1 no hydrogen 2.561 N/A ARG 153.A NH2 GLU 150.A OE2 no hydrogen 3.062 N/A ARG 153.A NH2 GLU 563.A OE1 no hydrogen 3.217 N/A LEU 154.A N GLU 150.A O no hydrogen 3.040 N/A TYR 155.A N TRP 151.A O no hydrogen 2.801 N/A TYR 155.A OH THR 553.A OG1 no hydrogen 2.684 N/A THR 156.A N ASP 152.A O no hydrogen 2.987 N/A THR 156.A OG1 ASP 152.A O no hydrogen 2.702 N/A THR 156.A OG1 ASP 152.A OD1 no hydrogen 3.019 N/A LYS 157.A N ARG 153.A O no hydrogen 3.251 N/A LYS 157.A NZ GLU 20.A OE1 no hydrogen 3.421 N/A LYS 157.A NZ GLU 20.A OE2 no hydrogen 2.768 N/A ALA 158.A N LEU 154.A O no hydrogen 2.878 N/A GLU 159.A N TYR 155.A O no hydrogen 2.777 N/A SER 160.A N THR 156.A O no hydrogen 3.157 N/A SER 160.A OG LYS 157.A O no hydrogen 3.150 N/A TYR 161.A N LYS 157.A O no hydrogen 2.978 N/A TYR 161.A OH GLU 20.A OE2 no hydrogen 2.235 N/A PHE 162.A N ALA 158.A O no hydrogen 3.035 N/A GLN 163.A NE2 SER 160.A O no hydrogen 2.544 N/A THR 164.A N GLU 159.A O no hydrogen 2.929 N/A THR 164.A OG1 THR 128.A OG1 no hydrogen 2.589 N/A GLY 165.A N LEU 197.A O no hydrogen 3.035 N/A GLN 168.A N GLN 168.A OE1 no hydrogen 2.866 N/A GLN 168.A NE2 GLY 165.A O no hydrogen 3.390 N/A GLN 168.A NE2 LEU 197.A O no hydrogen 2.794 N/A GLN 168.A NE2 ALA 199.A O no hydrogen 2.714 N/A PHE 169.A N GLN 194.A OE1 no hydrogen 3.009 N/A LYS 170.A N ASP 167.A O no hydrogen 3.471 N/A SER 172.A N PHE 169.A O no hydrogen 3.032 N/A SER 172.A OG ASP 386.A OD2 no hydrogen 3.405 N/A SER 172.A OG PRO 387.A O no hydrogen 2.652 N/A ILE 173.A N ASP 386.A OD1 no hydrogen 2.856 N/A ARG 174.A N ASP 386.A OD2 no hydrogen 2.872 N/A ARG 174.A NE ASP 386.A OD2 no hydrogen 3.414 N/A ARG 174.A NH2 ASP 386.A O no hydrogen 2.589 N/A HIS 175.A N SER 172.A OG no hydrogen 3.081 N/A ASN 176.A N SER 172.A O no hydrogen 2.930 N/A ASN 176.A ND2 LYS 170.A O no hydrogen 2.755 N/A ASN 176.A ND2 SER 172.A O no hydrogen 2.763 N/A LEU 177.A N ILE 173.A O no hydrogen 2.710 N/A VAL 178.A N ARG 174.A O no hydrogen 2.923 N/A LEU 179.A N HIS 175.A O no hydrogen 2.698 N/A ASN 180.A N ASN 176.A O no hydrogen 2.846 N/A LYS 181.A N LEU 177.A O no hydrogen 3.338 N/A LYS 181.A NZ GLU 185.A OE2 no hydrogen 3.279 N/A LEU 182.A N VAL 178.A O no hydrogen 3.212 N/A THR 183.A N LEU 179.A O no hydrogen 2.980 N/A THR 183.A OG1 LEU 179.A O no hydrogen 2.869 N/A GLU 184.A N ASN 180.A O no hydrogen 2.991 N/A GLU 185.A N LYS 181.A O no hydrogen 2.881 N/A TYR 186.A N LEU 182.A O no hydrogen 3.157 N/A LYS 187.A N GLU 184.A O no hydrogen 3.041 N/A GLN 189.A N TYR 186.A O no hydrogen 2.780 N/A ARG 190.A N TYR 186.A O no hydrogen 3.159 N/A ARG 190.A NH1 ASP 477.A OD2 no hydrogen 2.995 N/A ARG 190.A NH2 ASP 477.A OD1 no hydrogen 3.020 N/A ARG 190.A NH2 ASP 477.A OD2 no hydrogen 3.383 N/A GLN 193.A N THR 392.A O no hydrogen 3.087 N/A GLN 193.A NE2 GLN 194.A O no hydrogen 2.685 N/A GLN 194.A NE2 GLN 168.A OE1 no hydrogen 2.864 N/A GLN 194.A NE2 ILE 195.A O no hydrogen 2.825 N/A ILE 195.A N GLN 390.A O no hydrogen 2.833 N/A LEU 197.A N GLY 165.A O no hydrogen 2.817 N/A ALA 198.A N CYS 126.A O no hydrogen 2.869 N/A ALA 199.A N GLN 163.A O no hydrogen 3.318 N/A THR 200.A N GLU 208.A O no hydrogen 3.003 N/A ARG 201.A NE GLN 168.A O no hydrogen 2.799 N/A ARG 201.A NH1 SER 203.A O no hydrogen 2.820 N/A ARG 201.A NH2 GLN 168.A O no hydrogen 2.993 N/A ARG 202.A N PHE 206.A O no hydrogen 2.873 N/A ARG 202.A NE GLU 208.A OE1 no hydrogen 3.388 N/A SER 203.A N PHE 206.A O no hydrogen 3.136 N/A PHE 206.A N SER 203.A O no hydrogen 3.334 N/A VAL 207.A N GLN 53.A OE1 no hydrogen 2.885 N/A GLU 208.A N THR 200.A O no hydrogen 2.767 N/A TRP 209.A N ASN 48.A OD1 no hydrogen 2.960 N/A SER 210.A N ALA 198.A O no hydrogen 3.043 N/A SER 210.A OG PHE 162.A O no hydrogen 2.582 N/A SER 211.A N THR 214.A OG1 no hydrogen 2.957 N/A SER 211.A OG GLY 43.A O no hydrogen 3.323 N/A ALA 212.A N SER 121.A OG no hydrogen 2.858 N/A ASN 213.A N GLY 43.A O no hydrogen 3.418 N/A ASN 213.A ND2 ILE 42.A O no hydrogen 3.155 N/A THR 214.A OG1 SER 211.A O no hydrogen 3.281 N/A PHE 216.A N ALA 212.A O no hydrogen 2.898 N/A GLN 219.A N ASP 217.A OD1 no hydrogen 2.831 N/A ARG 221.A N PHE 231.A O no hydrogen 2.817 N/A ARG 221.A NE GLU 229.A OE1 no hydrogen 2.974 N/A ARG 221.A NH1 ASP 217.A OD1 no hydrogen 2.602 N/A ARG 221.A NH1 GLN 219.A O no hydrogen 2.956 N/A ARG 221.A NH2 ASP 217.A OD1 no hydrogen 3.160 N/A ARG 221.A NH2 ASP 217.A OD2 no hydrogen 3.444 N/A ASN 223.A N ALA 226.A O no hydrogen 3.224 N/A ASN 223.A ND2 ASN 220.A O no hydrogen 3.058 N/A ASP 225.A N ASN 223.A OD1 no hydrogen 2.976 N/A ALA 226.A N ASN 223.A O no hydrogen 2.902 N/A ALA 226.A N ASN 223.A OD1 no hydrogen 2.994 N/A GLU 229.A N ALA 226.A O no hydrogen 3.178 N/A ARG 230.A NH1 SER 572.A OG no hydrogen 2.964 N/A ARG 230.A NH2 GLY 25.A O no hydrogen 2.957 N/A ARG 230.A NH2 SER 572.A O no hydrogen 2.746 N/A PHE 231.A N ARG 221.A O no hydrogen 2.978 N/A ASN 232.A N VAL 28.A O no hydrogen 3.001 N/A LEU 233.A N ASN 220.A OD1 no hydrogen 3.225 N/A PHE 234.A N MET 30.A O no hydrogen 2.724 N/A ALA 236.A N GLY 34.A O no hydrogen 3.031 N/A VAL 237.A N ASP 32.A O no hydrogen 2.825 N/A ALA 238.A N HIS 257.A O no hydrogen 2.939 N/A GLU 240.A N HIS 255.A O no hydrogen 2.933 N/A VAL 242.A N SER 288.A OG no hydrogen 2.671 N/A VAL 243.A N SER 253.A O no hydrogen 3.021 N/A ARG 244.A NE SER 288.A O no hydrogen 2.868 N/A ARG 244.A NH1 ASN 248.A OD1 no hydrogen 2.545 N/A ARG 244.A NH2 SER 288.A O no hydrogen 3.232 N/A ASN 245.A N GLU 250.A O no hydrogen 3.101 N/A ASN 245.A ND2 SER 249.A OG no hydrogen 3.093 N/A ASN 248.A N ASN 245.A O no hydrogen 2.970 N/A SER 249.A N ASN 245.A OD1 no hydrogen 2.841 N/A GLU 250.A N ASN 245.A OD1 no hydrogen 3.074 N/A ILE 251.A N ASN 533.A OD1 no hydrogen 2.910 N/A GLU 252.A N VAL 243.A O no hydrogen 2.800 N/A SER 253.A OG GLU 266.A OE2 no hydrogen 3.471 N/A LEU 254.A N ILE 267.A O no hydrogen 2.771 N/A HIS 255.A N ARG 241.A O no hydrogen 2.887 N/A HIS 255.A ND1 GLU 266.A OE1 no hydrogen 2.454 N/A ILE 256.A N PHE 265.A O no hydrogen 2.830 N/A HIS 257.A N ALA 238.A O no hydrogen 2.869 N/A ASP 258.A N ASP 263.A O no hydrogen 2.947 N/A LEU 259.A N ALA 236.A O no hydrogen 3.001 N/A ILE 260.A N ASP 258.A OD1 no hydrogen 2.917 N/A SER 261.A N ASP 258.A OD1 no hydrogen 3.388 N/A SER 261.A OG ASP 258.A OD2 no hydrogen 2.975 N/A GLY 262.A N ASP 258.A O no hydrogen 2.742 N/A ASP 263.A N SER 261.A OG no hydrogen 3.164 N/A ARG 264.A NE GLU 240.A OE1 no hydrogen 3.157 N/A PHE 265.A N ILE 256.A O no hydrogen 2.758 N/A ILE 267.A N LEU 254.A O no hydrogen 2.676 N/A LYS 268.A NZ GLU 252.A O no hydrogen 3.170 N/A ALA 269.A N TYR 272.A OH no hydrogen 3.063 N/A ASP 270.A N ASP 4.A O no hydrogen 3.140 N/A VAL 271.A N ASP 4.A O no hydrogen 3.054 N/A TYR 272.A N ASN 533.A O no hydrogen 2.915 N/A TYR 272.A OH ALA 269.A O no hydrogen 3.040 N/A VAL 273.A N VAL 6.A O no hydrogen 2.868 N/A LEU 274.A N PHE 535.A O no hydrogen 2.776 N/A THR 275.A N VAL 8.A O no hydrogen 2.723 N/A THR 275.A OG1 VAL 8.A O no hydrogen 2.864 N/A THR 275.A OG1 GLY 9.A O no hydrogen 3.471 N/A ALA 276.A N ASN 281.A OD1 no hydrogen 2.699 N/A ASN 281.A N GLY 277.A O no hydrogen 3.019 N/A ASN 281.A ND2 LEU 274.A O no hydrogen 2.937 N/A ASN 281.A ND2 HIS 509.A NE2 no hydrogen 3.269 N/A ASN 281.A ND2 GLY 537.A O no hydrogen 3.229 N/A THR 282.A OG1 ALA 278.A O no hydrogen 2.806 N/A GLN 283.A N VAL 279.A O no hydrogen 3.035 N/A GLN 283.A NE2 ASP 449.A OD2 no hydrogen 2.983 N/A GLN 283.A NE2 PRO 454.A O no hydrogen 2.880 N/A LEU 284.A N HIS 280.A O no hydrogen 3.021 N/A LEU 285.A N ASN 281.A O no hydrogen 2.937 N/A VAL 286.A N THR 282.A O no hydrogen 2.919 N/A ASN 287.A N GLN 283.A O no hydrogen 2.895 N/A ASN 287.A ND2 GLU 240.A O no hydrogen 2.977 N/A SER 288.A N LEU 285.A O no hydrogen 2.933 N/A SER 288.A OG VAL 242.A O no hydrogen 3.162 N/A SER 288.A OG LEU 284.A O no hydrogen 2.883 N/A GLY 289.A N VAL 286.A O no hydrogen 3.323 N/A PHE 290.A N LEU 285.A O no hydrogen 3.045 N/A GLY 291.A N LEU 304.A O no hydrogen 2.951 N/A GLN 292.A NE2 ASN 297.A O no hydrogen 3.381 N/A GLY 294.A N PHE 443.A O no hydrogen 2.663 N/A ARG 295.A NH2 GLU 101.A O no hydrogen 2.993 N/A ARG 295.A NH2 GLU 101.A OE1 no hydrogen 3.028 N/A ASN 297.A N GLN 292.A OE1 no hydrogen 3.027 N/A ASN 300.A N ASN 297.A O no hydrogen 2.764 N/A LEU 308.A N LEU 305.A O no hydrogen 2.936 N/A GLY 309.A N THR 508.A O no hydrogen 3.008 N/A SER 310.A N SER 307.A O no hydrogen 2.978 N/A SER 310.A OG GLU 437.A O no hydrogen 3.562 N/A ILE 312.A N ASN 439.A O no hydrogen 3.267 N/A THR 313.A N GLY 506.A O no hydrogen 3.144 N/A GLN 315.A N GLU 314.A OE1 no hydrogen 2.760 N/A GLN 315.A NE2 TYR 546.A O no hydrogen 2.665 N/A GLN 315.A NE2 ALA 548.A O no hydrogen 3.393 N/A VAL 318.A N PHE 429.A O no hydrogen 3.181 N/A PHE 319.A N GLN 495.A O no hydrogen 2.923 N/A CYS 320.A N TRP 427.A O no hydrogen 3.060 N/A GLN 321.A N SER 492.A O no hydrogen 3.105 N/A GLN 321.A NE2 ASP 426.A OD1 no hydrogen 2.769 N/A THR 322.A N VAL 425.A O no hydrogen 2.892 N/A THR 322.A OG1 VAL 425.A O no hydrogen 3.549 N/A VAL 323.A N GLY 487.A O no hydrogen 2.844 N/A MET 324.A N LEU 423.A O no hydrogen 2.768 N/A SER 325.A N ILE 485.A O no hydrogen 2.858 N/A SER 325.A OG ILE 485.A O no hydrogen 3.562 N/A LEU 328.A N SER 325.A OG no hydrogen 3.094 N/A ILE 329.A N SER 325.A O no hydrogen 3.206 N/A ASP 330.A N THR 326.A O no hydrogen 2.955 N/A SER 331.A N GLU 327.A O no hydrogen 2.931 N/A SER 331.A OG LEU 328.A O no hydrogen 2.645 N/A VAL 332.A N LEU 328.A O no hydrogen 3.127 N/A VAL 332.A N ILE 329.A O no hydrogen 3.063 N/A LYS 333.A N ASP 330.A O no hydrogen 2.827 N/A SER 334.A N SER 331.A O no hydrogen 3.164 N/A SER 334.A OG SER 331.A O no hydrogen 3.127 N/A SER 334.A OG ASP 335.A OD1 no hydrogen 3.008 N/A SER 334.A OG HIS 360.A NE2 no hydrogen 3.175 N/A MET 336.A N LYS 333.A O no hydrogen 3.141 N/A THR 337.A N THR 350.A O no hydrogen 2.778 N/A ARG 339.A N SER 348.A O no hydrogen 2.661 N/A GLY 343.A N GLN 376.A OE1 no hydrogen 2.300 N/A GLU 344.A N THR 341.A O no hydrogen 3.275 N/A TYR 347.A N GLU 344.A O no hydrogen 3.187 N/A SER 348.A N ARG 339.A O no hydrogen 2.944 N/A THR 350.A N THR 337.A O no hydrogen 2.886 N/A TYR 351.A OH GLU 366.A OE1 no hydrogen 2.327 N/A ALA 355.A N THR 352.A O no hydrogen 3.421 N/A ASN 358.A N ALA 355.A O no hydrogen 3.253 N/A ASN 358.A ND2 THR 352.A O no hydrogen 2.842 N/A LYS 359.A N ASP 335.A OD1 no hydrogen 2.862 N/A HIS 360.A N ASP 335.A OD2 no hydrogen 2.837 N/A HIS 360.A NE2 SER 331.A O no hydrogen 2.661 N/A TRP 364.A N PRO 361.A O no hydrogen 3.017 N/A TRP 364.A NE1 VAL 332.A O no hydrogen 3.054 N/A ASN 365.A N PRO 361.A O no hydrogen 3.069 N/A ASN 365.A ND2 ASP 335.A OD2 no hydrogen 2.909 N/A GLU 366.A N ASP 362.A O no hydrogen 2.766 N/A LYS 367.A N TRP 363.A O no hydrogen 3.409 N/A VAL 368.A N TRP 364.A O no hydrogen 2.942 N/A LYS 369.A N ASN 365.A O no hydrogen 2.826 N/A LYS 369.A NZ ASN 370.A OD1 no hydrogen 3.011 N/A ASN 370.A N GLU 366.A O no hydrogen 3.005 N/A HIS 371.A N LYS 367.A O no hydrogen 3.133 N/A HIS 371.A NE2 ASP 378.A OD2 no hydrogen 3.131 N/A HIS 371.A NE2 LEU 380.A O no hydrogen 2.747 N/A MET 372.A N VAL 368.A O no hydrogen 2.895 N/A MET 373.A N LYS 369.A O no hydrogen 2.919 N/A GLN 374.A N ASN 370.A O no hydrogen 2.912 N/A HIS 375.A N HIS 371.A O no hydrogen 3.020 N/A GLN 376.A NE2 MET 373.A O no hydrogen 3.033 N/A GLU 377.A N GLU 377.A OE1 no hydrogen 2.637 N/A ASP 378.A N HIS 375.A O no hydrogen 2.799 N/A LEU 380.A N ASP 378.A OD2 no hydrogen 3.180 N/A ASP 386.A N PRO 383.A O no hydrogen 3.140 N/A GLN 390.A N HIS 175.A ND1 no hydrogen 2.989 N/A VAL 391.A N ILE 405.A O no hydrogen 2.844 N/A THR 392.A N GLN 193.A O no hydrogen 2.960 N/A THR 392.A OG1 THR 403.A O no hydrogen 2.649 N/A THR 392.A OG1 THR 403.A OG1 no hydrogen 3.354 N/A THR 393.A N THR 403.A OG1 no hydrogen 2.836 N/A THR 393.A OG1 ASP 191.A O no hydrogen 2.808 N/A GLN 396.A N HIS 399.A O no hydrogen 3.104 N/A HIS 399.A N GLN 396.A O no hydrogen 2.813 N/A TRP 401.A N HIS 399.A O no hydrogen 2.806 N/A TRP 401.A NE1 ASP 477.A OD2 no hydrogen 3.094 N/A HIS 402.A N PHE 430.A O no hydrogen 2.941 N/A HIS 402.A NE2 GLN 404.A OE1 no hydrogen 2.819 N/A THR 403.A OG1 THR 392.A OG1 no hydrogen 3.354 N/A THR 403.A OG1 THR 393.A O no hydrogen 2.654 N/A GLN 404.A N ARG 428.A O no hydrogen 2.919 N/A ILE 405.A N VAL 391.A O no hydrogen 2.684 N/A HIS 406.A N ASP 426.A O no hydrogen 2.999 N/A ARG 407.A NH1 SER 421.A O no hydrogen 2.717 N/A ARG 407.A NH1 ILE 424.A O no hydrogen 2.948 N/A ASP 408.A N ASP 426.A OD2 no hydrogen 2.964 N/A PHE 410.A N ASP 57.A OD1 no hydrogen 3.210 N/A SER 411.A OG SER 411.A O no hydrogen 2.553 N/A TRP 412.A NE1 ASP 57.A OD2 no hydrogen 2.549 N/A GLN 417.A N ALA 414.A O no hydrogen 3.052 N/A SER 418.A N VAL 415.A O no hydrogen 3.131 N/A ILE 419.A N GLN 416.A O no hydrogen 3.251 N/A ARG 422.A N ASP 420.A OD1 no hydrogen 2.900 N/A ARG 422.A NE ASP 420.A OD1 no hydrogen 3.061 N/A ARG 422.A NH1 ASP 378.A OD2 no hydrogen 3.013 N/A ARG 422.A NH1 ILE 382.A O no hydrogen 2.778 N/A ARG 422.A NH2 ASP 378.A OD1 no hydrogen 3.131 N/A ARG 422.A NH2 ASP 378.A OD2 no hydrogen 3.195 N/A ARG 422.A NH2 ASP 420.A OD2 no hydrogen 2.788 N/A LEU 423.A N ASP 420.A O no hydrogen 3.091 N/A ILE 424.A N SER 421.A O no hydrogen 3.194 N/A VAL 425.A N THR 322.A O no hydrogen 3.058 N/A ASP 426.A N HIS 406.A O no hydrogen 2.765 N/A TRP 427.A N CYS 320.A O no hydrogen 2.875 N/A TRP 427.A NE1 THR 322.A OG1 no hydrogen 3.024 N/A ARG 428.A N GLN 404.A O no hydrogen 2.990 N/A ARG 428.A NH1 HIS 406.A NE2 no hydrogen 2.902 N/A ARG 428.A NH1 ASP 426.A OD2 no hydrogen 3.035 N/A PHE 429.A N VAL 318.A O no hydrogen 3.126 N/A PHE 430.A N HIS 402.A O no hydrogen 2.754 N/A GLY 431.A N SER 316.A O no hydrogen 2.838 N/A ARG 432.A NE GLU 470.A OE1 no hydrogen 2.749 N/A ARG 432.A NH2 GLU 470.A OE1 no hydrogen 3.559 N/A ARG 432.A NH2 GLU 470.A OE2 no hydrogen 2.832 N/A THR 433.A OG1 GLU 314.A O no hydrogen 2.486 N/A GLU 434.A N THR 467.A OG1 no hydrogen 3.023 N/A GLU 438.A N GLU 438.A OE1 no hydrogen 2.606 N/A ASN 439.A N LYS 436.A O no hydrogen 3.094 N/A ASN 439.A ND2 ARG 461.A O no hydrogen 2.898 N/A LYS 440.A N ASP 459.A O no hydrogen 2.989 N/A LYS 440.A NZ GLU 437.A O no hydrogen 3.025 N/A LYS 440.A NZ GLU 437.A OE2 no hydrogen 2.930 N/A LEU 441.A N GLY 309.A O no hydrogen 2.689 N/A TRP 442.A N THR 457.A O no hydrogen 2.951 N/A SER 444.A N GLN 455.A O no hydrogen 3.029 N/A SER 444.A OG GLU 101.A OE2 no hydrogen 2.505 N/A LYS 446.A N SER 444.A OG no hydrogen 3.167 N/A ILE 447.A N SER 444.A OG no hydrogen 2.935 N/A ASP 449.A N MET 453.A O no hydrogen 2.930 N/A TYR 451.A N ASP 449.A OD1 no hydrogen 2.989 N/A ASN 452.A N ASP 449.A O no hydrogen 2.789 N/A MET 453.A N ASP 449.A OD1 no hydrogen 2.986 N/A GLN 455.A N ILE 447.A O no hydrogen 2.975 N/A GLN 455.A NE2 VAL 70.A O no hydrogen 2.891 N/A GLN 455.A NE2 PRO 456.A O no hydrogen 2.901 N/A THR 457.A N TRP 442.A O no hydrogen 2.705 N/A PHE 458.A N GLN 102.A OE1 no hydrogen 2.679 N/A ASP 459.A N LYS 440.A O no hydrogen 2.817 N/A PHE 460.A N ARG 106.A O no hydrogen 2.894 N/A ARG 461.A N ASN 439.A OD1 no hydrogen 2.922 N/A ARG 461.A NE LEU 105.A O no hydrogen 2.910 N/A ARG 461.A NH2 LEU 105.A O no hydrogen 3.030 N/A THR 467.A N GLU 434.A OE2 no hydrogen 2.829 N/A THR 467.A OG1 GLU 434.A OE2 no hydrogen 2.604 N/A SER 468.A N GLY 465.A O no hydrogen 3.030 N/A SER 468.A OG PRO 463.A O no hydrogen 2.668 N/A LYS 469.A N GLY 465.A O no hydrogen 3.043 N/A LYS 469.A NZ ASP 473.A OD1 no hydrogen 3.204 N/A LYS 469.A NZ ASP 473.A OD2 no hydrogen 2.983 N/A GLU 470.A N ARG 466.A O no hydrogen 2.754 N/A ALA 471.A N THR 467.A O no hydrogen 3.081 N/A GLU 472.A N SER 468.A O no hydrogen 3.070 N/A ASP 473.A N LYS 469.A O no hydrogen 2.830 N/A MET 474.A N GLU 470.A O no hydrogen 2.646 N/A MET 475.A N ALA 471.A O no hydrogen 3.073 N/A THR 476.A N GLU 472.A O no hydrogen 3.148 N/A THR 476.A OG1 GLU 472.A O no hydrogen 3.302 N/A ASP 477.A N ASP 473.A O no hydrogen 3.041 N/A MET 478.A N MET 474.A O no hydrogen 3.061 N/A CYS 479.A N MET 475.A O no hydrogen 3.080 N/A CYS 479.A SG MET 475.A O no hydrogen 3.492 N/A VAL 480.A N THR 476.A O no hydrogen 2.866 N/A MET 481.A N ASP 477.A O no hydrogen 2.799 N/A SER 482.A N MET 478.A O no hydrogen 2.892 N/A SER 482.A OG MET 478.A O no hydrogen 2.833 N/A SER 482.A OG CYS 479.A O no hydrogen 3.275 N/A ALA 483.A N CYS 479.A O no hydrogen 3.369 N/A LYS 484.A N MET 481.A O no hydrogen 2.958 N/A LYS 484.A NZ GLU 185.A OE1 no hydrogen 3.216 N/A ILE 485.A N SER 482.A O no hydrogen 2.760 N/A GLY 486.A N SER 482.A O no hydrogen 3.234 N/A LEU 489.A N GLN 321.A O no hydrogen 2.849 N/A SER 492.A N LEU 489.A O no hydrogen 2.738 N/A SER 492.A OG GLN 321.A OE1 no hydrogen 2.625 N/A SER 492.A OG GLN 416.A OE1 no hydrogen 2.919 N/A GLN 495.A N PHE 319.A O no hydrogen 2.920 N/A GLN 495.A NE2 LEU 493.A O no hydrogen 2.801 N/A MET 497.A N LEU 317.A O no hydrogen 2.708 N/A LEU 501.A N GLU 498.A O no hydrogen 2.930 N/A LEU 503.A N GLY 500.A O no hydrogen 3.095 N/A HIS 504.A N GLU 314.A OE1 no hydrogen 3.113 N/A HIS 504.A N GLU 314.A OE2 no hydrogen 2.951 N/A HIS 504.A ND1 GLN 315.A OE1 no hydrogen 2.721 N/A GLY 506.A N THR 313.A O no hydrogen 2.815 N/A GLY 507.A N CYS 539.A O no hydrogen 3.459 N/A THR 508.A OG1 ALA 278.A O no hydrogen 2.769 N/A THR 508.A OG1 THR 282.A OG1 no hydrogen 3.314 N/A HIS 509.A N GLY 540.A O no hydrogen 2.928 N/A HIS 509.A ND1 HIS 509.A O no hydrogen 2.805 N/A HIS 509.A ND1 ASN 541.A OD1 no hydrogen 2.913 N/A ARG 510.A NH1 ASN 519.A O no hydrogen 2.720 N/A ARG 510.A NH2 PRO 543.A O no hydrogen 2.960 N/A MET 511.A N ASN 541.A O no hydrogen 2.772 N/A GLY 512.A N VAL 522.A O no hydrogen 2.979 N/A ASP 514.A N ASP 518.A OD2 no hydrogen 2.945 N/A GLU 517.A N ASP 514.A OD2 no hydrogen 3.008 N/A ASP 518.A N ASP 514.A O no hydrogen 3.026 N/A ASN 519.A N LYS 516.A O no hydrogen 3.065 N/A CYS 520.A N GLU 515.A O no hydrogen 3.227 N/A CYS 520.A SG ASP 514.A O no hydrogen 3.324 N/A CYS 520.A SG GLU 515.A O no hydrogen 4.027 N/A CYS 521.A N ARG 510.A O no hydrogen 2.716 N/A VAL 522.A N ARG 510.A O no hydrogen 3.346 N/A ASN 523.A N ARG 527.A O no hydrogen 3.020 N/A ASP 525.A N ASN 523.A OD1 no hydrogen 3.068 N/A SER 526.A N ASN 523.A O no hydrogen 2.580 N/A ARG 527.A N ASN 523.A OD1 no hydrogen 3.293 N/A ARG 527.A NH1 PHE 531.A O no hydrogen 2.846 N/A VAL 528.A N LEU 534.A O no hydrogen 3.088 N/A PHE 529.A N CYS 521.A O no hydrogen 3.305 N/A PHE 531.A N VAL 528.A O no hydrogen 3.075 N/A LYS 532.A N SER 249.A O no hydrogen 2.994 N/A LYS 532.A NZ SER 249.A O no hydrogen 3.435 N/A LYS 532.A NZ SER 249.A OG no hydrogen 3.310 N/A ASN 533.A ND2 ILE 251.A O no hydrogen 3.100 N/A ASN 533.A ND2 ASP 270.A O no hydrogen 3.177 N/A PHE 535.A N TYR 272.A O no hydrogen 2.934 N/A LEU 536.A N SER 526.A O no hydrogen 2.968 N/A GLY 537.A N LEU 274.A O no hydrogen 3.033 N/A ASN 541.A N GLY 538.A O no hydrogen 3.024 N/A ASN 541.A ND2 LEU 536.A O no hydrogen 2.712 N/A ILE 542.A N CYS 539.A O no hydrogen 3.043 N/A THR 544.A OG1 GLN 135.A O no hydrogen 2.689 N/A TYR 546.A OH HIS 504.A O no hydrogen 2.764 N/A GLY 547.A N GLN 135.A OE1 no hydrogen 2.705 N/A ALA 548.A N GLN 135.A OE1 no hydrogen 3.126 N/A ASN 549.A ND2 GLN 404.A OE1 no hydrogen 2.754 N/A THR 553.A OG1 TYR 155.A OH no hydrogen 2.684 N/A ALA 554.A N PRO 550.A O no hydrogen 3.095 N/A MET 555.A N THR 551.A O no hydrogen 2.903 N/A SER 556.A N LEU 552.A O no hydrogen 2.825 N/A SER 556.A OG LEU 552.A O no hydrogen 2.922 N/A LEU 557.A N THR 553.A O no hydrogen 3.081 N/A ALA 558.A N ALA 554.A O no hydrogen 3.002 N/A ILE 559.A N MET 555.A O no hydrogen 2.951 N/A LYS 560.A N SER 556.A O no hydrogen 3.220 N/A LYS 560.A NZ GLU 150.A OE2 no hydrogen 2.812 N/A SER 561.A N LEU 557.A O no hydrogen 2.952 N/A SER 561.A OG TYR 17.A OH no hydrogen 2.834 N/A SER 561.A OG ASP 525.A O no hydrogen 3.022 N/A CYS 562.A N ALA 558.A O no hydrogen 3.057 N/A CYS 562.A SG ALA 558.A O no hydrogen 3.379 N/A GLU 563.A N ILE 559.A O no hydrogen 3.181 N/A GLU 563.A N LYS 560.A O no hydrogen 2.968 N/A TYR 564.A N LYS 560.A O no hydrogen 3.321 N/A ILE 565.A N SER 561.A O no hydrogen 3.084 N/A LYS 566.A N CYS 562.A O no hydrogen 2.920 N/A LYS 566.A NZ GLU 20.A OE1 no hydrogen 2.675 N/A GLN 567.A N GLU 563.A O no hydrogen 3.038 N/A ASN 568.A N ILE 565.A O no hydrogen 2.924 N/A ASN 568.A ND2 TYR 564.A O no hydrogen 2.828 N/A SER 572.A N ASP 4.A OD2 no hydrogen 2.829 N/A SER 572.A OG ASP 4.A OD1 no hydrogen 2.962 N/A SER 572.A OG ASP 4.A OD2 no hydrogen 3.033 N/A