Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4emd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N VAL 43.A O no hydrogen 2.937 N/A THR 4.A N GLN 298.A O no hydrogen 2.879 N/A THR 4.A OG1 THR 42.A OG1 no hydrogen 2.767 N/A VAL 5.A N VAL 41.A O no hydrogen 2.863 N/A ARG 6.A N GLN 295.A O no hydrogen 2.993 N/A ARG 6.A NE ASP 40.A OD1 no hydrogen 2.791 N/A ARG 6.A NH2 ASP 40.A OD2 no hydrogen 3.045 N/A ALA 7.A N ASP 39.A O no hydrogen 2.897 N/A GLY 9.A N LEU 37.A O no hydrogen 2.827 N/A LYS 10.A N MET 100.A O no hydrogen 3.057 N/A LYS 10.A NZ ASN 12.A OD1 no hydrogen 2.786 N/A LYS 10.A NZ GLY 99.A O no hydrogen 2.803 N/A VAL 11.A N HIS 33.A O no hydrogen 2.953 N/A ASN 12.A ND2 THR 30.A OG1 no hydrogen 2.912 N/A LEU 13.A N VAL 31.A O no hydrogen 2.802 N/A TYR 14.A OH ALA 198.A O no hydrogen 2.615 N/A LEU 15.A N GLY 220.A O no hydrogen 2.942 N/A ALA 16.A N THR 29.A O no hydrogen 2.852 N/A VAL 17.A N GLU 222.A OE1 no hydrogen 2.755 N/A GLY 18.A N GLU 27.A O no hydrogen 2.740 N/A ARG 21.A N TYR 25.A O no hydrogen 2.672 N/A ARG 21.A NE ASP 23.A OD1 no hydrogen 3.064 N/A ARG 21.A NE ASP 23.A OD2 no hydrogen 3.405 N/A ARG 21.A NH1 GLU 27.A OE1 no hydrogen 2.697 N/A ARG 21.A NH2 ASP 23.A OD2 no hydrogen 2.752 N/A GLY 24.A N ARG 21.A O no hydrogen 3.072 N/A TYR 25.A N ASP 23.A OD1 no hydrogen 3.275 N/A HIS 26.A NE2 ASP 186.A OD1 no hydrogen 2.795 N/A HIS 26.A NE2 ASP 186.A OD2 no hydrogen 2.789 N/A GLU 27.A N ASP 19.A O no hydrogen 2.932 N/A LEU 28.A N GLY 151.A O no hydrogen 2.824 N/A THR 29.A N ALA 16.A O no hydrogen 2.980 N/A THR 30.A N GLY 149.A O no hydrogen 2.860 N/A THR 30.A OG1 TYR 14.A O no hydrogen 2.687 N/A VAL 31.A N TYR 14.A O no hydrogen 2.825 N/A PHE 32.A N ALA 147.A O no hydrogen 2.851 N/A HIS 33.A N VAL 11.A O no hydrogen 2.999 N/A HIS 33.A ND1 THR 146.A OG1 no hydrogen 3.137 N/A ALA 34.A N GLY 145.A O no hydrogen 2.830 N/A VAL 35.A N GLY 9.A O no hydrogen 3.025 N/A SER 36.A N SER 288.A O no hydrogen 2.847 N/A SER 36.A OG SER 288.A O no hydrogen 3.430 N/A ASP 39.A N ALA 7.A O no hydrogen 2.968 N/A ASP 40.A N ASN 91.A O no hydrogen 2.998 N/A VAL 41.A N VAL 5.A O no hydrogen 2.786 N/A THR 42.A N PHE 89.A O no hydrogen 2.834 N/A THR 42.A OG1 THR 4.A OG1 no hydrogen 2.767 N/A VAL 43.A N VAL 3.A O no hydrogen 2.770 N/A ARG 44.A N SER 87.A O no hydrogen 3.053 N/A ALA 46.A N ASP 85.A O no hydrogen 3.047 N/A SER 50.A N VAL 86.A O no hydrogen 3.286 N/A ASP 52.A N ILE 88.A O no hydrogen 2.878 N/A VAL 53.A N ASP 52.A OD1 no hydrogen 3.028 N/A VAL 54.A N ILE 90.A O no hydrogen 2.964 N/A GLY 55.A N GLU 58.A OE1 no hydrogen 3.003 N/A GLN 56.A N LYS 92.A O no hydrogen 2.977 N/A GLU 58.A N GLY 55.A O no hydrogen 3.013 N/A THR 60.A N GLY 57.A O no hydrogen 2.828 N/A VAL 61.A N GLY 57.A O no hydrogen 2.906 N/A ARG 66.A N ASP 64.A OD1 no hydrogen 3.031 N/A ARG 66.A NE ASP 64.A OD1 no hydrogen 2.916 N/A ARG 66.A NE ASP 64.A OD2 no hydrogen 3.303 N/A ARG 66.A NH2 ASP 64.A OD2 no hydrogen 2.754 N/A ASN 67.A N ASP 64.A O no hydrogen 2.958 N/A ASN 67.A ND2 PRO 62.A O no hydrogen 2.902 N/A ALA 69.A N ASN 67.A OD1 no hydrogen 2.878 N/A TRP 70.A N ASN 67.A O no hydrogen 2.836 N/A TRP 70.A NE1 GLU 74.A OE2 no hydrogen 2.874 N/A GLN 71.A NE2.A GLU 65.A O no hydrogen 3.126 N/A GLN 71.A NE2.B GLU 65.A O no hydrogen 2.693 N/A ALA 72.A N LEU 68.A O no hydrogen 2.930 N/A ALA 73.A N ALA 69.A O no hydrogen 3.000 N/A GLU 74.A N TRP 70.A O no hydrogen 2.965 N/A LEU 75.A N GLN 71.A O no hydrogen 2.851 N/A PHE 76.A N ALA 72.A O no hydrogen 2.975 N/A ALA 77.A N ALA 73.A O no hydrogen 2.987 N/A ASP 78.A N GLU 74.A O no hydrogen 2.993 N/A HIS 79.A N LEU 75.A O no hydrogen 2.952 N/A VAL 80.A N PHE 76.A O no hydrogen 3.084 N/A VAL 80.A N ALA 77.A O no hydrogen 3.162 N/A GLY 81.A N ASP 78.A O no hydrogen 3.287 N/A ARG 82.A N ALA 77.A O no hydrogen 2.915 N/A ASP 85.A N ALA 83.A O no hydrogen 2.798 N/A VAL 86.A N PRO 84.A O no hydrogen 2.968 N/A SER 87.A N ARG 44.A O no hydrogen 2.875 N/A ILE 88.A N SER 50.A O no hydrogen 2.808 N/A PHE 89.A N THR 42.A O no hydrogen 2.828 N/A ILE 90.A N ASP 52.A O no hydrogen 2.796 N/A ASN 91.A N ASP 40.A O no hydrogen 2.845 N/A LYS 92.A N VAL 54.A O no hydrogen 2.904 N/A LYS 92.A NZ ASP 39.A OD2 no hydrogen 2.818 N/A LYS 92.A NZ ASP 106.A OD2 no hydrogen 3.010 N/A ASP 93.A N ALA 38.A O no hydrogen 3.304 N/A ASP 93.A N ASP 39.A OD1 no hydrogen 3.001 N/A ILE 94.A N ASP 39.A OD1 no hydrogen 2.966 N/A ALA 105.A N ALA 101.A O no hydrogen 2.995 N/A ASP 106.A N GLY 102.A O no hydrogen 3.028 N/A ALA 107.A N GLY 103.A O no hydrogen 2.911 N/A ALA 108.A N SER 104.A O no hydrogen 2.963 N/A ALA 109.A N ALA 105.A O no hydrogen 2.853 N/A VAL 110.A N ASP 106.A O no hydrogen 3.012 N/A LEU 111.A N ALA 107.A O no hydrogen 3.145 N/A VAL 112.A N ALA 108.A O no hydrogen 3.204 N/A ALA 113.A N ALA 109.A O no hydrogen 2.794 N/A MET 114.A N VAL 110.A O no hydrogen 2.860 N/A ASN 115.A N LEU 111.A O no hydrogen 3.059 N/A ASN 115.A ND2 VAL 122.A O no hydrogen 3.005 N/A GLU 116.A N VAL 112.A O no hydrogen 3.078 N/A LEU 117.A N ALA 113.A O no hydrogen 2.752 N/A TRP 118.A N MET 114.A O no hydrogen 2.964 N/A TRP 118.A NE1 ASP 45.A OD1 no hydrogen 3.190 N/A HIS 119.A N GLU 116.A O no hydrogen 3.125 N/A ALA 120.A N ASN 115.A O no hydrogen 2.921 N/A VAL 122.A N ASN 115.A OD1 no hydrogen 2.972 N/A ASP 126.A N PRO 123.A O no hydrogen 3.038 N/A LEU 127.A N PRO 123.A O no hydrogen 3.000 N/A HIS 128.A N ARG 124.A O no hydrogen 2.812 N/A HIS 129.A N ARG 125.A O no hydrogen 3.169 N/A LEU 130.A N ASP 126.A O no hydrogen 3.115 N/A ALA 131.A N LEU 127.A O no hydrogen 2.858 N/A ALA 132.A N HIS 128.A O no hydrogen 2.992 N/A GLN 133.A N HIS 129.A O no hydrogen 3.274 N/A LEU 134.A N LEU 130.A O no hydrogen 3.235 N/A LEU 134.A N ALA 131.A O no hydrogen 3.027 N/A GLY 135.A N ALA 131.A O no hydrogen 3.183 N/A VAL 138.A N GLY 135.A O no hydrogen 3.164 N/A ALA 141.A N ASP 137.A O no hydrogen 3.296 N/A LEU 142.A N VAL 138.A O no hydrogen 3.175 N/A HIS 143.A N PRO 139.A O no hydrogen 2.956 N/A HIS 143.A ND1 GLY 144.A O no hydrogen 2.809 N/A GLY 144.A N PHE 140.A O no hydrogen 2.726 N/A GLY 145.A N VAL 291.A O no hydrogen 2.853 N/A THR 146.A OG1 HIS 33.A ND1 no hydrogen 3.137 N/A ALA 147.A N PHE 32.A O no hydrogen 2.932 N/A LEU 148.A N ALA 157.A O no hydrogen 2.730 N/A GLY 149.A N THR 30.A O no hydrogen 2.703 N/A THR 150.A N GLN 155.A O no hydrogen 2.810 N/A ARG 152.A N GLU 154.A OE1 no hydrogen 2.869 N/A ARG 152.A NH2 ALA 132.A O no hydrogen 2.758 N/A GLY 153.A N THR 150.A O no hydrogen 2.882 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.683 N/A GLN 155.A N THR 150.A O no hydrogen 3.296 N/A GLN 155.A NE2 GLU 154.A OE2 no hydrogen 3.512 N/A ALA 157.A N LEU 148.A O no hydrogen 2.894 N/A THR 158.A OG1 HIS 143.A NE2 no hydrogen 2.804 N/A VAL 159.A N THR 146.A O no hydrogen 3.005 N/A ARG 162.A N LEU 207.A O no hydrogen 2.937 N/A ASN 163.A N ALA 161.A O no hydrogen 2.924 N/A ASN 163.A ND2 GLY 210.A O no hydrogen 2.875 N/A VAL 164.A N ASN 163.A OD1 no hydrogen 2.775 N/A PHE 165.A N GLY 289.A O no hydrogen 2.784 N/A TRP 167.A N ALA 287.A O no hydrogen 2.932 N/A TRP 167.A NE1 HIS 33.A NE2 no hydrogen 3.112 N/A VAL 168.A N PHE 260.A O no hydrogen 2.962 N/A PHE 169.A N ARG 285.A O no hydrogen 2.821 N/A ALA 170.A N CYS 258.A O no hydrogen 2.823 N/A PHE 171.A N THR 283.A O no hydrogen 2.832 N/A LEU 176.A N ALA 97.A O no hydrogen 2.969 N/A THR 178.A OG1 SER 254.A OG no hydrogen 2.971 N/A VAL 181.A N ALA 177.A O no hydrogen 3.243 N/A PHE 182.A N THR 178.A O no hydrogen 3.146 N/A LYS 183.A N PRO 179.A O no hydrogen 2.952 N/A GLU 184.A N GLN 180.A O no hydrogen 2.886 N/A ILE 185.A N VAL 181.A O no hydrogen 2.945 N/A ASP 186.A N PHE 182.A O no hydrogen 3.199 N/A ARG 187.A N LYS 183.A O no hydrogen 2.922 N/A ARG 187.A NE.A GLU 184.A OE1 no hydrogen 2.899 N/A ARG 187.A NE.A GLU 184.A OE2 no hydrogen 3.422 N/A ARG 187.A NE.B GLU 184.A OE1 no hydrogen 2.606 N/A ARG 187.A NH1.B GLU 184.A OE1 no hydrogen 3.063 N/A ARG 187.A NH2.A GLU 184.A OE2 no hydrogen 2.739 N/A LEU 188.A N GLU 184.A O no hydrogen 2.868 N/A ARG 189.A N ILE 185.A O no hydrogen 3.004 N/A ARG 189.A NH1 VAL 17.A O no hydrogen 2.805 N/A ARG 189.A NH2 VAL 17.A O no hydrogen 3.353 N/A ARG 189.A NH2 GLU 222.A OE1 no hydrogen 2.830 N/A GLU 190.A N ASP 186.A O no hydrogen 2.928 N/A ASN 191.A N ARG 187.A O no hydrogen 3.020 N/A ASN 191.A ND2.A ARG 187.A O no hydrogen 2.999 N/A GLY 192.A N LEU 188.A O no hydrogen 2.946 N/A LEU 197.A N GLU 222.A OE2 no hydrogen 2.781 N/A LEU 204.A N ALA 200.A O no hydrogen 2.930 N/A GLY 205.A N ASP 201.A O no hydrogen 2.888 N/A ALA 206.A N GLU 202.A O no hydrogen 2.960 N/A LEU 207.A N LEU 203.A O no hydrogen 3.064 N/A ALA 208.A N LEU 204.A O no hydrogen 3.033 N/A ALA 209.A N GLY 205.A O no hydrogen 2.961 N/A GLY 210.A N LEU 207.A O no hydrogen 2.905 N/A ASP 211.A N ALA 206.A O no hydrogen 3.080 N/A ARG 214.A N ASP 211.A OD1 no hydrogen 3.039 N/A LEU 215.A N ASP 211.A O no hydrogen 2.918 N/A ALA 216.A N ALA 212.A O no hydrogen 3.007 N/A LEU 218.A N LEU 215.A O no hydrogen 2.888 N/A LEU 219.A N ALA 216.A O no hydrogen 3.209 N/A GLY 220.A N LEU 13.A O no hydrogen 3.007 N/A ASN 221.A ND2 VAL 251.A O no hydrogen 2.852 N/A ASN 221.A ND2 GLY 253.A O no hydrogen 2.875 N/A GLU 222.A N LEU 15.A O no hydrogen 2.778 N/A LEU 223.A N ASN 221.A OD1 no hydrogen 2.848 N/A GLN 224.A N ASN 221.A O no hydrogen 2.935 N/A ALA 227.A N LEU 223.A O no hydrogen 2.929 N/A VAL 228.A N GLN 224.A O no hydrogen 2.791 N/A SER 229.A N ALA 225.A O no hydrogen 2.979 N/A SER 229.A OG GLU 184.A OE2 no hydrogen 2.536 N/A LEU 230.A N ALA 226.A O no hydrogen 3.090 N/A ASN 231.A N ALA 227.A O no hydrogen 2.752 N/A GLU 233.A N GLU 233.A OE1 no hydrogen 2.816 N/A LEU 234.A N ASN 231.A O no hydrogen 3.007 N/A ARG 235.A N PRO 232.A O no hydrogen 3.117 N/A ARG 235.A NE PRO 232.A O no hydrogen 3.098 N/A ARG 236.A N GLU 233.A O no hydrogen 2.982 N/A THR 237.A OG1 VAL 280.A O no hydrogen 2.842 N/A LEU 238.A N LEU 234.A O no hydrogen 2.974 N/A ARG 239.A N ARG 235.A O no hydrogen 2.932 N/A ALA 240.A N ARG 236.A O no hydrogen 2.924 N/A GLY 241.A N THR 237.A O no hydrogen 3.074 N/A GLU 242.A N LEU 238.A O no hydrogen 3.074 N/A SER 243.A N ARG 239.A O no hydrogen 2.911 N/A SER 243.A OG.A ARG 239.A O no hydrogen 3.059 N/A SER 243.A OG.B ARG 239.A O no hydrogen 3.161 N/A SER 243.A OG.B ALA 240.A O no hydrogen 2.988 N/A ALA 244.A N ALA 240.A O no hydrogen 2.957 N/A GLY 245.A N GLU 242.A O no hydrogen 2.983 N/A ALA 246.A N GLY 241.A O no hydrogen 3.164 N/A LEU 247.A N LEU 261.A O no hydrogen 2.881 N/A ILE 250.A N ALA 259.A O no hydrogen 2.883 N/A VAL 251.A N GLN 224.A OE1 no hydrogen 2.873 N/A SER 252.A N THR 257.A O no hydrogen 2.870 N/A SER 252.A OG LYS 10.A O no hydrogen 3.413 N/A SER 252.A OG GLY 99.A O no hydrogen 2.969 N/A SER 254.A OG THR 178.A OG1 no hydrogen 2.971 N/A GLY 255.A N SER 252.A O no hydrogen 2.742 N/A THR 257.A N GLY 98.A O no hydrogen 3.092 N/A THR 257.A OG1 GLY 98.A O no hydrogen 2.694 N/A CYS 258.A N ALA 170.A O no hydrogen 3.096 N/A CYS 258.A SG PRO 256.A O no hydrogen 3.996 N/A ALA 259.A N ILE 250.A O no hydrogen 2.766 N/A PHE 260.A N VAL 168.A O no hydrogen 2.828 N/A LEU 261.A N ALA 248.A O no hydrogen 3.036 N/A CYS 262.A N HIS 166.A O no hydrogen 2.833 N/A CYS 262.A SG PHE 260.A O no hydrogen 3.870 N/A THR 263.A N ASP 267.A OD2 no hydrogen 2.759 N/A ASP 267.A N SER 264.A OG no hydrogen 3.072 N/A ALA 268.A N SER 264.A O no hydrogen 3.087 N/A VAL 269.A N ALA 265.A O no hydrogen 3.086 N/A GLN 270.A N ASP 266.A O no hydrogen 3.163 N/A VAL 271.A N ASP 267.A O no hydrogen 2.773 N/A SER 272.A N ALA 268.A O no hydrogen 2.876 N/A SER 272.A OG ALA 268.A O no hydrogen 2.773 N/A SER 272.A OG VAL 269.A O no hydrogen 2.952 N/A ALA 273.A N VAL 269.A O no hydrogen 3.266 N/A GLU 274.A N GLN 270.A O no hydrogen 3.060 N/A LEU 275.A N VAL 271.A O no hydrogen 2.935 N/A ALA 276.A N SER 272.A O no hydrogen 2.908 N/A GLY 277.A N ALA 273.A O no hydrogen 3.140 N/A ALA 278.A N LEU 275.A O no hydrogen 3.101 N/A CYS 281.A SG THR 283.A O no hydrogen 3.817 N/A ARG 282.A N PHE 171.A O no hydrogen 2.772 N/A ARG 282.A NE ALA 172.A O no hydrogen 3.099 N/A ARG 282.A NH2 GLN 56.A OE1 no hydrogen 2.983 N/A ARG 285.A N PHE 169.A O no hydrogen 2.847 N/A ARG 285.A NH1 THR 283.A OG1 no hydrogen 2.820 N/A ARG 285.A NH1 VAL 284.A O no hydrogen 2.908 N/A ALA 287.A N TRP 167.A O no hydrogen 3.056 N/A SER 288.A N SER 36.A OG no hydrogen 2.898 N/A GLY 289.A N PHE 165.A O no hydrogen 2.930 N/A VAL 291.A N ALA 34.A O no hydrogen 3.013 N/A ALA 294.A N ALA 141.A O no hydrogen 3.021 N/A GLN 295.A N ARG 6.A O no hydrogen 3.084 N/A GLN 295.A NE2 HIS 292.A ND1 no hydrogen 2.807 N/A ILE 297.A N THR 4.A O no hydrogen 2.860 N/A GLN 298.A N THR 4.A O no hydrogen 3.455 N/A