Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4p16_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N LEU 20.A O no hydrogen 2.847 N/A GLU 5.A N ASN 50.A OD1 no hydrogen 2.797 N/A VAL 6.A N VAL 18.A O no hydrogen 2.839 N/A LEU 7.A N HIS 52.A O no hydrogen 2.876 N/A VAL 8.A N ARG 16.A O no hydrogen 2.719 N/A THR 9.A N LEU 54.A O no hydrogen 3.105 N/A THR 9.A OG1 ASN 14.A O no hydrogen 2.740 N/A ASP 11.A N THR 9.A OG1 no hydrogen 3.062 N/A GLY 12.A N THR 9.A OG1 no hydrogen 2.879 N/A VAL 13.A N ASP 11.A OD1 no hydrogen 2.929 N/A ASN 14.A N ASP 11.A OD1 no hydrogen 2.932 N/A ASN 14.A ND2 ASP 11.A OD2 no hydrogen 2.779 N/A ARG 16.A N VAL 8.A O no hydrogen 2.830 N/A ARG 16.A NE GLU 64.A OE1 no hydrogen 3.102 N/A ARG 16.A NE GLU 64.A OE2 no hydrogen 2.853 N/A ARG 16.A NH2 GLU 64.A OE1 no hydrogen 3.150 N/A VAL 18.A N VAL 6.A O no hydrogen 2.907 N/A LEU 20.A N ILE 4.A O no hydrogen 2.741 N/A ASN 21.A N GLN 29.A OE1 no hydrogen 2.807 N/A LYS 23.A N ASN 21.A OD1 no hydrogen 2.849 N/A TYR 26.A N THR 43.A O no hydrogen 2.970 N/A TYR 26.A OH GLN 49.A OE1 no hydrogen 2.888 N/A ARG 27.A N SER 41.A O no hydrogen 2.782 N/A ARG 27.A NE ASP 42.A OD1 no hydrogen 3.246 N/A SER 28.A N THR 25.A OG1 no hydrogen 3.187 N/A GLN 29.A N THR 25.A O no hydrogen 3.211 N/A GLN 29.A NE2 ASN 21.A O no hydrogen 2.881 N/A GLN 29.A NE2 ASN 24.A O no hydrogen 3.458 N/A LEU 30.A N TYR 26.A O no hydrogen 2.778 N/A GLY 31.A N TYR 26.A O no hydrogen 2.933 N/A CYS 32.A N ASP 58.A OD1 no hydrogen 2.752 N/A CYS 32.A SG ASP 39.A OD2 no hydrogen 3.541 N/A CYS 32.A SG SER 41.A OG no hydrogen 3.638 N/A VAL 33.A N SER 41.A OG no hydrogen 2.958 N/A PHE 34.A N TYR 55.A O no hydrogen 2.863 N/A PHE 35.A N ALA 38.A O no hydrogen 2.790 N/A ALA 38.A N PHE 35.A O no hydrogen 3.088 N/A ILE 40.A N VAL 33.A O no hydrogen 2.888 N/A SER 41.A N ASP 39.A OD1 no hydrogen 2.915 N/A SER 41.A OG ASP 39.A OD1 no hydrogen 2.683 N/A THR 43.A N ILE 40.A O no hydrogen 2.970 N/A THR 43.A OG1 ILE 40.A O no hydrogen 2.700 N/A ASP 46.A N GLN 49.A OE1 no hydrogen 2.824 N/A GLN 49.A N ASP 46.A O no hydrogen 2.750 N/A ASN 50.A N GLU 47.A O no hydrogen 3.457 N/A GLY 51.A N GLU 5.A O no hydrogen 2.732 N/A HIS 52.A N GLN 49.A O no hydrogen 3.335 N/A LEU 54.A N LEU 7.A O no hydrogen 2.766 N/A TYR 55.A N PHE 34.A O no hydrogen 2.864 N/A LEU 56.A N THR 9.A O no hydrogen 3.255 N/A ALA 57.A N CYS 32.A O no hydrogen 2.968 N/A THR 61.A N GLU 64.A OE1 no hydrogen 2.893 N/A THR 61.A OG1 GLU 64.A OE1 no hydrogen 3.294 N/A GLU 64.A N THR 61.A OG1 no hydrogen 3.045 N/A THR 65.A N THR 61.A O no hydrogen 2.826 N/A THR 65.A OG1 THR 61.A O no hydrogen 3.057 N/A LYS 66.A N ALA 62.A O no hydrogen 2.977 N/A ALA 67.A N ASP 63.A O no hydrogen 3.127 N/A LEU 68.A N GLU 64.A O no hydrogen 2.991 N/A LYS 69.A N THR 65.A O no hydrogen 3.160 N/A GLU 70.A N LYS 66.A O no hydrogen 3.074 N/A LEU 71.A N ALA 67.A O no hydrogen 2.989 N/A TYR 72.A N LEU 68.A O no hydrogen 2.939 N/A THR 78.A N ASP 76.A OD1 no hydrogen 2.985 N/A THR 78.A OG1 ASP 76.A OD1 no hydrogen 2.688 N/A PHE 79.A N ASP 76.A O no hydrogen 3.159 N/A ARG 82.A N THR 78.A O no hydrogen 2.923 N/A ARG 82.A NE THR 78.A OG1 no hydrogen 2.990 N/A ARG 82.A NH1 ALA 153.A O no hydrogen 2.818 N/A ARG 82.A NH2 ASP 76.A OD2 no hydrogen 2.790 N/A PHE 83.A N PHE 79.A O no hydrogen 2.744 N/A TYR 84.A N LEU 80.A O no hydrogen 2.790 N/A SER 85.A N HIS 81.A O no hydrogen 2.999 N/A SER 85.A OG HIS 81.A O no hydrogen 2.633 N/A LEU 86.A N ARG 82.A O no hydrogen 2.744 N/A LYS 87.A N PHE 83.A O no hydrogen 2.817 N/A ALA 88.A N TYR 84.A O no hydrogen 3.155 N/A ALA 89.A N SER 85.A O no hydrogen 2.946 N/A VAL 90.A N LEU 86.A O no hydrogen 2.922 N/A HIS 91.A N ALA 88.A O no hydrogen 3.432 N/A TRP 93.A N VAL 90.A O no hydrogen 2.931 N/A TRP 93.A NE1 ASP 108.A OD2 no hydrogen 2.813 N/A VAL 96.A N SER 103.A O no hydrogen 2.801 N/A CYS 98.A N VAL 101.A O no hydrogen 2.800 N/A VAL 101.A N CYS 98.A O no hydrogen 3.091 N/A ARG 102.A NH1 HIS 139.A O no hydrogen 2.707 N/A ARG 102.A NH2 GLY 142.A O no hydrogen 3.561 N/A SER 103.A N VAL 96.A O no hydrogen 2.840 N/A SER 103.A OG ASN 113.A OD1 no hydrogen 3.025 N/A LEU 104.A N ASN 113.A OD1 no hydrogen 2.875 N/A LYS 105.A N LYS 94.A O no hydrogen 2.773 N/A SER 107.A N ASN 110.A OD1 no hydrogen 3.005 N/A SER 107.A OG ASP 108.A OD2 no hydrogen 2.999 N/A ASN 109.A ND2 GLY 160.A O no hydrogen 2.938 N/A ASN 110.A N SER 107.A O no hydrogen 3.107 N/A ASN 110.A ND2 LYS 105.A O no hydrogen 2.953 N/A LEU 112.A N ASN 110.A O no hydrogen 2.852 N/A ASN 113.A N ASN 110.A O no hydrogen 3.320 N/A ASN 113.A ND2 PHE 287.A O no hydrogen 3.401 N/A VAL 115.A N TYR 111.A O no hydrogen 2.983 N/A ILE 116.A N LEU 112.A O no hydrogen 2.804 N/A MET 117.A N ASN 113.A O no hydrogen 2.926 N/A THR 118.A N ALA 114.A O no hydrogen 3.038 N/A THR 118.A OG1 ALA 114.A O no hydrogen 2.624 N/A THR 118.A OG1 HIS 276.A ND1 no hydrogen 3.227 N/A LEU 119.A N VAL 115.A O no hydrogen 2.917 N/A ASP 120.A N ILE 116.A O no hydrogen 2.956 N/A LEU 121.A N THR 118.A O no hydrogen 3.080 N/A LEU 122.A N LEU 119.A O no hydrogen 3.055 N/A LYS 126.A N GLU 177.A O no hydrogen 3.123 N/A PHE 127.A N GLN 133.A OE1 no hydrogen 2.746 N/A VAL 128.A N LYS 175.A O no hydrogen 2.888 N/A ALA 131.A N LEU 71.A O no hydrogen 2.998 N/A LEU 132.A N ILE 129.A O no hydrogen 2.972 N/A GLN 133.A N ILE 129.A O no hydrogen 3.116 N/A HIS 134.A N PRO 130.A O no hydrogen 2.908 N/A ALA 135.A N ALA 131.A O no hydrogen 3.137 N/A PHE 136.A N LEU 132.A O no hydrogen 2.850 N/A MET 137.A N GLN 133.A O no hydrogen 2.923 N/A LYS 138.A N HIS 134.A O no hydrogen 2.940 N/A LYS 138.A NZ ASP 146.A OD2 no hydrogen 3.303 N/A HIS 139.A N ALA 135.A O no hydrogen 2.938 N/A HIS 139.A ND1 SER 144.A OG no hydrogen 2.682 N/A HIS 139.A NE2 ASP 120.A OD1 no hydrogen 2.733 N/A LYS 140.A N PHE 136.A O no hydrogen 2.995 N/A GLY 141.A N MET 137.A O no hydrogen 3.207 N/A GLY 142.A N HIS 139.A O no hydrogen 3.182 N/A ASP 143.A N LYS 138.A O no hydrogen 2.867 N/A SER 144.A OG HIS 139.A ND1 no hydrogen 2.682 N/A THR 145.A OG1 ASP 143.A OD1 no hydrogen 3.449 N/A ILE 148.A N SER 144.A O no hydrogen 2.906 N/A ALA 149.A N THR 145.A O no hydrogen 3.037 N/A LEU 150.A N ASP 146.A O no hydrogen 2.924 N/A ILE 151.A N PHE 147.A O no hydrogen 2.994 N/A MET 152.A N ILE 148.A O no hydrogen 3.019 N/A ALA 153.A N ALA 149.A O no hydrogen 2.823 N/A TYR 154.A N LEU 150.A O no hydrogen 2.842 N/A TYR 154.A OH TYR 72.A O no hydrogen 2.805 N/A GLY 155.A N ILE 151.A O no hydrogen 2.795 N/A ASN 156.A N ALA 153.A O no hydrogen 3.409 N/A CYS 157.A N MET 152.A O no hydrogen 2.837 N/A CYS 157.A SG ASP 163.A OD2 no hydrogen 3.302 N/A ALA 161.A N THR 158.A O no hydrogen 3.061 N/A ASP 164.A N ASP 163.A OD1 no hydrogen 2.842 N/A ALA 165.A N TYR 274.A OH no hydrogen 3.318 N/A SER 166.A N ASP 164.A OD2 no hydrogen 3.144 N/A SER 166.A OG ASP 304.A OD1 no hydrogen 2.674 N/A ARG 167.A N ASP 164.A OD1 no hydrogen 3.220 N/A ARG 167.A NE ASP 163.A OD1 no hydrogen 3.197 N/A ARG 167.A NH1 GLY 155.A O no hydrogen 2.915 N/A ARG 167.A NH1 ASP 163.A OD1 no hydrogen 2.912 N/A ARG 167.A NH1 ASP 163.A OD2 no hydrogen 3.015 N/A ARG 167.A NH2 GLY 155.A O no hydrogen 2.888 N/A LEU 168.A N ASP 164.A O no hydrogen 3.129 N/A LEU 169.A N ALA 165.A O no hydrogen 2.818 N/A HIS 170.A N SER 166.A O no hydrogen 3.107 N/A HIS 170.A NE2 SER 246.A OG no hydrogen 3.081 N/A THR 171.A N ARG 167.A O no hydrogen 3.058 N/A THR 171.A OG1 ARG 167.A O no hydrogen 2.634 N/A VAL 172.A N LEU 168.A O no hydrogen 2.887 N/A LEU 173.A N LEU 169.A O no hydrogen 2.840 N/A ALA 174.A N THR 171.A O no hydrogen 3.298 N/A LYS 175.A N VAL 172.A O no hydrogen 2.967 N/A ALA 176.A N LEU 173.A O no hydrogen 3.267 N/A GLU 177.A N LYS 126.A O no hydrogen 2.830 N/A CYS 179.A N ASP 124.A O no hydrogen 2.803 N/A CYS 179.A SG ASP 124.A O no hydrogen 3.356 N/A ARG 183.A N THR 239.A O no hydrogen 2.798 N/A ARG 183.A NE GLU 237.A OE1 no hydrogen 3.473 N/A MET 184.A N LEU 200.A O no hydrogen 2.824 N/A VAL 185.A N GLU 237.A O no hydrogen 2.820 N/A TRP 186.A N VAL 198.A O no hydrogen 3.028 N/A ARG 187.A N GLN 234.A O no hydrogen 2.863 N/A ARG 187.A NE ASP 197.A OD1 no hydrogen 2.917 N/A ARG 187.A NH2 ASP 197.A OD2 no hydrogen 3.194 N/A GLU 188.A N LYS 196.A O no hydrogen 2.844 N/A TRP 189.A N HIS 232.A O no hydrogen 2.875 N/A CYS 190.A N GLY 194.A O no hydrogen 3.162 N/A CYS 190.A SG GLU 230.A O no hydrogen 3.835 N/A GLY 194.A N CYS 190.A O no hydrogen 3.032 N/A LYS 196.A N GLU 188.A O no hydrogen 2.808 N/A VAL 198.A N TRP 186.A O no hydrogen 2.939 N/A LEU 200.A N MET 184.A O no hydrogen 2.799 N/A GLY 202.A N ALA 182.A O no hydrogen 3.335 N/A ALA 205.A N GLY 202.A O no hydrogen 3.344 N/A CYS 206.A N LEU 203.A O no hydrogen 2.959 N/A CYS 206.A SG GLY 202.A O no hydrogen 3.673 N/A CYS 206.A SG TRP 242.A O no hydrogen 3.871 N/A CYS 207.A SG LEU 203.A O no hydrogen 3.359 N/A TYR 208.A N LEU 244.A O no hydrogen 2.847 N/A GLY 210.A N SER 246.A O no hydrogen 2.930 N/A GLN 212.A NE2 THR 248.A O no hydrogen 3.288 N/A GLN 212.A NE2 VAL 302.A O no hydrogen 2.827 N/A GLN 212.A NE2 THR 303.A O no hydrogen 2.972 N/A ASP 216.A N THR 213.A OG1 no hydrogen 2.975 N/A LEU 217.A N THR 213.A O no hydrogen 3.020 N/A ARG 218.A N VAL 214.A O no hydrogen 2.968 N/A MET 221.A N ARG 233.A O no hydrogen 2.813 N/A THR 222.A OG1 HIS 232.A ND1 no hydrogen 2.993 N/A TYR 223.A N ARG 231.A O no hydrogen 2.871 N/A CYS 225.A N GLY 229.A O no hydrogen 3.040 N/A GLY 228.A N CYS 225.A O no hydrogen 3.081 N/A ARG 231.A N TYR 223.A O no hydrogen 2.759 N/A HIS 232.A N TRP 189.A O no hydrogen 2.805 N/A HIS 232.A ND1 THR 222.A OG1 no hydrogen 2.993 N/A ARG 233.A N MET 221.A O no hydrogen 2.850 N/A ARG 233.A NH2 TYR 208.A OH no hydrogen 3.174 N/A GLN 234.A N ARG 187.A O no hydrogen 2.898 N/A GLN 234.A NE2 ARG 218.A O no hydrogen 3.406 N/A VAL 236.A N VAL 185.A O no hydrogen 2.746 N/A GLU 237.A N VAL 185.A O no hydrogen 3.316 N/A HIS 238.A N TYR 312.A O no hydrogen 3.083 N/A HIS 238.A NE2 ALA 205.A O no hydrogen 2.781 N/A THR 239.A N ARG 183.A O no hydrogen 3.072 N/A THR 240.A N GLN 310.A O no hydrogen 3.088 N/A THR 240.A OG1 TRP 242.A O no hydrogen 2.738 N/A TRP 242.A NE1 LYS 123.A O no hydrogen 3.057 N/A LEU 243.A N PHE 307.A O no hydrogen 2.814 N/A LEU 244.A N CYS 206.A O no hydrogen 2.679 N/A LEU 245.A N VAL 305.A O no hydrogen 3.010 N/A SER 246.A N TYR 208.A O no hydrogen 2.809 N/A SER 246.A OG HIS 170.A NE2 no hydrogen 3.081 N/A SER 246.A OG ASP 304.A OD1 no hydrogen 2.689 N/A GLY 247.A N THR 303.A O no hydrogen 3.104 N/A ASN 250.A N VAL 302.A O no hydrogen 2.927 N/A ASN 250.A ND2 GLN 212.A OE1 no hydrogen 2.765 N/A LYS 252.A N CYS 300.A O no hydrogen 3.047 N/A VAL 254.A N TRP 298.A O no hydrogen 2.761 N/A THR 255.A OG1 SER 257.A OG no hydrogen 3.039 N/A THR 255.A OG1 ASP 297.A OD2 no hydrogen 2.731 N/A THR 256.A N SER 296.A O no hydrogen 2.905 N/A THR 256.A OG1 GLY 282.A O no hydrogen 3.003 N/A THR 256.A OG1 SER 296.A O no hydrogen 2.879 N/A SER 257.A OG THR 255.A OG1 no hydrogen 3.039 N/A ALA 259.A N THR 256.A O no hydrogen 2.913 N/A VAL 263.A N LEU 306.A O no hydrogen 2.893 N/A PHE 265.A N ALA 277.A O no hydrogen 2.888 N/A ASN 266.A N ASP 304.A O no hydrogen 2.763 N/A ASN 266.A ND2 THR 118.A OG1 no hydrogen 2.803 N/A ASN 266.A ND2 ASP 304.A OD2 no hydrogen 2.868 N/A VAL 267.A N VAL 275.A O no hydrogen 2.937 N/A PHE 268.A N LYS 301.A O no hydrogen 3.047 N/A GLN 269.A N HIS 273.A O no hydrogen 2.916 N/A VAL 275.A N VAL 267.A O no hydrogen 2.984 N/A HIS 276.A N PHE 287.A O no hydrogen 3.095 N/A HIS 276.A ND1 ASN 266.A OD1 no hydrogen 2.789 N/A ALA 277.A N PHE 265.A O no hydrogen 2.817 N/A ARG 278.A N LEU 285.A O no hydrogen 2.883 N/A ARG 278.A NE HIS 276.A NE2 no hydrogen 2.939 N/A ARG 278.A NH2 MET 117.A O no hydrogen 2.893 N/A LEU 279.A N VAL 263.A O no hydrogen 2.749 N/A LYS 280.A N LEU 283.A O no hydrogen 2.897 N/A LEU 283.A N LYS 280.A O no hydrogen 3.168 N/A ILE 284.A N THR 295.A O no hydrogen 2.773 N/A LEU 285.A N ARG 278.A O no hydrogen 2.821 N/A LYS 286.A N SER 293.A O no hydrogen 2.793 N/A PHE 287.A N HIS 276.A O no hydrogen 2.795 N/A ASP 288.A N THR 291.A O no hydrogen 2.798 N/A GLY 290.A N SER 103.A OG no hydrogen 2.920 N/A THR 291.A OG1 GLY 290.A O no hydrogen 2.994 N/A SER 293.A N LYS 286.A O no hydrogen 2.901 N/A THR 295.A N ILE 284.A O no hydrogen 3.085 N/A THR 295.A OG1 ASP 297.A O no hydrogen 2.961 N/A ASP 297.A N THR 295.A OG1 no hydrogen 3.423 N/A TRP 298.A N VAL 254.A O no hydrogen 2.752 N/A CYS 300.A N LYS 252.A O no hydrogen 3.161 N/A CYS 300.A SG TRP 298.A O no hydrogen 3.656 N/A VAL 302.A N ASN 250.A O no hydrogen 3.042 N/A VAL 302.A N CYS 300.A O no hydrogen 3.000 N/A THR 303.A N ASN 266.A O no hydrogen 3.086 N/A ASP 304.A N THR 303.A OG1 no hydrogen 2.771 N/A VAL 305.A N LEU 245.A O no hydrogen 2.857 N/A LEU 306.A N ALA 264.A O no hydrogen 2.816 N/A PHE 307.A N LEU 243.A O no hydrogen 2.742 N/A GLN 310.A N THR 240.A O no hydrogen 2.960 N/A GLN 310.A N THR 240.A OG1 no hydrogen 3.152 N/A GLN 310.A NE2 PRO 308.A O no hydrogen 2.773 N/A TYR 312.A N HIS 238.A O no hydrogen 2.799 N/A SER 314.A N VAL 236.A O no hydrogen 2.821 N/A