Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4w8d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 5.A N LEU 2.A O no hydrogen 3.058 N/A GLN 6.A N SER 80.A O no hydrogen 2.733 N/A LYS 9.A N ASN 7.A OD1 no hydrogen 2.980 N/A ALA 10.A N ASN 7.A O no hydrogen 3.136 N/A GLU 13.A N ASP 11.A OD2 no hydrogen 3.075 N/A GLU 14.A N ASP 11.A O no hydrogen 2.929 N/A LEU 15.A N ASP 11.A O no hydrogen 3.091 N/A PHE 16.A N PRO 12.A O no hydrogen 2.837 N/A THR 17.A N ILE 34.A O no hydrogen 2.880 N/A THR 17.A OG1 ASN 36.A OD1 no hydrogen 2.601 N/A LEU 19.A N LYS 32.A O no hydrogen 2.821 N/A GLU 20.A N GLU 20.A OE2 no hydrogen 2.897 N/A LYS 21.A NZ GLU 29.A OE2 no hydrogen 2.808 N/A ILE 22.A N VAL 30.A O no hydrogen 2.797 N/A GLY 23.A N VAL 30.A O no hydrogen 3.316 N/A GLY 25.A N GLY 28.A O no hydrogen 2.974 N/A SER 26.A N ASP 154.A OD1 no hydrogen 3.027 N/A SER 26.A OG GLU 62.A OE1 no hydrogen 3.292 N/A SER 26.A OG ASP 154.A OD1 no hydrogen 3.400 N/A SER 26.A OG ASP 154.A OD2 no hydrogen 2.766 N/A VAL 30.A N GLY 23.A O no hydrogen 2.831 N/A PHE 31.A N ILE 44.A O no hydrogen 2.790 N/A LYS 32.A N GLU 20.A O no hydrogen 2.862 N/A GLY 33.A N VAL 42.A O no hydrogen 2.901 N/A ILE 34.A N THR 17.A O no hydrogen 2.865 N/A ASP 35.A N LYS 40.A O no hydrogen 2.874 N/A ASN 36.A N LEU 15.A O no hydrogen 2.843 N/A ASN 36.A ND2 GLU 14.A O no hydrogen 2.747 N/A ARG 37.A N ASP 35.A OD1 no hydrogen 2.881 N/A THR 38.A N ASP 35.A OD1 no hydrogen 3.136 N/A GLN 39.A N ASP 35.A O no hydrogen 2.787 N/A LYS 40.A N THR 38.A OG1 no hydrogen 3.236 N/A VAL 42.A N GLY 33.A O no hydrogen 2.862 N/A ALA 43.A N MET 91.A O no hydrogen 2.771 N/A ILE 44.A N PHE 31.A O no hydrogen 2.764 N/A LYS 45.A N ILE 89.A O no hydrogen 2.915 N/A LYS 45.A NZ SER 26.A O no hydrogen 2.708 N/A LYS 45.A NZ GLU 62.A OE1 no hydrogen 2.686 N/A LYS 45.A NZ GLU 62.A OE2 no hydrogen 3.128 N/A ILE 46.A N GLU 29.A O no hydrogen 2.917 N/A ILE 47.A N LEU 87.A O no hydrogen 2.883 N/A LEU 49.A N THR 85.A O no hydrogen 2.961 N/A GLU 50.A N ASP 48.A OD1 no hydrogen 3.290 N/A ALA 52.A N LEU 49.A O no hydrogen 3.445 N/A GLU 57.A N GLU 57.A OE2 no hydrogen 2.833 N/A ILE 59.A N GLU 55.A O no hydrogen 2.797 N/A GLN 60.A N ILE 56.A O no hydrogen 2.790 N/A GLN 61.A N GLU 57.A O no hydrogen 3.047 N/A GLU 62.A N ASP 58.A O no hydrogen 2.937 N/A ILE 63.A N ILE 59.A O no hydrogen 3.169 N/A THR 64.A N GLN 60.A O no hydrogen 2.932 N/A THR 64.A OG1 GLN 60.A O no hydrogen 2.797 N/A VAL 65.A N GLN 61.A O no hydrogen 3.007 N/A LEU 66.A N GLU 62.A O no hydrogen 3.013 N/A SER 67.A N ILE 63.A O no hydrogen 2.964 N/A SER 67.A OG ILE 63.A O no hydrogen 3.342 N/A SER 67.A OG THR 64.A O no hydrogen 2.670 N/A GLN 68.A N THR 64.A O no hydrogen 3.141 N/A GLN 68.A N VAL 65.A O no hydrogen 3.145 N/A CYS 69.A N LEU 66.A O no hydrogen 3.074 N/A CYS 69.A SG VAL 65.A O no hydrogen 3.322 N/A ASP 70.A N TYR 126.A OH no hydrogen 2.920 N/A TYR 73.A N SER 71.A OG no hydrogen 3.002 N/A VAL 74.A N SER 71.A O no hydrogen 3.346 N/A THR 75.A N LEU 152.A O no hydrogen 3.040 N/A LYS 76.A N GLU 92.A OE2 no hydrogen 2.956 N/A LYS 76.A NZ ASP 70.A OD1 no hydrogen 2.649 N/A TYR 77.A OH PRO 3.A O no hydrogen 2.601 N/A TYR 77.A OH SER 80.A OG no hydrogen 2.672 N/A TYR 78.A N ILE 90.A O no hydrogen 2.834 N/A SER 80.A N GLY 4.A O no hydrogen 2.991 N/A SER 80.A OG TYR 77.A OH no hydrogen 2.672 N/A TYR 81.A N TRP 88.A O no hydrogen 2.926 N/A LYS 83.A N LYS 86.A O no hydrogen 2.854 N/A LYS 83.A NZ ASP 11.A OD1 no hydrogen 3.372 N/A LYS 83.A NZ ASP 11.A OD2 no hydrogen 3.369 N/A THR 85.A OG1 ASP 48.A OD1 no hydrogen 3.321 N/A LYS 86.A N LYS 83.A O no hydrogen 2.942 N/A LEU 87.A N ILE 47.A O no hydrogen 2.829 N/A TRP 88.A N TYR 81.A O no hydrogen 2.691 N/A ILE 89.A N LYS 45.A O no hydrogen 2.790 N/A ILE 90.A N GLY 79.A O no hydrogen 2.865 N/A MET 91.A N ALA 43.A O no hydrogen 2.774 N/A GLU 92.A N LYS 76.A O no hydrogen 2.948 N/A GLY 96.A N LEU 144.A O no hydrogen 2.771 N/A GLY 97.A N LEU 94.A O no hydrogen 3.486 N/A SER 98.A N ASP 101.A OD1 no hydrogen 3.371 N/A ALA 99.A N VAL 142.A O no hydrogen 2.727 N/A LEU 100.A N ALA 139.A O no hydrogen 3.235 N/A ASP 101.A N SER 98.A OG no hydrogen 3.034 N/A LEU 102.A N SER 98.A O no hydrogen 3.110 N/A LEU 103.A N LEU 100.A O no hydrogen 3.225 N/A GLU 104.A N ASP 101.A O no hydrogen 3.068 N/A GLY 106.A N LEU 103.A O no hydrogen 3.141 N/A ASP 109.A N GLN 112.A OE1 no hydrogen 2.988 N/A THR 111.A OG1 ASN 268.A O no hydrogen 3.457 N/A GLN 112.A N ASP 109.A OD2 no hydrogen 2.910 N/A ILE 113.A N ASP 109.A O no hydrogen 3.030 N/A ALA 114.A N GLU 110.A O no hydrogen 2.914 N/A THR 115.A N THR 111.A O no hydrogen 2.911 N/A THR 115.A OG1 THR 111.A O no hydrogen 2.677 N/A THR 115.A OG1 LYS 270.A O no hydrogen 3.503 N/A ILE 116.A N GLN 112.A O no hydrogen 2.994 N/A LEU 117.A N ILE 113.A O no hydrogen 2.932 N/A ARG 118.A N ALA 114.A O no hydrogen 2.920 N/A ARG 118.A NE GLU 119.A OE1 no hydrogen 2.919 N/A ARG 118.A NH2 GLU 119.A OE1 no hydrogen 3.178 N/A ARG 118.A NH2 LYS 270.A O no hydrogen 2.806 N/A GLU 119.A N THR 115.A O no hydrogen 3.092 N/A ILE 120.A N ILE 116.A O no hydrogen 2.939 N/A LEU 121.A N LEU 117.A O no hydrogen 2.897 N/A LYS 122.A N ARG 118.A O no hydrogen 2.996 N/A LYS 122.A NZ GLU 119.A OE1 no hydrogen 3.003 N/A GLY 123.A N GLU 119.A O no hydrogen 3.135 N/A LEU 124.A N ILE 120.A O no hydrogen 2.807 N/A ASP 125.A N LEU 121.A O no hydrogen 2.810 N/A TYR 126.A N LYS 122.A O no hydrogen 3.010 N/A LEU 127.A N GLY 123.A O no hydrogen 2.949 N/A HIS 128.A N LEU 124.A O no hydrogen 2.815 N/A HIS 128.A NE2 ASP 192.A OD2 no hydrogen 2.777 N/A SER 129.A N ASP 125.A O no hydrogen 3.008 N/A SER 129.A OG ASP 125.A O no hydrogen 3.242 N/A SER 129.A OG TYR 126.A O no hydrogen 2.608 N/A GLU 130.A N TYR 126.A O no hydrogen 3.157 N/A GLU 130.A N LEU 127.A O no hydrogen 2.996 N/A LYS 131.A N HIS 128.A O no hydrogen 3.067 N/A LYS 132.A N LEU 127.A O no hydrogen 2.866 N/A LYS 132.A NZ GLN 68.A OE1 no hydrogen 2.964 N/A ILE 133.A N GLY 159.A O no hydrogen 2.885 N/A HIS 134.A N ASP 192.A OD2 no hydrogen 2.847 N/A HIS 134.A NE2 ALA 153.A O no hydrogen 2.895 N/A ARG 135.A N ASP 192.A OD1 no hydrogen 2.826 N/A ARG 135.A NH1 TYR 187.A OH no hydrogen 2.635 N/A ARG 135.A NH2 VAL 157.A O no hydrogen 2.977 N/A ASP 136.A N HIS 134.A ND1 no hydrogen 2.900 N/A LYS 138.A NZ THR 173.A OG1 no hydrogen 2.773 N/A ALA 139.A N GLU 202.A OE1 no hydrogen 2.879 N/A ASN 141.A N LYS 138.A O no hydrogen 2.927 N/A ASN 141.A ND2 ASP 136.A O no hydrogen 2.851 N/A VAL 142.A N ALA 139.A O no hydrogen 3.300 N/A LEU 143.A N LYS 151.A O no hydrogen 2.807 N/A LEU 144.A N GLY 97.A O no hydrogen 2.869 N/A SER 145.A N GLU 149.A O no hydrogen 2.811 N/A SER 145.A OG GLU 149.A OE2 no hydrogen 2.630 N/A HIS 147.A N SER 145.A OG no hydrogen 3.081 N/A GLY 148.A N SER 145.A O no hydrogen 3.107 N/A GLU 149.A N SER 145.A OG no hydrogen 3.174 N/A LYS 151.A N LEU 143.A O no hydrogen 2.829 N/A LYS 151.A NZ PRO 72.A O no hydrogen 3.243 N/A LYS 151.A NZ GLU 92.A OE1 no hydrogen 2.925 N/A LEU 152.A N TYR 73.A O no hydrogen 2.833 N/A ALA 153.A N ASN 141.A O no hydrogen 2.882 N/A PHE 155.A N GLU 62.A OE2 no hydrogen 3.384 N/A GLY 156.A N ASP 154.A OD2 no hydrogen 3.099 N/A ALA 158.A N PHE 155.A O no hydrogen 3.211 N/A GLY 159.A N ILE 133.A O no hydrogen 2.813 N/A LEU 161.A N LYS 131.A O no hydrogen 2.747 N/A THR 162.A N GLN 165.A O no hydrogen 2.794 N/A GLN 165.A N THR 162.A OG1 no hydrogen 2.934 N/A LYS 167.A NZ ASP 188.A OD2 no hydrogen 3.279 N/A ARG 168.A N TYR 187.A O no hydrogen 2.843 N/A ARG 168.A NH1 GLN 160.A O no hydrogen 3.034 N/A THR 173.A OG1 ASP 136.A OD1 no hydrogen 2.686 N/A THR 173.A OG1 ASP 136.A OD2 no hydrogen 3.553 N/A TRP 176.A N THR 173.A O no hydrogen 2.838 N/A TRP 176.A NE1 GLU 202.A OE1 no hydrogen 2.937 N/A MET 177.A N PRO 174.A O no hydrogen 3.132 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.794 N/A VAL 181.A N ALA 178.A O no hydrogen 3.014 N/A ILE 182.A N ALA 178.A O no hydrogen 3.109 N/A LYS 183.A N PRO 179.A O no hydrogen 2.958 N/A GLN 184.A N VAL 181.A O no hydrogen 3.024 N/A SER 185.A N GLU 180.A O no hydrogen 2.832 N/A TYR 187.A N ARG 168.A O no hydrogen 2.772 N/A LYS 190.A N ASP 188.A OD1 no hydrogen 3.112 N/A LYS 190.A NZ PRO 250.A O no hydrogen 3.388 N/A LYS 190.A NZ ARG 253.A O no hydrogen 2.795 N/A ALA 191.A N ASP 188.A O no hydrogen 3.091 N/A ASP 192.A N SER 189.A O no hydrogen 2.952 N/A TRP 194.A N LYS 190.A O no hydrogen 3.127 N/A SER 195.A N ALA 191.A O no hydrogen 3.078 N/A SER 195.A OG TRP 176.A O no hydrogen 2.744 N/A SER 195.A OG ALA 191.A O no hydrogen 3.324 N/A LEU 196.A N ASP 192.A O no hydrogen 2.898 N/A GLY 197.A N ILE 193.A O no hydrogen 3.132 N/A ILE 198.A N TRP 194.A O no hydrogen 3.200 N/A THR 199.A N SER 195.A O no hydrogen 2.975 N/A THR 199.A OG1 SER 195.A O no hydrogen 2.922 N/A ALA 200.A N LEU 196.A O no hydrogen 2.803 N/A ILE 201.A N GLY 197.A O no hydrogen 3.112 N/A GLU 202.A N ILE 198.A O no hydrogen 2.889 N/A LEU 203.A N THR 199.A O no hydrogen 2.749 N/A ALA 204.A N ALA 200.A O no hydrogen 3.043 N/A ARG 205.A N ILE 201.A O no hydrogen 2.753 N/A ARG 205.A NH1 GLU 231.A O no hydrogen 2.827 N/A GLY 206.A N GLU 202.A O no hydrogen 2.734 N/A LEU 213.A N HIS 210.A O no hydrogen 2.982 N/A MET 216.A N HIS 214.A ND1 no hydrogen 3.046 N/A LYS 217.A N HIS 214.A O no hydrogen 2.945 N/A LEU 219.A N MET 216.A O no hydrogen 3.193 N/A PHE 220.A N LYS 217.A O no hydrogen 3.154 N/A LEU 221.A N LYS 217.A O no hydrogen 3.003 N/A ILE 222.A N VAL 218.A O no hydrogen 2.888 N/A LYS 224.A N PHE 220.A O no hydrogen 3.190 N/A ASN 225.A N LEU 221.A O no hydrogen 2.836 N/A THR 229.A OG1 GLU 231.A OE1 no hydrogen 2.855 N/A TYR 234.A N GLY 232.A O no hydrogen 2.941 N/A TYR 234.A OH ALA 204.A O no hydrogen 2.923 N/A SER 235.A N GLU 110.A OE2 no hydrogen 2.895 N/A SER 235.A OG GLU 110.A OE1 no hydrogen 2.632 N/A LEU 238.A N SER 235.A OG no hydrogen 3.172 N/A LYS 239.A N SER 235.A O no hydrogen 3.011 N/A LYS 239.A NZ GLY 232.A O no hydrogen 3.045 N/A GLU 240.A N LYS 236.A O no hydrogen 2.854 N/A PHE 241.A N PRO 237.A O no hydrogen 2.853 N/A VAL 242.A N LEU 238.A O no hydrogen 3.115 N/A GLU 243.A N LYS 239.A O no hydrogen 2.990 N/A ALA 244.A N GLU 240.A O no hydrogen 2.876 N/A CYS 245.A N PHE 241.A O no hydrogen 3.214 N/A CYS 245.A SG PHE 241.A O no hydrogen 3.511 N/A LEU 246.A N VAL 242.A O no hydrogen 2.899 N/A LYS 248.A NZ PRO 223.A O no hydrogen 2.976 N/A LYS 248.A NZ ASN 225.A O no hydrogen 2.676 N/A GLU 249.A N ASN 247.A OD1 no hydrogen 2.925 N/A SER 251.A N GLU 249.A OE1 no hydrogen 2.961 N/A SER 251.A OG GLU 249.A OE1 no hydrogen 2.807 N/A PHE 252.A N GLU 249.A O no hydrogen 2.945 N/A ARG 253.A N PRO 250.A O no hydrogen 3.029 N/A ARG 253.A NE ASN 247.A O no hydrogen 2.788 N/A ARG 253.A NH1 GLU 180.A OE1 no hydrogen 3.569 N/A ARG 253.A NH1 GLU 180.A OE2 no hydrogen 2.670 N/A ARG 253.A NH1 LYS 190.A O no hydrogen 2.986 N/A ARG 253.A NH2 GLU 180.A OE1 no hydrogen 2.811 N/A ARG 253.A NH2 GLU 180.A OE2 no hydrogen 3.482 N/A ARG 253.A NH2 ASN 247.A O no hydrogen 3.089 N/A THR 255.A N GLU 258.A OE1 no hydrogen 3.075 N/A GLU 258.A N THR 255.A OG1 no hydrogen 3.096 N/A LEU 259.A N THR 255.A O no hydrogen 3.028 N/A LEU 260.A N ALA 256.A O no hydrogen 3.125 N/A LYS 261.A N GLU 258.A O no hydrogen 3.107 N/A HIS 262.A N LEU 259.A O no hydrogen 3.032 N/A LYS 263.A NZ GLU 240.A OE1 no hydrogen 2.749 N/A PHE 264.A N HIS 262.A ND1 no hydrogen 3.007 N/A LEU 266.A N HIS 262.A O no hydrogen 3.035 N/A ARG 267.A N LYS 263.A O no hydrogen 2.961 N/A ASN 268.A N PHE 264.A O no hydrogen 3.186 N/A ASN 268.A N ILE 265.A O no hydrogen 3.319 N/A ASN 268.A ND2 PHE 264.A O no hydrogen 2.873 N/A ALA 269.A N ILE 265.A O no hydrogen 2.864 N/A LYS 270.A N THR 115.A OG1 no hydrogen 3.077 N/A LYS 271.A NZ TYR 274.A OH no hydrogen 3.546 N/A TYR 274.A N LYS 271.A O no hydrogen 3.188 N/A LEU 275.A N THR 272.A O no hydrogen 2.833 N/A THR 276.A N SER 273.A O no hydrogen 3.164 N/A THR 276.A OG1 SER 273.A O no hydrogen 2.958 N/A GLU 277.A N TYR 274.A O no hydrogen 3.126 N/A ILE 279.A N LEU 275.A O no hydrogen 3.067 N/A ASP 280.A N THR 276.A O no hydrogen 2.770 N/A ARG 281.A N GLU 277.A O no hydrogen 3.008 N/A ARG 281.A NH1 PRO 107.A O no hydrogen 3.134 N/A ARG 281.A NH2 LEU 102.A O no hydrogen 2.960 N/A ARG 281.A NH2 GLY 106.A O no hydrogen 2.828 N/A TYR 282.A N LEU 278.A O no hydrogen 3.176 N/A LYS 283.A N ILE 279.A O no hydrogen 2.938 N/A LYS 283.A NZ ASP 280.A OD1 no hydrogen 2.759 N/A ARG 284.A N ASP 280.A O no hydrogen 2.961 N/A ARG 284.A NH2 GLU 277.A OE1 no hydrogen 3.246 N/A TRP 285.A N ARG 281.A O no hydrogen 3.012 N/A LYS 286.A N TYR 282.A O no hydrogen 2.924 N/A ALA 287.A N LYS 283.A O no hydrogen 2.958 N/A GLN 289.A NE2 TRP 285.A O no hydrogen 2.698 N/A