Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zzg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N HIS 64.A O no hydrogen 2.685 N/A THR 6.A N THR 9.A OG1 no hydrogen 3.242 N/A THR 6.A OG1 SER 8.A OG no hydrogen 3.359 N/A THR 6.A OG1 THR 9.A OG1 no hydrogen 2.914 N/A SER 8.A OG THR 6.A OG1 no hydrogen 3.359 N/A THR 9.A N THR 6.A OG1 no hydrogen 3.412 N/A THR 9.A OG1 THR 6.A OG1 no hydrogen 2.914 N/A VAL 10.A N THR 6.A O no hydrogen 2.947 N/A ILE 11.A N ARG 7.A O no hydrogen 2.937 N/A GLN 12.A N SER 8.A O no hydrogen 3.040 N/A LEU 13.A N THR 9.A O no hydrogen 2.892 N/A LEU 14.A N VAL 10.A O no hydrogen 3.161 N/A ILE 17.A N LEU 14.A O no hydrogen 3.308 N/A SER 18.A N GLU 22.A OE1 no hydrogen 2.641 N/A SER 18.A OG GLU 22.A OE1 no hydrogen 2.925 N/A THR 19.A N GLU 22.A OE1 no hydrogen 3.103 N/A GLU 22.A N THR 19.A O no hydrogen 2.970 N/A VAL 23.A N THR 19.A O no hydrogen 3.268 N/A GLU 24.A N LYS 20.A O no hydrogen 2.937 N/A GLN 25.A N ARG 21.A O no hydrogen 2.970 N/A TYR 26.A N GLU 22.A O no hydrogen 3.140 N/A LEU 27.A N VAL 23.A O no hydrogen 3.092 N/A LYS 28.A N GLU 24.A O no hydrogen 3.089 N/A PHE 30.A N TYR 26.A O no hydrogen 3.039 N/A THR 31.A N LEU 27.A O no hydrogen 2.829 N/A THR 31.A OG1 LEU 27.A O no hydrogen 2.939 N/A SER 34.A N SER 32.A OG no hydrogen 3.281 N/A GLN 36.A N SER 34.A OG no hydrogen 2.924 N/A GLN 36.A NE2 GLU 201.A O no hydrogen 2.838 N/A GLN 37.A NE2 TYR 68.A O no hydrogen 2.435 N/A VAL 40.A N LYS 204.A O no hydrogen 3.176 N/A ILE 41.A N ILE 70.A O no hydrogen 2.953 N/A LYS 42.A N VAL 206.A O no hydrogen 2.808 N/A LYS 42.A NZ ASP 190.A OD1 no hydrogen 3.151 N/A VAL 43.A N LEU 72.A O no hydrogen 2.861 N/A GLY 44.A N LEU 208.A O no hydrogen 3.282 N/A ILE 47.A N GLY 44.A O no hydrogen 2.913 N/A ILE 48.A N GLY 45.A O no hydrogen 2.877 N/A SER 49.A N GLY 45.A O no hydrogen 3.484 N/A SER 49.A OG GLY 45.A O no hydrogen 3.387 N/A SER 49.A OG GLN 114.A OE1 no hydrogen 3.143 N/A ASP 50.A N ALA 46.A O no hydrogen 2.862 N/A ASN 51.A N ILE 47.A O no hydrogen 2.844 N/A LEU 55.A N ASN 51.A O no hydrogen 2.968 N/A ALA 56.A N LEU 52.A O no hydrogen 2.888 N/A SER 57.A N HIS 53.A O no hydrogen 2.950 N/A SER 57.A OG HIS 53.A O no hydrogen 2.946 N/A CYS 58.A N GLU 54.A O no hydrogen 3.120 N/A CYS 58.A N LEU 55.A O no hydrogen 3.112 N/A CYS 58.A SG GLU 54.A O no hydrogen 3.117 N/A CYS 58.A SG GLU 54.A OE1 no hydrogen 3.174 N/A LEU 59.A N LEU 55.A O no hydrogen 3.038 N/A ALA 60.A N ALA 56.A O no hydrogen 2.723 N/A PHE 61.A N SER 57.A O no hydrogen 3.072 N/A LEU 62.A N CYS 58.A O no hydrogen 3.430 N/A TYR 63.A N LEU 59.A O no hydrogen 2.917 N/A HIS 64.A N ALA 60.A O no hydrogen 2.880 N/A VAL 65.A N PHE 61.A O no hydrogen 3.080 N/A GLY 66.A N TYR 63.A O no hydrogen 2.982 N/A LEU 67.A N LEU 62.A O no hydrogen 2.908 N/A ILE 70.A N ALA 39.A O no hydrogen 2.905 N/A VAL 71.A N PRO 171.A O no hydrogen 3.214 N/A LEU 72.A N ILE 41.A O no hydrogen 2.978 N/A HIS 73.A N LEU 173.A O no hydrogen 3.043 N/A HIS 73.A ND1 GLY 74.A O no hydrogen 2.868 N/A GLY 74.A N VAL 43.A O no hydrogen 3.092 N/A GLY 81.A N PRO 77.A O no hydrogen 3.261 N/A ARG 82.A N GLN 78.A O no hydrogen 2.699 N/A ARG 82.A NH1 GLU 113.A OE1 no hydrogen 3.305 N/A ARG 82.A NH2 GLU 113.A OE1 no hydrogen 3.420 N/A LEU 83.A N VAL 79.A O no hydrogen 3.009 N/A GLU 84.A N ASN 80.A O no hydrogen 2.783 N/A ALA 85.A N GLY 81.A O no hydrogen 2.698 N/A GLN 86.A N ARG 82.A O no hydrogen 3.242 N/A GLY 87.A N LEU 83.A O no hydrogen 2.689 N/A ILE 88.A N LEU 83.A O no hydrogen 2.751 N/A ILE 93.A N ILE 96.A O no hydrogen 2.889 N/A ILE 96.A N ILE 93.A O no hydrogen 3.225 N/A ARG 97.A NH2 ASN 80.A OD1 no hydrogen 3.239 N/A ILE 98.A N ASP 91.A O no hydrogen 2.714 N/A THR 99.A N TYR 147.A O no hydrogen 3.256 N/A THR 99.A OG1 ARG 97.A O no hydrogen 3.134 N/A ASP 100.A N ILE 98.A O no hydrogen 3.197 N/A THR 103.A OG1 ASP 100.A OD1 no hydrogen 2.599 N/A MET 104.A N ASP 100.A O no hydrogen 2.794 N/A ALA 105.A N GLU 101.A O no hydrogen 3.272 N/A VAL 107.A N THR 103.A O no hydrogen 2.970 N/A ARG 108.A N MET 104.A O no hydrogen 2.759 N/A LYS 109.A N ALA 105.A O no hydrogen 3.172 N/A CYS 110.A N VAL 106.A O no hydrogen 2.922 N/A PHE 111.A N VAL 107.A O no hydrogen 2.872 N/A LEU 112.A N ARG 108.A O no hydrogen 2.949 N/A GLU 113.A N LYS 109.A O no hydrogen 3.299 N/A GLN 114.A N CYS 110.A O no hydrogen 2.863 N/A GLN 114.A NE2 CYS 110.A O no hydrogen 3.634 N/A ASN 115.A N PHE 111.A O no hydrogen 2.814 N/A ASN 115.A ND2 HIS 73.A NE2 no hydrogen 2.943 N/A ASN 115.A ND2 ILE 172.A O no hydrogen 3.092 N/A LEU 116.A N LEU 112.A O no hydrogen 3.111 N/A LYS 117.A N GLU 113.A O no hydrogen 2.986 N/A LEU 118.A N GLN 114.A O no hydrogen 3.195 N/A VAL 119.A N ASN 115.A O no hydrogen 3.013 N/A THR 120.A N LEU 116.A O no hydrogen 2.844 N/A THR 120.A OG1 LEU 116.A O no hydrogen 2.745 N/A ALA 121.A N LYS 117.A O no hydrogen 2.939 N/A LEU 122.A N LEU 118.A O no hydrogen 3.052 N/A GLU 123.A N VAL 119.A O no hydrogen 2.959 N/A GLN 124.A N THR 120.A O no hydrogen 2.876 N/A LEU 125.A N LEU 122.A O no hydrogen 2.862 N/A GLY 126.A N GLU 123.A O no hydrogen 2.783 N/A VAL 127.A N LEU 122.A O no hydrogen 2.981 N/A ALA 129.A N GLU 123.A OE2 no hydrogen 2.775 N/A ARG 130.A N LEU 170.A O no hydrogen 2.812 N/A ILE 132.A N ILE 172.A O no hydrogen 2.825 N/A GLY 135.A N GLU 178.A OE1 no hydrogen 3.129 N/A THR 138.A N SER 155.A O no hydrogen 3.225 N/A ALA 139.A N GLU 178.A O no hydrogen 2.946 N/A ASP 140.A N ASN 152.A O no hydrogen 3.060 N/A LEU 142.A N VAL 150.A O no hydrogen 2.973 N/A LYS 144.A NZ TYR 141.A OH no hydrogen 3.462 N/A LYS 146.A N ASP 143.A OD1 no hydrogen 3.332 N/A LYS 146.A NZ ASP 94.A OD1 no hydrogen 3.160 N/A LYS 146.A NZ TYR 147.A OH no hydrogen 3.336 N/A TYR 147.A N ASP 143.A O no hydrogen 2.887 N/A LEU 149.A N THR 99.A O no hydrogen 3.033 N/A VAL 150.A N LYS 148.A O no hydrogen 2.735 N/A GLY 151.A N ASN 186.A O no hydrogen 3.065 N/A ASN 152.A N ASP 140.A O no hydrogen 2.823 N/A LYS 154.A N THR 138.A O no hydrogen 3.013 N/A SER 155.A N THR 138.A O no hydrogen 3.399 N/A THR 157.A N VAL 136.A O no hydrogen 2.888 N/A LYS 158.A NZ GLU 162.A OE2 no hydrogen 3.514 N/A GLU 159.A N GLU 159.A OE1 no hydrogen 2.905 N/A GLU 162.A N LYS 158.A O no hydrogen 3.085 N/A ALA 163.A N GLU 159.A O no hydrogen 2.874 N/A SER 164.A N PRO 160.A O no hydrogen 2.989 N/A SER 164.A OG ALA 169.A O no hydrogen 2.394 N/A ILE 165.A N ILE 161.A O no hydrogen 3.097 N/A LYS 166.A N GLU 162.A O no hydrogen 2.912 N/A ALA 167.A N ALA 163.A O no hydrogen 2.942 N/A GLY 168.A N ILE 165.A O no hydrogen 3.074 N/A ALA 169.A N SER 164.A O no hydrogen 2.956 N/A LEU 170.A N ARG 128.A O no hydrogen 2.934 N/A ILE 172.A N ARG 130.A O no hydrogen 3.053 N/A LEU 173.A N VAL 71.A O no hydrogen 2.786 N/A THR 174.A N ILE 132.A O no hydrogen 3.318 N/A SER 175.A OG VAL 187.A O no hydrogen 3.122 N/A ALA 177.A N LEU 185.A O no hydrogen 2.990 N/A GLU 178.A N PHE 137.A O no hydrogen 3.149 N/A THR 179.A N GLN 183.A O no hydrogen 2.973 N/A GLY 182.A N THR 179.A O no hydrogen 2.851 N/A GLN 183.A N THR 179.A OG1 no hydrogen 2.988 N/A GLN 183.A NE2 MET 184.A O no hydrogen 2.611 N/A LEU 185.A N ALA 177.A O no hydrogen 2.764 N/A ASN 186.A N LEU 149.A O no hydrogen 3.095 N/A ASP 190.A N ASN 188.A OD1 no hydrogen 2.720 N/A VAL 191.A N ASN 188.A OD1 no hydrogen 3.388 N/A ALA 192.A N ASN 188.A O no hydrogen 2.848 N/A ALA 193.A N ALA 189.A O no hydrogen 2.917 N/A GLY 194.A N ASP 190.A O no hydrogen 3.190 N/A GLU 195.A N VAL 191.A O no hydrogen 2.959 N/A LEU 196.A N ALA 192.A O no hydrogen 3.223 N/A ALA 197.A N ALA 193.A O no hydrogen 3.084 N/A ARG 198.A N GLY 194.A O no hydrogen 2.902 N/A ARG 198.A NH2 GLU 251.A OE1 no hydrogen 2.873 N/A VAL 199.A N GLU 195.A O no hydrogen 3.132 N/A VAL 199.A N LEU 196.A O no hydrogen 3.224 N/A PHE 200.A N LEU 196.A O no hydrogen 2.833 N/A GLU 201.A N ALA 197.A O no hydrogen 2.891 N/A LEU 203.A N GLN 37.A O no hydrogen 2.956 N/A LYS 204.A N PHE 38.A O no hydrogen 2.904 N/A LYS 204.A NZ TYR 29.A OH no hydrogen 2.954 N/A VAL 206.A N VAL 40.A O no hydrogen 2.988 N/A TYR 207.A N ALA 266.A O no hydrogen 2.799 N/A TYR 207.A OH ASP 190.A O no hydrogen 3.096 N/A LEU 208.A N LYS 42.A O no hydrogen 2.732 N/A ASN 209.A N ILE 268.A O no hydrogen 3.060 N/A ASN 209.A ND2 GLY 213.A O no hydrogen 2.875 N/A GLY 212.A N ASN 209.A OD1 no hydrogen 2.808 N/A GLY 213.A N ASN 209.A OD1 no hydrogen 2.843 N/A ILE 214.A N THR 285.A OG1 no hydrogen 2.787 N/A ASN 216.A N GLU 221.A O no hydrogen 2.762 N/A SER 218.A OG ASN 216.A OD1 no hydrogen 2.841 N/A THR 219.A N ASN 216.A O no hydrogen 3.151 N/A GLY 220.A N ASN 216.A O no hydrogen 2.810 N/A LYS 222.A NZ GLY 282.A O no hydrogen 3.203 N/A LYS 222.A NZ GLY 284.A O no hydrogen 2.865 N/A ILE 223.A N ILE 214.A O no hydrogen 3.006 N/A ILE 226.A N MET 286.A O no hydrogen 2.998 N/A ASN 227.A N GLU 231.A OE2 no hydrogen 3.048 N/A ASN 227.A ND2 TYR 291.A O no hydrogen 3.213 N/A LEU 228.A N ARG 288.A O no hydrogen 3.064 N/A ASP 229.A N ARG 289.A O no hydrogen 2.904 N/A GLU 231.A N ASN 227.A O no hydrogen 2.854 N/A TYR 232.A N LEU 228.A O no hydrogen 3.294 N/A LEU 235.A N GLU 231.A O no hydrogen 3.003 N/A MET 236.A N TYR 232.A O no hydrogen 3.106 N/A GLN 238.A N MET 236.A O no hydrogen 2.805 N/A GLN 238.A NE2 ASP 234.A O no hydrogen 3.164 N/A LYS 246.A N LYS 242.A O no hydrogen 3.357 N/A LYS 248.A N GLY 244.A O no hydrogen 3.416 N/A ILE 249.A N THR 245.A O no hydrogen 2.819 N/A ARG 250.A N LYS 246.A O no hydrogen 2.833 N/A GLU 251.A N LEU 247.A O no hydrogen 2.991 N/A ILE 252.A N LYS 248.A O no hydrogen 3.277 N/A LYS 253.A N ILE 249.A O no hydrogen 3.401 N/A LYS 253.A NZ ASP 257.A OD2 no hydrogen 2.931 N/A GLU 254.A N ARG 250.A O no hydrogen 3.011 N/A LEU 255.A N GLU 251.A O no hydrogen 2.807 N/A LEU 256.A N ILE 252.A O no hydrogen 3.087 N/A ASP 257.A N LYS 253.A O no hydrogen 3.061 N/A TYR 258.A N GLU 254.A O no hydrogen 3.314 N/A TYR 258.A N LEU 255.A O no hydrogen 3.231 N/A LEU 259.A N LEU 255.A O no hydrogen 2.830 N/A SER 263.A N PRO 260.A O no hydrogen 3.415 N/A VAL 265.A N ILE 287.A O no hydrogen 3.029 N/A ALA 266.A N ILE 205.A O no hydrogen 2.992 N/A ILE 267.A N THR 285.A O no hydrogen 2.699 N/A ILE 268.A N TYR 207.A O no hydrogen 2.924 N/A ASN 269.A ND2 GLU 210.A O no hydrogen 2.893 N/A GLN 271.A N ASN 269.A OD1 no hydrogen 3.349 N/A ASP 272.A N ASN 269.A O no hydrogen 3.014 N/A LEU 273.A N VAL 270.A O no hydrogen 3.041 N/A GLN 274.A NE2 GLN 12.A O no hydrogen 2.940 N/A GLN 274.A NE2 TYR 26.A OH no hydrogen 2.918 N/A GLU 276.A N ASP 272.A O no hydrogen 2.963 N/A LEU 277.A N LEU 273.A O no hydrogen 3.235 N/A LEU 277.A N GLN 274.A O no hydrogen 3.201 N/A PHE 278.A N GLN 274.A O no hydrogen 3.278 N/A THR 279.A OG1 LYS 275.A O no hydrogen 2.739 N/A THR 285.A N ILE 267.A O no hydrogen 2.870 N/A THR 285.A OG1 ILE 223.A O no hydrogen 2.678 N/A MET 286.A N SER 224.A O no hydrogen 2.936 N/A ILE 287.A N VAL 265.A O no hydrogen 2.997 N/A ARG 288.A N ILE 226.A O no hydrogen 3.134 N/A