Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4f63_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A N ASP 5.A OD1 no hydrogen 3.360 N/A ARG 7.A NE ASP 5.A OD1 no hydrogen 3.244 N/A ARG 7.A NH2 ASP 5.A OD2 no hydrogen 3.244 N/A TRP 8.A N ASP 5.A O no hydrogen 3.278 N/A GLU 9.A N ASP 5.A O no hydrogen 3.226 N/A LEU 10.A N ALA 78.A O no hydrogen 2.845 N/A ARG 12.A NE GLN 81.A O no hydrogen 2.720 N/A ARG 12.A NH1 PRO 84.A O no hydrogen 3.003 N/A ARG 12.A NH2 GLN 81.A O no hydrogen 3.216 N/A ARG 12.A NH2 PRO 84.A O no hydrogen 2.833 N/A ARG 14.A N PRO 11.A O no hydrogen 2.944 N/A ARG 14.A NE ASP 13.A OD1 no hydrogen 3.226 N/A ARG 14.A NH2 ASP 13.A O no hydrogen 2.844 N/A LEU 15.A N ARG 12.A O no hydrogen 3.391 N/A VAL 16.A N GLU 28.A O no hydrogen 2.709 N/A GLY 18.A N LEU 26.A O no hydrogen 2.904 N/A LEU 21.A N VAL 24.A O no hydrogen 2.656 N/A GLY 22.A N VAL 24.A O no hydrogen 3.288 N/A VAL 25.A N VAL 41.A O no hydrogen 3.062 N/A LEU 26.A N LYS 19.A O no hydrogen 2.787 N/A ALA 27.A N VAL 39.A O no hydrogen 2.749 N/A GLU 28.A N VAL 16.A O no hydrogen 2.891 N/A ALA 29.A N THR 37.A O no hydrogen 2.911 N/A ILE 30.A N ARG 14.A O no hydrogen 2.753 N/A GLY 31.A N ARG 35.A O no hydrogen 2.957 N/A THR 37.A N ALA 29.A O no hydrogen 3.100 N/A VAL 39.A N ALA 27.A O no hydrogen 3.051 N/A ALA 40.A N VAL 89.A O no hydrogen 3.055 N/A VAL 41.A N VAL 25.A O no hydrogen 2.856 N/A LYS 42.A N VAL 87.A O no hydrogen 2.788 N/A LYS 42.A NZ GLU 59.A OE1 no hydrogen 3.232 N/A MET 43.A N GLN 23.A O no hydrogen 3.025 N/A THR 49.A N ASP 52.A OD2 no hydrogen 2.973 N/A THR 49.A OG1 ASP 52.A OD2 no hydrogen 2.972 N/A ASP 52.A N THR 49.A OG1 no hydrogen 3.260 N/A SER 54.A N GLU 50.A O no hydrogen 2.979 N/A SER 54.A OG GLU 50.A O no hydrogen 2.561 N/A ASP 55.A N LYS 51.A O no hydrogen 2.934 N/A LEU 56.A N ASP 52.A O no hydrogen 2.941 N/A ILE 57.A N LEU 53.A O no hydrogen 2.814 N/A SER 58.A N SER 54.A O no hydrogen 3.017 N/A SER 58.A OG SER 54.A O no hydrogen 2.961 N/A GLU 59.A N ASP 55.A O no hydrogen 2.899 N/A MET 60.A N LEU 56.A O no hydrogen 2.941 N/A GLU 61.A N ILE 57.A O no hydrogen 2.808 N/A MET 62.A N SER 58.A O no hydrogen 2.817 N/A MET 63.A N GLU 59.A O no hydrogen 2.967 N/A LYS 64.A N MET 60.A O no hydrogen 2.895 N/A LYS 64.A NZ ASP 5.A OD2 no hydrogen 2.756 N/A LYS 64.A NZ GLU 61.A OE2 no hydrogen 2.418 N/A MET 65.A N GLU 61.A O no hydrogen 3.145 N/A ILE 66.A N MET 62.A O no hydrogen 2.920 N/A HIS 69.A N ASN 74.A OD1 no hydrogen 3.080 N/A ASN 71.A N HIS 69.A ND1 no hydrogen 3.066 N/A ASN 71.A ND2 GLN 122.A OE1 no hydrogen 3.621 N/A ASN 71.A ND2 MET 153.A O no hydrogen 2.712 N/A ILE 72.A N HIS 69.A O no hydrogen 3.351 N/A ILE 73.A N ILE 155.A O no hydrogen 2.807 N/A ASN 74.A N GLU 90.A OE1 no hydrogen 3.095 N/A ASN 74.A ND2 HIS 69.A O no hydrogen 2.843 N/A ASN 74.A ND2 GLU 90.A OE1 no hydrogen 2.844 N/A ASN 74.A ND2 GLU 90.A OE2 no hydrogen 3.282 N/A LEU 76.A N ILE 88.A O no hydrogen 2.705 N/A GLY 77.A N ILE 88.A O no hydrogen 3.207 N/A ALA 78.A N TRP 8.A O no hydrogen 2.944 N/A CYS 79.A N TYR 86.A O no hydrogen 2.837 N/A CYS 79.A SG LEU 10.A O no hydrogen 3.326 N/A THR 80.A N GLU 9.A OE2 no hydrogen 3.116 N/A THR 80.A OG1 GLU 9.A OE1 no hydrogen 2.464 N/A THR 80.A OG1 GLU 9.A OE2 no hydrogen 3.298 N/A GLN 81.A NE2 LEU 2.A O no hydrogen 2.879 N/A GLN 81.A NE2 THR 80.A OG1 no hydrogen 3.108 N/A TYR 86.A N CYS 79.A O no hydrogen 2.825 N/A VAL 87.A N LYS 42.A O no hydrogen 2.927 N/A ILE 88.A N GLY 77.A O no hydrogen 3.049 N/A VAL 89.A N ALA 40.A O no hydrogen 2.960 N/A GLU 90.A N ASN 74.A O no hydrogen 2.994 N/A SER 93.A OG GLU 149.A OE1 no hydrogen 2.633 N/A LYS 94.A N VAL 147.A O no hydrogen 2.933 N/A LYS 94.A NZ GLU 149.A O no hydrogen 3.308 N/A LYS 94.A NZ ASN 151.A OD1 no hydrogen 3.236 N/A ASN 96.A N GLU 99.A OE1 no hydrogen 3.296 N/A LEU 97.A N VAL 145.A O no hydrogen 2.635 N/A GLU 99.A N ASN 96.A OD1 no hydrogen 2.781 N/A TYR 100.A N ASN 96.A O no hydrogen 3.059 N/A TYR 100.A OH ASN 151.A OD1 no hydrogen 3.200 N/A LEU 101.A N LEU 97.A O no hydrogen 2.977 N/A GLN 102.A N ARG 98.A O no hydrogen 2.972 N/A GLN 102.A NE2 GLY 213.A O no hydrogen 3.004 N/A ALA 103.A N GLU 99.A O no hydrogen 2.796 N/A ARG 104.A N LEU 101.A O no hydrogen 2.890 N/A ARG 104.A NH1 TYR 100.A O no hydrogen 2.952 N/A ARG 105.A N GLN 102.A O no hydrogen 3.322 N/A ARG 105.A NE LEU 212.A O no hydrogen 3.081 N/A ARG 105.A NH2 LEU 212.A O no hydrogen 3.204 N/A SER 112.A N ASP 115.A OD2 no hydrogen 2.811 N/A SER 112.A OG ASP 115.A OD2 no hydrogen 2.865 N/A LYS 114.A N SER 278.A O no hydrogen 3.198 N/A LYS 114.A NZ VAL 274.A O no hydrogen 2.658 N/A LYS 114.A NZ THR 277.A O no hydrogen 2.902 N/A ASP 115.A N SER 112.A OG no hydrogen 3.233 N/A LEU 116.A N SER 112.A O no hydrogen 2.997 N/A VAL 117.A N SER 113.A O no hydrogen 2.991 N/A SER 118.A N LYS 114.A O no hydrogen 2.723 N/A CYS 119.A N ASP 115.A O no hydrogen 2.873 N/A ALA 120.A N LEU 116.A O no hydrogen 3.131 N/A TYR 121.A N VAL 117.A O no hydrogen 3.057 N/A GLN 122.A N SER 118.A O no hydrogen 3.199 N/A GLN 122.A NE2 SER 118.A O no hydrogen 3.253 N/A GLN 122.A NE2 SER 118.A OG no hydrogen 3.332 N/A VAL 123.A N CYS 119.A O no hydrogen 3.190 N/A ALA 124.A N ALA 120.A O no hydrogen 2.912 N/A ARG 125.A N TYR 121.A O no hydrogen 2.804 N/A GLY 126.A N GLN 122.A O no hydrogen 2.964 N/A MET 127.A N VAL 123.A O no hydrogen 2.884 N/A GLU 128.A N ALA 124.A O no hydrogen 3.013 N/A TYR 129.A N ARG 125.A O no hydrogen 3.098 N/A TYR 129.A OH ILE 66.A O no hydrogen 2.622 N/A LEU 130.A N GLY 126.A O no hydrogen 3.035 N/A ALA 131.A N MET 127.A O no hydrogen 2.751 N/A SER 132.A N GLU 128.A O no hydrogen 2.863 N/A SER 132.A OG TYR 129.A O no hydrogen 2.634 N/A LYS 133.A N TYR 129.A O no hydrogen 2.954 N/A LYS 133.A N LEU 130.A O no hydrogen 3.039 N/A LYS 134.A N ALA 131.A O no hydrogen 2.705 N/A CYS 135.A N LEU 130.A O no hydrogen 2.908 N/A CYS 135.A SG PHE 158.A O no hydrogen 3.545 N/A HIS 137.A N ASP 198.A OD2 no hydrogen 2.856 N/A HIS 137.A NE2 ALA 156.A O no hydrogen 2.992 N/A ARG 138.A N ASP 198.A OD1 no hydrogen 2.965 N/A ASP 139.A N HIS 137.A ND1 no hydrogen 3.041 N/A ALA 142.A N GLU 208.A OE2 no hydrogen 2.960 N/A ARG 143.A NH2 ASP 139.A OD1 no hydrogen 2.874 N/A ARG 143.A NH2 ASP 139.A OD2 no hydrogen 3.406 N/A ASN 144.A N ALA 141.A O no hydrogen 2.959 N/A ASN 144.A ND2 ASP 139.A O no hydrogen 2.945 N/A VAL 145.A N ALA 142.A O no hydrogen 3.109 N/A LEU 146.A N LYS 154.A O no hydrogen 2.837 N/A VAL 147.A N GLY 95.A O no hydrogen 2.899 N/A THR 148.A N VAL 152.A O no hydrogen 3.162 N/A ASN 151.A N THR 148.A O no hydrogen 2.650 N/A VAL 152.A N THR 148.A OG1 no hydrogen 2.857 N/A MET 153.A N GLN 122.A OE1 no hydrogen 3.033 N/A LYS 154.A N LEU 146.A O no hydrogen 2.636 N/A LYS 154.A NZ LYS 70.A O no hydrogen 2.551 N/A LYS 154.A NZ ILE 72.A O no hydrogen 3.449 N/A LYS 154.A NZ GLU 90.A OE1 no hydrogen 2.888 N/A ILE 155.A N ASN 71.A O no hydrogen 3.032 N/A ALA 156.A N ASN 144.A O no hydrogen 2.872 N/A HIS 165.A N ASP 163.A OD1 no hydrogen 2.938 N/A HIS 166.A N ASP 163.A O no hydrogen 2.972 N/A ILE 167.A N ILE 164.A O no hydrogen 3.158 N/A TYR 169.A OH LEU 188.A O no hydrogen 2.883 N/A TYR 170.A N ASP 168.A OD1 no hydrogen 2.979 N/A LYS 171.A N ASP 168.A O no hydrogen 3.244 N/A THR 173.A N ARG 177.A O no hydrogen 2.460 N/A THR 173.A OG1 ARG 177.A O no hydrogen 3.231 N/A GLY 176.A N THR 173.A O no hydrogen 2.780 N/A ARG 177.A N THR 173.A OG1 no hydrogen 3.043 N/A ARG 177.A NH2 GLY 213.A O no hydrogen 2.867 N/A LYS 181.A N LEU 178.A O no hydrogen 3.157 N/A LYS 181.A NZ PRO 216.A O no hydrogen 3.569 N/A LYS 181.A NZ TYR 217.A O no hydrogen 2.552 N/A LYS 181.A NZ VAL 220.A O no hydrogen 2.777 N/A TRP 182.A N PRO 179.A O no hydrogen 2.872 N/A TRP 182.A NE1 GLU 208.A OE2 no hydrogen 2.879 N/A MET 183.A N VAL 180.A O no hydrogen 3.115 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.854 N/A ALA 187.A N ALA 184.A O no hydrogen 3.020 N/A LEU 188.A N ALA 184.A O no hydrogen 2.930 N/A PHE 189.A N PRO 185.A O no hydrogen 2.667 N/A ASP 190.A N GLU 186.A O no hydrogen 3.203 N/A ARG 191.A N ALA 187.A O no hydrogen 2.787 N/A ILE 192.A N GLU 186.A O no hydrogen 3.014 N/A THR 194.A N SER 197.A OG no hydrogen 2.912 N/A THR 194.A OG1 GLN 196.A OE1 no hydrogen 3.233 N/A GLN 196.A N GLN 196.A OE1 no hydrogen 3.164 N/A SER 197.A N THR 194.A OG1 no hydrogen 2.931 N/A SER 197.A OG THR 194.A O no hydrogen 3.008 N/A ASP 198.A N THR 194.A O no hydrogen 3.378 N/A VAL 199.A N HIS 195.A O no hydrogen 2.960 N/A TRP 200.A N GLN 196.A O no hydrogen 3.120 N/A SER 201.A N SER 197.A O no hydrogen 3.169 N/A SER 201.A OG TRP 182.A O no hydrogen 2.415 N/A SER 201.A OG SER 197.A O no hydrogen 3.084 N/A PHE 202.A N ASP 198.A O no hydrogen 2.840 N/A GLY 203.A N VAL 199.A O no hydrogen 2.945 N/A VAL 204.A N TRP 200.A O no hydrogen 3.340 N/A LEU 205.A N SER 201.A O no hydrogen 2.863 N/A LEU 206.A N PHE 202.A O no hydrogen 2.758 N/A TRP 207.A N GLY 203.A O no hydrogen 3.156 N/A TRP 207.A NE1 ASP 236.A O no hydrogen 3.295 N/A GLU 208.A N VAL 204.A O no hydrogen 2.939 N/A ILE 209.A N LEU 205.A O no hydrogen 2.914 N/A PHE 210.A N LEU 206.A O no hydrogen 3.014 N/A THR 211.A N TRP 207.A O no hydrogen 2.974 N/A THR 211.A OG1 TRP 207.A O no hydrogen 2.883 N/A LEU 212.A N ILE 209.A O no hydrogen 3.043 N/A GLY 213.A N GLU 208.A O no hydrogen 2.803 N/A TYR 217.A OH HIS 233.A ND1 no hydrogen 3.385 N/A VAL 220.A N TYR 217.A O no hydrogen 3.436 N/A GLU 224.A N PRO 221.A O no hydrogen 3.107 N/A LEU 225.A N PRO 221.A O no hydrogen 2.980 N/A PHE 226.A N VAL 222.A O no hydrogen 3.112 N/A LYS 227.A N GLU 223.A O no hydrogen 3.480 N/A LEU 228.A N GLU 224.A O no hydrogen 2.897 N/A LEU 229.A N LEU 225.A O no hydrogen 2.841 N/A LYS 230.A N PHE 226.A O no hydrogen 2.771 N/A GLU 231.A N LYS 227.A O no hydrogen 2.895 N/A GLY 232.A N LEU 229.A O no hydrogen 2.805 N/A HIS 233.A N LEU 228.A O no hydrogen 2.935 N/A ARG 234.A NE TRP 253.A O no hydrogen 3.008 N/A ARG 234.A NH1 HIS 233.A O no hydrogen 3.119 N/A LYS 237.A NZ ASN 243.A OD1 no hydrogen 2.805 N/A CYS 241.A SG THR 242.A O no hydrogen 3.949 N/A LEU 245.A N THR 242.A OG1 no hydrogen 3.068 N/A TYR 246.A N THR 242.A O no hydrogen 2.898 N/A TYR 246.A OH MET 235.A O no hydrogen 2.399 N/A MET 247.A N ASN 243.A O no hydrogen 2.637 N/A MET 248.A N GLU 244.A O no hydrogen 3.161 N/A MET 249.A N LEU 245.A O no hydrogen 3.323 N/A ARG 250.A N TYR 246.A O no hydrogen 3.150 N/A ARG 250.A NH1 TYR 246.A OH no hydrogen 3.475 N/A ASP 251.A N MET 247.A O no hydrogen 2.767 N/A CYS 252.A N MET 248.A O no hydrogen 2.851 N/A CYS 252.A SG MET 248.A O no hydrogen 3.413 N/A TRP 253.A N MET 249.A O no hydrogen 2.920 N/A HIS 254.A N ASP 251.A O no hydrogen 3.248 N/A GLN 259.A N VAL 256.A O no hydrogen 2.873 N/A GLN 259.A NE2 SER 258.A OG no hydrogen 3.152 N/A ARG 260.A N PRO 257.A O no hydrogen 3.070 N/A ARG 260.A NE HIS 254.A O no hydrogen 2.798 N/A ARG 260.A NH1 GLU 186.A OE2 no hydrogen 2.944 N/A ARG 260.A NH1 GLN 196.A O no hydrogen 3.001 N/A ARG 260.A NH2 GLU 186.A OE1 no hydrogen 3.002 N/A ARG 260.A NH2 HIS 254.A O no hydrogen 3.216 N/A THR 262.A N GLN 265.A OE1 no hydrogen 3.190 N/A THR 262.A OG1 GLN 265.A OE1 no hydrogen 3.453 N/A GLN 265.A N THR 262.A OG1 no hydrogen 3.153 N/A LEU 266.A N THR 262.A O no hydrogen 3.017 N/A VAL 267.A N PHE 263.A O no hydrogen 2.862 N/A GLU 268.A N LYS 264.A O no hydrogen 3.323 N/A ASP 269.A N GLN 265.A O no hydrogen 3.036 N/A LEU 270.A N LEU 266.A O no hydrogen 2.861 N/A ASP 271.A N VAL 267.A O no hydrogen 2.920 N/A ARG 272.A N GLU 268.A O no hydrogen 3.103 N/A ARG 272.A NH1 GLU 244.A OE2 no hydrogen 2.935 N/A ARG 272.A NH2 GLU 244.A OE2 no hydrogen 2.950 N/A ILE 273.A N ASP 269.A O no hydrogen 2.852 N/A VAL 274.A N LEU 270.A O no hydrogen 2.722 N/A ALA 275.A N ASP 271.A O no hydrogen 3.320 N/A THR 277.A N VAL 274.A O no hydrogen 2.992 N/A THR 277.A OG1 ILE 273.A O no hydrogen 2.702 N/A