Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dlm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NE ALA 45.A O no hydrogen 2.874 N/A ARG 3.A NH2 GLN 44.A O no hydrogen 2.802 N/A ILE 4.A N TRP 276.A O no hydrogen 2.807 N/A ASP 5.A N ALA 48.A O no hydrogen 3.007 N/A SER 6.A N PHE 239.A O no hydrogen 3.124 N/A SER 6.A OG PHE 239.A O no hydrogen 2.809 N/A HIS 7.A N ASP 5.A OD1 no hydrogen 3.278 N/A GLN 8.A N ILE 50.A O no hydrogen 3.169 N/A GLN 8.A NE2 HIS 9.A O no hydrogen 3.121 N/A HIS 9.A N TRP 243.A O no hydrogen 2.861 N/A HIS 9.A ND1 VAL 52.A O no hydrogen 2.698 N/A HIS 9.A NE2 HIS 7.A NE2 no hydrogen 3.050 N/A TRP 11.A N TYR 32.A O no hydrogen 2.902 N/A TYR 13.A N ASP 31.A OD1 no hydrogen 2.886 N/A ARG 14.A NH1 ASP 17.A OD2 no hydrogen 3.220 N/A ASP 17.A N ARG 14.A O no hydrogen 2.917 N/A TYR 18.A N ALA 15.A O no hydrogen 3.053 N/A TRP 20.A NE1 ALA 54.A O no hydrogen 3.069 N/A ILE 21.A N TYR 18.A O no hydrogen 2.969 N/A MET 25.A N GLY 22.A O no hydrogen 3.289 N/A LEU 28.A N MET 25.A O no hydrogen 2.956 N/A ALA 29.A N GLY 26.A O no hydrogen 3.047 N/A ARG 30.A N LEU 28.A O no hydrogen 2.843 N/A ARG 30.A NE ASP 31.A O no hydrogen 2.920 N/A ARG 30.A NH1 ASP 31.A O no hydrogen 2.917 N/A TYR 32.A N TRP 11.A O no hydrogen 2.830 N/A TYR 32.A OH VAL 27.A O no hydrogen 2.655 N/A ALA 36.A N LEU 33.A O no hydrogen 2.985 N/A LEU 37.A N PRO 34.A O no hydrogen 3.069 N/A HIS 38.A N PRO 34.A O no hydrogen 3.052 N/A HIS 38.A NE2 GLU 71.A OE1.A no hydrogen 2.651 N/A HIS 38.A NE2 GLU 71.A OE2.B no hydrogen 2.304 N/A MET 41.A N LEU 37.A O no hydrogen 3.109 N/A HIS 42.A N HIS 38.A O no hydrogen 3.031 N/A ALA 43.A N PRO 39.A O no hydrogen 3.118 N/A GLN 44.A N MET 41.A O no hydrogen 3.229 N/A GLN 44.A NE2 ASP 253.A OD1 no hydrogen 3.027 N/A ALA 45.A N HIS 42.A O no hydrogen 3.018 N/A LEU 46.A N MET 41.A O no hydrogen 2.901 N/A GLY 47.A N ARG 3.A O no hydrogen 2.988 N/A ALA 48.A N ARG 3.A O no hydrogen 3.399 N/A SER 49.A N ARG 73.A O no hydrogen 2.910 N/A SER 49.A OG GLN 8.A OE1 no hydrogen 2.671 N/A ILE 50.A N ASP 5.A O no hydrogen 2.913 N/A ALA 51.A N ALA 76.A O no hydrogen 3.059 N/A VAL 52.A N GLN 8.A O no hydrogen 2.822 N/A GLN 53.A N VAL 78.A O no hydrogen 2.924 N/A GLN 53.A NE2 ARG 55.A O no hydrogen 2.986 N/A GLN 53.A NE2 GLN 106.A OE1 no hydrogen 2.930 N/A ALA 54.A N GLU 60.A OE2 no hydrogen 2.799 N/A ARG 55.A NE ASP 17.A O no hydrogen 3.281 N/A ARG 55.A NH1 ASP 59.A OD1 no hydrogen 3.537 N/A ARG 55.A NH1 ASP 59.A OD2 no hydrogen 3.464 N/A ARG 58.A NH1 ARG 91.A O no hydrogen 3.215 N/A ARG 58.A NH2 GLU 81.A OE1 no hydrogen 2.559 N/A ARG 58.A NH2 ARG 91.A O no hydrogen 3.486 N/A GLU 60.A N GLY 57.A O no hydrogen 3.090 N/A THR 61.A OG1 TRP 80.A O no hydrogen 2.594 N/A ALA 62.A N ARG 58.A O no hydrogen 2.970 N/A PHE 63.A N ASP 59.A O no hydrogen 2.913 N/A LEU 64.A N GLU 60.A O no hydrogen 2.941 N/A LEU 65.A N THR 61.A O no hydrogen 2.954 N/A GLU 66.A N ALA 62.A O no hydrogen 2.980 N/A LEU 67.A N PHE 63.A O no hydrogen 3.166 N/A ALA 68.A N LEU 64.A O no hydrogen 2.937 N/A CYS 69.A N LEU 65.A O no hydrogen 2.862 N/A ASP 70.A N GLU 66.A O no hydrogen 3.459 N/A GLU 71.A N.A LEU 67.A O no hydrogen 3.114 N/A GLU 71.A N.B LEU 67.A O no hydrogen 3.103 N/A ARG 73.A N GLU 71.A OE2.A no hydrogen 3.016 N/A ARG 73.A NH1 GLY 47.A O no hydrogen 3.198 N/A ILE 74.A N GLU 71.A O.A no hydrogen 3.339 N/A ILE 74.A N GLU 71.A O.B no hydrogen 3.024 N/A ALA 75.A N SER 49.A O no hydrogen 2.835 N/A VAL 77.A N LYS 99.A O no hydrogen 3.049 N/A VAL 78.A N ALA 51.A O no hydrogen 2.884 N/A GLY 79.A N GLY 102.A O no hydrogen 2.938 N/A TRP 80.A N THR 61.A OG1 no hydrogen 2.767 N/A ASP 82.A N GLU 81.A OE2 no hydrogen 2.936 N/A ARG 84.A N ASP 82.A OD1 no hydrogen 3.340 N/A ARG 84.A NE ASP 119.A OD2 no hydrogen 2.837 N/A ARG 84.A NH1 ASP 119.A OD1 no hydrogen 3.054 N/A ARG 84.A NH1 ASP 119.A OD2 no hydrogen 3.360 N/A ALA 85.A N ASP 82.A O no hydrogen 3.250 N/A GLN 87.A N GLN 87.A OE1 no hydrogen 2.825 N/A LEU 88.A N ALA 85.A O no hydrogen 3.122 N/A ARG 91.A N GLN 87.A O no hydrogen 2.935 N/A VAL 92.A N LEU 88.A O no hydrogen 3.022 N/A TRP 95.A N VAL 92.A O no hydrogen 2.668 N/A ARG 96.A N ALA 93.A O no hydrogen 3.143 N/A ARG 96.A NH1 ASN 132.A OD1 no hydrogen 2.603 N/A THR 98.A N TRP 95.A O no hydrogen 3.039 N/A THR 98.A OG1 TRP 95.A O no hydrogen 2.614 N/A LYS 99.A NZ ALA 68.A O no hydrogen 2.913 N/A LYS 99.A NZ ILE 74.A O no hydrogen 2.779 N/A LEU 100.A N THR 98.A OG1 no hydrogen 3.344 N/A ARG 101.A N VAL 77.A O no hydrogen 2.914 N/A ARG 101.A NE TYR 284.A O no hydrogen 3.220 N/A ARG 101.A NE ALA 285.A O no hydrogen 3.340 N/A ARG 101.A NH2 ALA 285.A O no hydrogen 3.341 N/A PHE 103.A N VAL 135.A O no hydrogen 2.955 N/A ARG 104.A N GLY 79.A O no hydrogen 3.026 N/A ARG 104.A NE GLN 53.A OE1 no hydrogen 2.936 N/A ARG 104.A NH1 GLN 53.A O no hydrogen 2.906 N/A ARG 104.A NH1 GLN 53.A OE1 no hydrogen 3.453 N/A ARG 104.A NH2 ASP 163.A OD2 no hydrogen 2.793 N/A HIS 105.A N TYR 136.A OH no hydrogen 3.377 N/A HIS 105.A NE2 GLU 110.A OE2 no hydrogen 3.053 N/A LEU 107.A N HIS 105.A O no hydrogen 2.880 N/A GLN 108.A NE2 ASP 109.A OD1 no hydrogen 3.523 N/A ASP 109.A N GLN 106.A O no hydrogen 3.112 N/A GLU 110.A N LEU 107.A O no hydrogen 2.986 N/A ARG 114.A NE ASP 118.A OD2 no hydrogen 2.733 N/A ALA 115.A N ASP 112.A OD1 no hydrogen 3.192 N/A PHE 116.A N ASP 112.A O no hydrogen 3.091 N/A VAL 117.A N VAL 113.A O no hydrogen 2.910 N/A ASP 118.A N ARG 114.A O no hydrogen 3.181 N/A ASP 119.A N PHE 116.A O no hydrogen 3.323 N/A PHE 122.A N ASP 119.A OD2 no hydrogen 2.840 N/A ALA 123.A N ASP 119.A O no hydrogen 2.913 N/A ARG 124.A N ALA 120.A O no hydrogen 2.984 N/A ARG 124.A NH1 ASP 121.A OD1 no hydrogen 2.807 N/A ARG 124.A NH2 ASP 121.A OD1 no hydrogen 3.017 N/A GLY 125.A N ASP 121.A O no hydrogen 3.201 N/A VAL 126.A N PHE 122.A O no hydrogen 3.040 N/A ALA 127.A N ALA 123.A O no hydrogen 2.909 N/A TRP 128.A N ARG 124.A O no hydrogen 2.826 N/A LEU 129.A N GLY 125.A O no hydrogen 2.764 N/A GLN 130.A N VAL 126.A O no hydrogen 3.021 N/A GLN 130.A NE2 HIS 155.A O no hydrogen 2.972 N/A ALA 131.A N ALA 127.A O no hydrogen 2.998 N/A ASN 132.A N TRP 128.A O no hydrogen 3.106 N/A ASN 132.A N LEU 129.A O no hydrogen 3.124 N/A ASN 132.A ND2 TRP 128.A O no hydrogen 2.969 N/A ASP 133.A N GLN 130.A O no hydrogen 3.102 N/A TYR 134.A N LEU 129.A O no hydrogen 2.793 N/A VAL 135.A N ARG 101.A O no hydrogen 3.084 N/A TYR 136.A N TRP 159.A O no hydrogen 3.447 N/A ASP 137.A N PHE 103.A O no hydrogen 2.957 N/A VAL 138.A N VAL 161.A O no hydrogen 2.730 N/A PHE 141.A N GLN 144.A OE1 no hydrogen 3.095 N/A GLN 144.A N PHE 141.A O no hydrogen 2.959 N/A GLN 144.A NE2 GLN 108.A O no hydrogen 3.230 N/A LEU 145.A N GLU 142.A O no hydrogen 2.928 N/A VAL 148.A N LEU 145.A O no hydrogen 3.138 N/A GLN 149.A N PRO 146.A O no hydrogen 3.468 N/A GLN 149.A NE2 GLU 189.A O no hydrogen 2.989 N/A CYS 152.A N VAL 148.A O no hydrogen 3.025 N/A CYS 152.A SG VAL 148.A O no hydrogen 3.419 N/A ALA 153.A N GLN 149.A O no hydrogen 3.136 N/A ARG 154.A N ALA 150.A O no hydrogen 2.998 N/A HIS 155.A N PHE 151.A O no hydrogen 3.192 N/A ALA 157.A N GLN 130.A OE1 no hydrogen 3.078 N/A LEU 160.A N HIS 195.A O no hydrogen 2.940 N/A VAL 161.A N TYR 136.A O no hydrogen 3.014 N/A LEU 162.A N VAL 197.A O no hydrogen 2.779 N/A ASP 163.A N VAL 138.A O no hydrogen 2.838 N/A HIS 164.A ND1 SER 201.A OG no hydrogen 2.860 N/A GLY 166.A N ASP 163.A O no hydrogen 3.118 N/A LYS 167.A N HIS 164.A O no hydrogen 2.917 N/A LYS 167.A NZ GLN 108.A OE1 no hydrogen 3.143 N/A LEU 170.A N PRO 168.A O no hydrogen 2.775 N/A GLU 172.A N ALA 169.A O no hydrogen 2.862 N/A PHE 173.A N LEU 170.A O no hydrogen 3.397 N/A THR 178.A N ASP 176.A OD2 no hydrogen 2.973 N/A THR 178.A OG1 ASP 176.A OD2 no hydrogen 3.139 N/A ALA 181.A N ASP 177.A O no hydrogen 2.942 N/A ARG 182.A N THR 178.A O no hydrogen 2.867 N/A ARG 182.A NE GLU 142.A OE1 no hydrogen 3.139 N/A ARG 182.A NE GLU 142.A OE2 no hydrogen 3.375 N/A ARG 182.A NH2 GLU 142.A OE2 no hydrogen 2.485 N/A TRP 183.A N ALA 179.A O no hydrogen 3.035 N/A TRP 183.A NE1 ALA 165.A O no hydrogen 2.780 N/A ARG 184.A N LEU 180.A O no hydrogen 2.794 N/A ALA 185.A N ALA 181.A O no hydrogen 3.085 N/A ALA 186.A N ARG 182.A O no hydrogen 3.341 N/A LEU 187.A N TRP 183.A O no hydrogen 2.872 N/A ARG 188.A N ARG 184.A O no hydrogen 3.027 N/A GLU 189.A N ALA 185.A O no hydrogen 3.212 N/A LEU 190.A N ALA 186.A O no hydrogen 3.212 N/A ALA 191.A N LEU 187.A O no hydrogen 2.817 N/A ALA 192.A N ARG 188.A O no hydrogen 3.119 N/A LEU 193.A N LEU 190.A O no hydrogen 3.009 N/A HIS 195.A NE2 CYS 152.A O no hydrogen 2.537 N/A VAL 196.A N LEU 193.A O no hydrogen 3.128 N/A VAL 197.A N LEU 160.A O no hydrogen 2.887 N/A CYS 198.A N ARG 236.A O no hydrogen 2.869 N/A CYS 198.A SG LYS 199.A O no hydrogen 4.018 N/A LYS 199.A N LEU 162.A O no hydrogen 2.993 N/A LYS 199.A NZ SER 6.A O no hydrogen 2.719 N/A LYS 199.A NZ ASP 137.A OD2 no hydrogen 3.022 N/A LEU 200.A N MET 238.A O no hydrogen 2.828 N/A SER 201.A OG HIS 164.A ND1 no hydrogen 2.860 N/A THR 205.A OG1 GLY 202.A O no hydrogen 3.567 N/A GLU 206.A N LEU 203.A O no hydrogen 3.008 N/A TRP 209.A N ALA 207.A O no hydrogen 2.833 N/A ARG 210.A NH1 ALA 23.A O no hydrogen 2.895 N/A ARG 210.A NH2 ALA 23.A O no hydrogen 3.260 N/A ARG 211.A N ASP 208.A O no hydrogen 3.246 N/A GLY 212.A N TRP 209.A O no hydrogen 2.759 N/A ARG 214.A N ASP 217.A OD2 no hydrogen 2.823 N/A ASP 217.A N ARG 214.A O no hydrogen 2.935 N/A LEU 218.A N ARG 214.A O no hydrogen 3.239 N/A ARG 219.A N ALA 215.A O no hydrogen 3.103 N/A HIS 220.A N SER 216.A O no hydrogen 2.880 N/A ILE 221.A N ASP 217.A O no hydrogen 2.916 N/A GLU 222.A N.A LEU 218.A O no hydrogen 2.988 N/A GLU 222.A N.B LEU 218.A O no hydrogen 2.977 N/A GLN 223.A N ARG 219.A O no hydrogen 3.040 N/A CYS 224.A N HIS 220.A O no hydrogen 3.150 N/A CYS 224.A SG HIS 220.A O no hydrogen 3.570 N/A LEU 225.A N ILE 221.A O no hydrogen 2.952 N/A ASP 226.A N GLU 222.A O.A no hydrogen 2.982 N/A ASP 226.A N GLU 222.A O.B no hydrogen 2.903 N/A ALA 227.A N GLN 223.A O no hydrogen 2.940 N/A ALA 228.A N CYS 224.A O no hydrogen 2.885 N/A LEU 229.A N LEU 225.A O no hydrogen 2.817 N/A ASP 230.A N ASP 226.A O no hydrogen 2.843 N/A ALA 231.A N ALA 227.A O no hydrogen 2.976 N/A PHE 232.A N ALA 228.A O no hydrogen 2.924 N/A GLY 233.A N LEU 229.A O no hydrogen 2.919 N/A ARG 236.A N GLY 233.A O no hydrogen 3.216 N/A ARG 236.A NE PHE 232.A O no hydrogen 2.977 N/A ARG 236.A NH1 ALA 191.A O no hydrogen 2.758 N/A ARG 236.A NH1 PHE 232.A O no hydrogen 3.200 N/A ARG 236.A NH2 ALA 191.A O no hydrogen 3.054 N/A ARG 236.A NH2 VAL 196.A O no hydrogen 2.921 N/A MET 238.A N CYS 198.A O no hydrogen 3.000 N/A PHE 239.A N LEU 275.A O no hydrogen 2.905 N/A GLY 240.A N LEU 200.A O no hydrogen 3.297 N/A SER 241.A N ASP 5.A OD1 no hydrogen 2.880 N/A SER 241.A OG ASP 5.A OD1 no hydrogen 3.390 N/A SER 241.A OG ASP 5.A OD2 no hydrogen 2.580 N/A ASP 242.A N HIS 7.A O no hydrogen 2.847 N/A TRP 243.A N SER 241.A OG no hydrogen 2.979 N/A CYS 246.A N ASP 242.A O no hydrogen 2.957 N/A CYS 246.A SG ALA 250.A O no hydrogen 4.038 N/A LEU 247.A N PRO 244.A O no hydrogen 3.040 N/A LEU 248.A N VAL 245.A O no hydrogen 3.127 N/A ALA 249.A N CYS 246.A O no hydrogen 2.792 N/A ALA 250.A N CYS 246.A O no hydrogen 2.954 N/A SER 251.A N GLU 254.A OE1 no hydrogen 2.968 N/A TYR 252.A OH ASP 5.A OD2 no hydrogen 2.733 N/A GLU 254.A N SER 251.A OG no hydrogen 3.058 N/A VAL 255.A N SER 251.A O no hydrogen 3.053 N/A ALA 256.A N TYR 252.A O no hydrogen 3.054 N/A SER 257.A N ASP 253.A O no hydrogen 2.905 N/A SER 257.A OG ASP 253.A O no hydrogen 2.940 N/A LEU 258.A N GLU 254.A O no hydrogen 2.954 N/A VAL 259.A N VAL 255.A O no hydrogen 3.316 N/A GLU 260.A N ALA 256.A O no hydrogen 2.872 N/A ARG 261.A N SER 257.A O no hydrogen 2.844 N/A TRP 262.A N LEU 258.A O no hydrogen 3.229 N/A TRP 262.A NE1 ASP 226.A OD1 no hydrogen 2.912 N/A ALA 263.A N VAL 259.A O no hydrogen 2.803 N/A GLU 264.A N GLU 260.A O no hydrogen 2.863 N/A SER 265.A N TRP 262.A O no hydrogen 3.170 N/A SER 265.A OG ARG 261.A O no hydrogen 3.309 N/A SER 265.A OG TRP 262.A O no hydrogen 3.037 N/A ARG 266.A N.A TRP 262.A O no hydrogen 3.028 N/A ARG 266.A N.B TRP 262.A O no hydrogen 3.021 N/A ARG 266.A NE.A ASP 226.A OD1 no hydrogen 2.850 N/A ARG 266.A NH1.A SER 265.A OG no hydrogen 3.023 N/A ARG 266.A NH2.A GLU 222.A OE2.B no hydrogen 1.461 N/A ARG 266.A NH2.A ASP 226.A OD1 no hydrogen 3.377 N/A ARG 266.A NH2.A ASP 226.A OD2 no hydrogen 3.190 N/A ARG 266.A NH2.B ASP 226.A OD1 no hydrogen 2.784 N/A LEU 267.A N ALA 263.A O no hydrogen 2.834 N/A SER 268.A N GLU 271.A OE1 no hydrogen 3.069 N/A GLU 271.A N SER 268.A OG no hydrogen 3.226 N/A ARG 272.A N SER 268.A O no hydrogen 2.850 N/A ARG 272.A NE LEU 267.A O no hydrogen 3.103 N/A ARG 272.A NH2 LEU 267.A O no hydrogen 2.923 N/A SER 273.A N ALA 269.A O no hydrogen 3.155 N/A SER 273.A OG ALA 269.A O no hydrogen 3.286 N/A ALA 274.A N ALA 270.A O no hydrogen 3.264 N/A LEU 275.A N GLU 271.A O no hydrogen 2.972 N/A TRP 276.A N ARG 272.A O no hydrogen 2.832 N/A GLY 277.A N ALA 274.A O no hydrogen 3.412 N/A GLY 278.A N SER 273.A O no hydrogen 2.990 N/A THR 279.A N ALA 274.A O no hydrogen 3.003 N/A THR 279.A OG1 GLN 235.A O no hydrogen 3.171 N/A THR 279.A OG1 LEU 237.A O no hydrogen 3.428 N/A THR 279.A OG1 ALA 274.A O no hydrogen 3.248 N/A ALA 281.A N GLY 277.A O no hydrogen 2.919 N/A ARG 282.A N GLY 278.A O no hydrogen 3.219 N/A ARG 282.A NH2 GLN 235.A O no hydrogen 2.778 N/A CYS 283.A N THR 279.A O no hydrogen 2.971 N/A CYS 283.A SG THR 279.A O no hydrogen 3.294 N/A TYR 284.A N ALA 280.A O no hydrogen 2.904 N/A TYR 284.A OH ASP 137.A OD1 no hydrogen 2.731 N/A LEU 286.A N ALA 281.A O no hydrogen 2.709 N/A