Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1a0p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N GLN 1.A O no hydrogen 2.915 N/A ARG 5.A NH1 ASP 2.A OD1 no hydrogen 2.568 N/A ILE 6.A N ASP 2.A O no hydrogen 3.151 N/A ILE 6.A N LEU 3.A O no hydrogen 3.283 N/A GLU 7.A N LEU 3.A O no hydrogen 3.188 N/A GLN 8.A N ALA 4.A O no hydrogen 2.679 N/A PHE 9.A N ARG 5.A O no hydrogen 3.020 N/A LEU 10.A N ILE 6.A O no hydrogen 2.940 N/A ASP 11.A N GLU 7.A O no hydrogen 2.900 N/A ALA 12.A N GLN 8.A O no hydrogen 2.877 N/A LEU 13.A N PHE 9.A O no hydrogen 2.535 N/A TRP 14.A N LEU 10.A O no hydrogen 2.421 N/A LEU 15.A N ASP 11.A O no hydrogen 2.711 N/A GLU 16.A N LEU 13.A O no hydrogen 2.955 N/A LEU 24.A N ALA 20.A O no hydrogen 2.604 N/A ASN 25.A N GLU 21.A O no hydrogen 2.941 N/A ASN 25.A N ASN 22.A O no hydrogen 2.603 N/A ALA 26.A N ASN 22.A O no hydrogen 2.634 N/A TYR 27.A N THR 23.A O no hydrogen 2.747 N/A ARG 28.A N LEU 24.A O no hydrogen 2.708 N/A ARG 28.A NH1 GLU 7.A OE2 no hydrogen 2.814 N/A ARG 29.A N ASN 25.A O no hydrogen 2.863 N/A ASP 30.A N ALA 26.A O no hydrogen 2.862 N/A LEU 31.A N TYR 27.A O no hydrogen 2.978 N/A SER 32.A N ARG 28.A O no hydrogen 3.023 N/A SER 32.A OG ARG 28.A O no hydrogen 2.314 N/A MET 33.A N ARG 29.A O no hydrogen 2.894 N/A MET 34.A N ASP 30.A O no hydrogen 2.974 N/A VAL 35.A N LEU 31.A O no hydrogen 2.644 N/A GLU 36.A N SER 32.A O no hydrogen 2.867 N/A TRP 37.A N MET 33.A O no hydrogen 2.673 N/A TRP 37.A NE1 GLU 59.A OE1 no hydrogen 2.777 N/A LEU 38.A N MET 34.A O no hydrogen 2.846 N/A HIS 39.A N VAL 35.A O no hydrogen 2.784 N/A HIS 40.A N GLU 36.A O no hydrogen 2.824 N/A ARG 41.A N TRP 37.A O no hydrogen 3.089 N/A ARG 41.A NH1 TRP 37.A O no hydrogen 3.085 N/A GLY 42.A N HIS 39.A O no hydrogen 2.654 N/A THR 44.A N THR 47.A OG1 no hydrogen 3.066 N/A THR 44.A OG1 ASP 2.A OD2 no hydrogen 2.932 N/A LEU 45.A N ASP 2.A OD2 no hydrogen 2.806 N/A THR 47.A N THR 44.A O no hydrogen 3.174 N/A ALA 48.A N THR 44.A O no hydrogen 2.959 N/A GLN 49.A N ASP 52.A OD2 no hydrogen 2.923 N/A LEU 53.A N GLN 49.A O no hydrogen 2.851 N/A GLN 54.A N SER 50.A O no hydrogen 2.699 N/A ALA 55.A N ASP 51.A O no hydrogen 2.715 N/A LEU 56.A N ASP 52.A O no hydrogen 3.062 N/A LEU 57.A N LEU 53.A O no hydrogen 3.372 N/A ALA 58.A N GLN 54.A O no hydrogen 3.272 N/A GLU 59.A N ALA 55.A O no hydrogen 2.866 N/A LEU 66.A N SER 62.A O no hydrogen 2.873 N/A LEU 67.A N SER 63.A O no hydrogen 2.628 N/A SER 68.A N ALA 64.A O no hydrogen 2.811 N/A SER 68.A OG ARG 65.A O no hydrogen 2.488 N/A ALA 69.A N ARG 65.A O no hydrogen 2.825 N/A VAL 70.A N LEU 66.A O no hydrogen 3.083 N/A ARG 71.A N LEU 67.A O no hydrogen 2.820 N/A ARG 71.A NE SER 88.A O no hydrogen 3.073 N/A ARG 71.A NH2 ALA 89.A O no hydrogen 3.374 N/A ARG 72.A N SER 68.A O no hydrogen 3.010 N/A LEU 73.A N ALA 69.A O no hydrogen 2.997 N/A PHE 74.A N VAL 70.A O no hydrogen 3.181 N/A GLN 75.A N ARG 71.A O no hydrogen 2.711 N/A TYR 76.A N ARG 72.A O no hydrogen 2.825 N/A LEU 77.A N LEU 73.A O no hydrogen 2.833 N/A ARG 79.A N GLN 75.A O no hydrogen 2.862 N/A GLU 80.A N TYR 76.A O no hydrogen 2.946 N/A LYS 81.A N TYR 78.A O no hydrogen 2.990 N/A PHE 82.A N LEU 77.A O no hydrogen 2.494 N/A ARG 83.A N LEU 77.A O no hydrogen 3.405 N/A ARG 83.A NH1 ASP 85.A OD1 no hydrogen 3.192 N/A ARG 83.A NH1 ASP 85.A OD2 no hydrogen 2.845 N/A ARG 83.A NH2 LEU 45.A O no hydrogen 3.114 N/A ARG 83.A NH2 ALA 48.A O no hydrogen 2.444 N/A SER 88.A N ASP 86.A OD1 no hydrogen 2.795 N/A SER 88.A OG ASP 86.A OD1 no hydrogen 2.615 N/A SER 88.A OG ASP 86.A OD2 no hydrogen 3.048 N/A ALA 89.A N ASP 86.A O no hydrogen 3.054 N/A GLN 98.A NE2 SER 95.A OG no hydrogen 2.680 N/A VAL 99.A N SER 95.A O no hydrogen 3.267 N/A VAL 99.A N GLU 96.A O no hydrogen 2.880 N/A GLU 100.A N GLU 96.A O no hydrogen 2.804 N/A ARG 101.A N ALA 97.A O no hydrogen 2.810 N/A ARG 101.A NH1 ALA 215.A O no hydrogen 3.467 N/A LEU 102.A N GLN 98.A O no hydrogen 3.164 N/A LEU 103.A N VAL 99.A O no hydrogen 3.203 N/A GLN 104.A N GLU 100.A O no hydrogen 2.977 N/A ALA 105.A N LEU 102.A O no hydrogen 2.973 N/A LEU 107.A N GLU 113.A OE1 no hydrogen 2.802 N/A GLN 110.A N LEU 107.A O no hydrogen 3.105 N/A GLU 113.A N GLN 110.A O no hydrogen 3.148 N/A LEU 114.A N GLN 110.A O no hydrogen 3.041 N/A LEU 114.A N PRO 111.A O no hydrogen 3.153 N/A ARG 115.A N PRO 111.A O no hydrogen 3.001 N/A ARG 115.A NE ASP 116.A OD1 no hydrogen 2.780 N/A ARG 115.A NH1 PRO 192.A O no hydrogen 2.975 N/A ARG 115.A NH2 ASP 116.A OD1 no hydrogen 2.401 N/A ASP 116.A N LEU 112.A O no hydrogen 2.915 N/A LYS 117.A N GLU 113.A O no hydrogen 2.618 N/A LYS 117.A NZ LEU 103.A O no hydrogen 2.766 N/A LYS 117.A NZ GLU 121.A OE2 no hydrogen 3.048 N/A ALA 118.A N LEU 114.A O no hydrogen 2.875 N/A MET 119.A N ARG 115.A O no hydrogen 2.864 N/A LEU 120.A N ASP 116.A O no hydrogen 3.081 N/A GLU 121.A N LYS 117.A O no hydrogen 3.025 N/A VAL 122.A N ALA 118.A O no hydrogen 3.047 N/A LEU 123.A N MET 119.A O no hydrogen 2.829 N/A TYR 124.A N LEU 120.A O no hydrogen 2.843 N/A TYR 124.A OH HIS 234.A ND1 no hydrogen 2.807 N/A ALA 125.A N GLU 121.A O no hydrogen 3.132 N/A THR 126.A N VAL 122.A O no hydrogen 2.869 N/A THR 126.A OG1 VAL 122.A O no hydrogen 2.779 N/A GLY 127.A N LEU 123.A O no hydrogen 3.092 N/A LEU 128.A N THR 126.A OG1 no hydrogen 3.019 N/A ARG 129.A N GLU 132.A OE1 no hydrogen 2.700 N/A SER 131.A OG LEU 15.A O no hydrogen 3.207 N/A GLU 132.A N ARG 129.A O no hydrogen 2.846 N/A LEU 133.A N ARG 129.A O no hydrogen 3.083 N/A LEU 133.A N VAL 130.A O no hydrogen 2.740 N/A VAL 134.A N VAL 130.A O no hydrogen 3.188 N/A LEU 136.A N LEU 133.A O no hydrogen 3.382 N/A THR 137.A N ASP 140.A OD2 no hydrogen 2.633 N/A THR 137.A OG1 ASP 140.A OD2 no hydrogen 2.567 N/A MET 138.A N ASP 188.A O no hydrogen 2.415 N/A ASP 140.A N THR 137.A O no hydrogen 2.840 N/A SER 142.A N VAL 147.A O no hydrogen 3.104 N/A GLN 145.A N SER 142.A OG no hydrogen 2.818 N/A GLY 146.A N SER 142.A O no hydrogen 2.460 N/A VAL 147.A N SER 142.A O no hydrogen 3.072 N/A VAL 148.A N VAL 160.A O no hydrogen 2.956 N/A ARG 149.A N ASP 140.A O no hydrogen 2.706 N/A VAL 150.A N ARG 158.A O no hydrogen 2.626 N/A GLY 152.A N LYS 156.A O no hydrogen 2.613 N/A LYS 153.A NZ ASP 11.A OD1 no hydrogen 2.841 N/A ARG 158.A N VAL 150.A O no hydrogen 3.105 N/A ARG 158.A NH1 GLU 132.A OE2 no hydrogen 3.296 N/A VAL 160.A N VAL 148.A O no hydrogen 2.795 N/A LEU 162.A N GLY 146.A O no hydrogen 2.946 N/A VAL 167.A N GLY 163.A O no hydrogen 3.124 N/A TYR 168.A N GLU 164.A O no hydrogen 2.937 N/A TRP 169.A N GLU 165.A O no hydrogen 2.854 N/A TRP 169.A NE1 GLU 165.A OE1 no hydrogen 3.203 N/A LEU 170.A N ALA 166.A O no hydrogen 2.834 N/A GLU 171.A N VAL 167.A O no hydrogen 2.802 N/A THR 172.A N TYR 168.A O no hydrogen 2.996 N/A THR 172.A OG1 TYR 168.A O no hydrogen 3.345 N/A TYR 173.A N TRP 169.A O no hydrogen 2.739 N/A TYR 173.A OH LEU 190.A O no hydrogen 2.588 N/A LEU 174.A N LEU 170.A O no hydrogen 2.640 N/A GLU 175.A N GLU 171.A O no hydrogen 3.001 N/A HIS 176.A N THR 172.A O no hydrogen 2.660 N/A GLY 177.A N TYR 173.A O no hydrogen 3.160 N/A ARG 178.A N TYR 173.A O no hydrogen 3.048 N/A ARG 178.A NE VAL 189.A O no hydrogen 3.261 N/A ARG 178.A NH2 ILE 187.A O no hydrogen 2.528 N/A ARG 178.A NH2 VAL 189.A O no hydrogen 2.894 N/A LEU 181.A N GLY 177.A O no hydrogen 2.998 N/A LEU 182.A N ARG 178.A O no hydrogen 2.907 N/A ASN 183.A N PRO 179.A O no hydrogen 2.956 N/A VAL 185.A N LEU 182.A O no hydrogen 2.965 N/A LEU 190.A N LEU 136.A O no hydrogen 2.922 N/A SER 193.A N GLN 197.A O no hydrogen 2.808 N/A ARG 195.A N SER 193.A OG no hydrogen 2.943 N/A ARG 195.A NE ARG 195.A O no hydrogen 3.401 N/A ALA 196.A N SER 193.A O no hydrogen 2.672 N/A GLN 197.A N SER 193.A OG no hydrogen 2.869 N/A THR 200.A N THR 203.A OG1 no hydrogen 2.937 N/A THR 203.A N THR 200.A OG1 no hydrogen 2.828 N/A THR 203.A OG1 THR 200.A O no hydrogen 3.178 N/A PHE 204.A N THR 200.A O no hydrogen 2.900 N/A TRP 205.A N ARG 201.A O no hydrogen 2.932 N/A TRP 205.A N GLN 202.A O no hydrogen 3.092 N/A HIS 206.A N GLN 202.A O no hydrogen 3.261 N/A ARG 207.A NE ASP 116.A OD2 no hydrogen 2.467 N/A ARG 207.A NH2 TYR 211.A OH no hydrogen 3.016 N/A ILE 208.A N PHE 204.A O no hydrogen 3.115 N/A LYS 209.A N TRP 205.A O no hydrogen 2.865 N/A HIS 210.A N HIS 206.A O no hydrogen 2.976 N/A TYR 211.A N ARG 207.A O no hydrogen 2.828 N/A TYR 211.A OH ASP 116.A OD2 no hydrogen 2.617 N/A ALA 212.A N ILE 208.A O no hydrogen 2.692 N/A VAL 213.A N LYS 209.A O no hydrogen 2.562 N/A LEU 214.A N HIS 210.A O no hydrogen 3.161 N/A ALA 215.A N TYR 211.A O no hydrogen 3.074 N/A GLY 216.A N VAL 213.A O no hydrogen 2.954 N/A ILE 217.A N ALA 212.A O no hydrogen 3.006 N/A GLU 220.A N ASP 218.A OD1 no hydrogen 3.166 N/A LYS 221.A N ASP 218.A O no hydrogen 3.362 N/A LEU 222.A N ASP 218.A O no hydrogen 3.225 N/A VAL 226.A N SER 223.A OG no hydrogen 3.133 N/A LEU 227.A N SER 223.A O no hydrogen 2.958 N/A ARG 228.A N PRO 224.A O no hydrogen 2.610 N/A ARG 228.A NE GLY 127.A O no hydrogen 2.571 N/A ARG 228.A NH2 GLY 127.A O no hydrogen 3.344 N/A HIS 229.A N HIS 225.A O no hydrogen 2.802 N/A HIS 229.A ND1 THR 254.A OG1 no hydrogen 2.964 N/A ALA 230.A N VAL 226.A O no hydrogen 2.646 N/A PHE 231.A N LEU 227.A O no hydrogen 2.743 N/A ALA 232.A N ARG 228.A O no hydrogen 2.970 N/A THR 233.A N HIS 229.A O no hydrogen 3.166 N/A HIS 234.A N ALA 230.A O no hydrogen 2.995 N/A HIS 234.A ND1 TYR 124.A OH no hydrogen 2.807 N/A HIS 234.A NE2 GLU 100.A OE2 no hydrogen 2.654 N/A LEU 235.A N PHE 231.A O no hydrogen 2.734 N/A LEU 236.A N ALA 232.A O no hydrogen 2.923 N/A ASN 237.A N THR 233.A O no hydrogen 2.906 N/A HIS 238.A N LEU 235.A O no hydrogen 3.229 N/A GLY 239.A N LEU 235.A O no hydrogen 2.607 N/A VAL 245.A N LEU 242.A O no hydrogen 3.250 N/A SER 253.A OG GLU 80.A O no hydrogen 3.544 N/A THR 254.A N GLU 80.A O no hydrogen 2.847 N/A THR 254.A OG1 GLU 80.A O no hydrogen 3.128 N/A THR 254.A OG1 HIS 229.A ND1 no hydrogen 2.964 N/A THR 255.A N GLU 80.A OE1 no hydrogen 3.037 N/A THR 255.A OG1 GLU 80.A OE1 no hydrogen 2.585 N/A ILE 257.A N SER 253.A O no hydrogen 2.849 N/A TYR 258.A N THR 254.A O no hydrogen 2.927 N/A TYR 258.A OH TYR 124.A O no hydrogen 2.949 N/A THR 259.A N THR 255.A O no hydrogen 2.962 N/A THR 259.A OG1 THR 255.A O no hydrogen 3.039 N/A HIS 260.A N GLN 256.A O no hydrogen 3.151 N/A VAL 261.A N ILE 257.A O no hydrogen 3.038 N/A ALA 262.A N TYR 258.A O no hydrogen 2.954 N/A THR 263.A N THR 259.A O no hydrogen 2.877 N/A THR 263.A OG1 THR 259.A O no hydrogen 3.296 N/A GLU 264.A N HIS 260.A O no hydrogen 2.821 N/A ARG 265.A N VAL 261.A O no hydrogen 3.123 N/A ARG 265.A NH1 ASP 241.A OD1 no hydrogen 3.236 N/A ARG 265.A NH1 ASP 241.A OD2 no hydrogen 2.878 N/A LEU 266.A N ALA 262.A O no hydrogen 3.071 N/A ARG 267.A N THR 263.A O no hydrogen 3.248 N/A ARG 267.A NH1 GLU 264.A OE1 no hydrogen 3.318 N/A ARG 267.A NH2 GLN 271.A OE1 no hydrogen 2.708 N/A GLN 268.A N GLU 264.A O no hydrogen 3.060 N/A GLN 268.A NE2 ASP 241.A O no hydrogen 2.686 N/A LEU 269.A N ARG 265.A O no hydrogen 3.070 N/A HIS 270.A N LEU 266.A O no hydrogen 3.130 N/A GLN 271.A N GLN 268.A O no hydrogen 3.325 N/A