Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2a84_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 5.A N ASN 10.A OD1 no hydrogen 2.813 N/A GLY 7.A N GLU 87.A OE1 no hydrogen 2.828 N/A GLU 8.A N HIS 5.A O no hydrogen 3.320 N/A ASN 10.A N GLU 87.A O no hydrogen 2.851 N/A ASN 10.A ND2 HIS 5.A O no hydrogen 2.930 N/A ASN 10.A ND2 GLU 87.A O no hydrogen 2.998 N/A TYR 12.A N ALA 89.A O no hydrogen 2.913 N/A TYR 12.A OH ALA 3.A O no hydrogen 2.741 N/A SER 13.A OG THR 91.A O no hydrogen 2.826 N/A SER 13.A OG THR 91.A OG1 no hydrogen 2.908 N/A ASP 17.A N ALA 14.A O no hydrogen 3.041 N/A VAL 18.A N ALA 14.A O no hydrogen 3.432 N/A ALA 19.A N PRO 15.A O no hydrogen 2.925 N/A ASP 20.A N GLY 16.A O no hydrogen 2.914 N/A VAL 21.A N ASP 17.A O no hydrogen 3.011 N/A SER 22.A N VAL 18.A O no hydrogen 2.850 N/A SER 22.A OG VAL 138.A O no hydrogen 2.495 N/A ARG 23.A N ALA 19.A O no hydrogen 3.072 N/A ARG 23.A NH1 ASP 20.A OD1 no hydrogen 3.196 N/A ALA 24.A N ASP 20.A O no hydrogen 3.108 N/A LEU 25.A N VAL 21.A O no hydrogen 2.982 N/A ARG 26.A N SER 22.A O no hydrogen 2.912 N/A ARG 26.A NE.A ASP 141.A OD1 no hydrogen 3.083 N/A ARG 26.A NE.B SER 22.A OG no hydrogen 2.996 N/A ARG 26.A NH1.A ARG 26.A O no hydrogen 3.304 N/A ARG 26.A NH2.A ASP 141.A OD1 no hydrogen 3.139 N/A LEU 27.A N ARG 23.A O no hydrogen 3.149 N/A THR 28.A N LEU 25.A O no hydrogen 3.013 N/A THR 28.A OG1 LEU 25.A O no hydrogen 2.668 N/A GLY 29.A N ARG 26.A O no hydrogen 3.034 N/A ARG 30.A NE GLY 57.A O no hydrogen 2.795 N/A ARG 30.A NH1 GLU 87.A OE1 no hydrogen 3.013 N/A ARG 30.A NH2 GLY 57.A O no hydrogen 3.252 N/A ARG 30.A NH2 SER 58.A O no hydrogen 2.975 N/A ARG 30.A NH2 GLU 87.A OE2 no hydrogen 2.760 N/A ARG 31.A NH2 PRO 56.A O no hydrogen 2.917 N/A VAL 32.A N ASP 141.A OD2 no hydrogen 2.870 N/A MET 33.A N VAL 59.A O no hydrogen 2.856 N/A LEU 34.A N ARG 142.A O no hydrogen 3.019 N/A VAL 35.A N VAL 61.A O no hydrogen 2.870 N/A THR 37.A N SER 63.A O no hydrogen 2.882 N/A THR 37.A OG1 SER 63.A O no hydrogen 2.784 N/A GLY 39.A N THR 37.A OG1 no hydrogen 3.089 N/A ALA 40.A N ASP 77.A OD2 no hydrogen 2.784 N/A LEU 41.A N ASP 77.A OD1 no hydrogen 2.889 N/A HIS 42.A N HIS 45.A ND1 no hydrogen 2.911 N/A GLY 44.A N HIS 42.A ND1 no hydrogen 2.933 N/A LEU 46.A N HIS 42.A O no hydrogen 3.040 N/A ALA 47.A N GLU 43.A O no hydrogen 3.024 N/A VAL 49.A N HIS 45.A O no hydrogen 3.098 N/A ARG 50.A N LEU 46.A O no hydrogen 2.801 N/A ARG 50.A NE GLU 84.A OE1 no hydrogen 2.883 N/A ARG 50.A NH1 GLU 43.A OE1 no hydrogen 3.124 N/A ARG 50.A NH2 GLU 84.A OE2 no hydrogen 2.829 N/A ALA 51.A N ALA 47.A O no hydrogen 2.917 N/A ALA 52.A N LEU 48.A O no hydrogen 3.000 N/A LYS 53.A N VAL 49.A O no hydrogen 2.856 N/A LYS 53.A NZ GLY 85.A O no hydrogen 2.861 N/A ARG 54.A N ARG 50.A O no hydrogen 3.067 N/A VAL 55.A N ALA 52.A O no hydrogen 3.228 N/A SER 58.A N VAL 55.A O no hydrogen 3.102 N/A SER 58.A OG ALA 52.A O no hydrogen 3.117 N/A SER 58.A OG VAL 55.A O no hydrogen 2.951 N/A VAL 59.A N ARG 31.A O no hydrogen 2.821 N/A VAL 61.A N MET 33.A O no hydrogen 2.858 N/A VAL 62.A N ILE 88.A O no hydrogen 2.950 N/A SER 63.A N VAL 35.A O no hydrogen 3.137 N/A ILE 64.A N PHE 90.A O no hydrogen 2.849 N/A PHE 65.A N THR 37.A O no hydrogen 3.062 N/A GLN 70.A NE2 THR 122.A O no hydrogen 2.783 N/A ALA 73.A N GLN 70.A O no hydrogen 3.247 N/A ASP 77.A N ASP 75.A OD1 no hydrogen 2.969 N/A GLN 80.A N ASP 76.A O no hydrogen 2.907 N/A GLN 80.A NE2 LEU 41.A O no hydrogen 3.116 N/A GLN 80.A NE2 ASP 76.A OD1 no hydrogen 3.356 N/A LEU 81.A N ASP 77.A O no hydrogen 3.066 N/A ARG 82.A N LEU 78.A O no hydrogen 2.887 N/A ALA 83.A N ALA 79.A O no hydrogen 3.072 N/A GLU 84.A N GLN 80.A O no hydrogen 3.143 N/A GLU 84.A N LEU 81.A O no hydrogen 3.038 N/A GLY 85.A N ARG 82.A O no hydrogen 3.098 N/A VAL 86.A N LEU 81.A O no hydrogen 3.143 N/A ILE 88.A N VAL 60.A O no hydrogen 3.213 N/A ALA 89.A N ASN 10.A O no hydrogen 2.919 N/A PHE 90.A N VAL 62.A O no hydrogen 2.895 N/A THR 91.A N TYR 12.A O no hydrogen 2.882 N/A THR 91.A OG1 TYR 12.A O no hydrogen 3.524 N/A THR 91.A OG1 SER 13.A OG no hydrogen 2.908 N/A ALA 96.A N THR 93.A OG1 no hydrogen 2.965 N/A MET 97.A N THR 93.A O no hydrogen 3.082 N/A TYR 98.A N THR 94.A O no hydrogen 2.804 N/A TYR 98.A OH ASN 67.A OD1 no hydrogen 2.665 N/A GLY 101.A N TYR 98.A O no hydrogen 2.995 N/A VAL 106.A N THR 129.A OG1 no hydrogen 2.982 N/A ALA 112.A N GLY 109.A O no hydrogen 3.067 N/A ALA 113.A N PRO 110.A O no hydrogen 3.063 N/A GLU 114.A N LEU 111.A O no hydrogen 3.045 N/A GLU 116.A N GLN 151.A OE1 no hydrogen 2.921 N/A GLY 117.A N GLU 114.A O no hydrogen 2.755 N/A GLY 118.A N LEU 115.A O no hydrogen 3.034 N/A HIS 123.A N ARG 120.A O no hydrogen 3.038 N/A GLY 126.A N THR 122.A O no hydrogen 3.265 N/A VAL 127.A N HIS 123.A O no hydrogen 3.040 N/A LEU 128.A N PHE 124.A O no hydrogen 2.801 N/A THR 129.A N ALA 125.A O no hydrogen 2.953 N/A THR 129.A OG1 ALA 125.A O no hydrogen 2.653 N/A VAL 130.A N GLY 126.A O no hydrogen 2.957 N/A VAL 131.A N VAL 127.A O no hydrogen 2.796 N/A LEU 132.A N LEU 128.A O no hydrogen 2.918 N/A LYS 133.A N THR 129.A O no hydrogen 3.019 N/A LYS 133.A NZ MET 97.A O no hydrogen 2.769 N/A LEU 134.A N VAL 130.A O no hydrogen 2.871 N/A LEU 135.A N VAL 131.A O no hydrogen 2.807 N/A GLN 136.A N LEU 132.A O no hydrogen 2.966 N/A ILE 137.A N LYS 133.A O no hydrogen 2.889 N/A VAL 138.A N LEU 134.A O no hydrogen 2.955 N/A ARG 139.A N LEU 135.A O no hydrogen 2.856 N/A ASP 141.A N VAL 32.A O no hydrogen 2.730 N/A VAL 143.A N ALA 168.A O no hydrogen 2.865 N/A PHE 144.A N LEU 34.A O no hydrogen 3.017 N/A PHE 145.A N VAL 170.A O no hydrogen 2.997 N/A GLU 147.A N VAL 172.A O no hydrogen 2.802 N/A LYS 148.A NZ MET 183.A O no hydrogen 3.104 N/A LYS 148.A NZ SER 184.A OG no hydrogen 2.634 N/A ASP 149.A N GLY 146.A O no hydrogen 3.345 N/A TYR 150.A OH ILE 243.A O no hydrogen 2.616 N/A GLN 151.A NE2 LEU 111.A O no hydrogen 2.828 N/A GLN 151.A NE2 GLU 114.A O no hydrogen 2.871 N/A LEU 153.A N ASP 149.A O no hydrogen 2.969 N/A VAL 154.A N TYR 150.A O no hydrogen 2.903 N/A LEU 155.A N GLN 151.A O no hydrogen 2.878 N/A ILE 156.A N GLN 152.A O no hydrogen 2.848 N/A ARG 157.A N LEU 153.A O no hydrogen 2.934 N/A ARG 157.A NH1 VAL 169.A O no hydrogen 2.964 N/A GLN 158.A N VAL 154.A O no hydrogen 2.928 N/A LEU 159.A N LEU 155.A O no hydrogen 2.876 N/A VAL 160.A N ILE 156.A O no hydrogen 2.907 N/A ALA 161.A N ARG 157.A O no hydrogen 2.906 N/A ASP 162.A N GLN 158.A O no hydrogen 2.736 N/A PHE 163.A N LEU 159.A O no hydrogen 3.030 N/A ASN 164.A N ALA 161.A O no hydrogen 3.225 N/A LEU 165.A N VAL 160.A O no hydrogen 2.876 N/A ALA 168.A N ASP 141.A O no hydrogen 3.026 N/A VAL 170.A N VAL 143.A O no hydrogen 2.841 N/A VAL 172.A N PHE 145.A O no hydrogen 2.881 N/A ARG 176.A NH1 GLY 180.A O no hydrogen 2.911 N/A ARG 176.A NH1 ASP 269.A OD1 no hydrogen 3.479 N/A ARG 176.A NH1 ASP 269.A OD2 no hydrogen 2.816 N/A ARG 176.A NH2 ASP 269.A OD1 no hydrogen 2.846 N/A GLU 177.A N LEU 181.A O no hydrogen 2.753 N/A GLY 180.A N GLU 177.A O no hydrogen 2.910 N/A LEU 181.A N ASP 179.A OD1 no hydrogen 3.107 N/A MET 183.A N VAL 175.A O no hydrogen 3.000 N/A SER 185.A OG ALA 40.A O no hydrogen 3.180 N/A ARG 186.A NH1 ARG 266.A O no hydrogen 2.749 N/A ASN 187.A N SER 184.A O no hydrogen 2.918 N/A ASN 187.A ND2 ALA 182.A O no hydrogen 3.021 N/A ARG 188.A N SER 185.A O no hydrogen 3.181 N/A ARG 188.A NH1 ALA 40.A O no hydrogen 3.041 N/A ARG 188.A NH2 LEU 41.A O no hydrogen 3.259 N/A TYR 189.A N ARG 186.A O no hydrogen 2.956 N/A LEU 190.A N ASN 187.A O no hydrogen 3.076 N/A ASP 191.A N GLN 194.A OE1 no hydrogen 2.929 N/A GLN 194.A N ASP 191.A OD1 no hydrogen 2.769 N/A ARG 195.A N ASP 191.A O no hydrogen 2.841 N/A ARG 195.A NH1 ASP 179.A OD2 no hydrogen 2.863 N/A ARG 195.A NH1 ARG 195.A O no hydrogen 2.891 N/A ARG 195.A NH2 ASP 179.A OD1 no hydrogen 3.079 N/A ARG 195.A NH2 ASP 179.A OD2 no hydrogen 3.343 N/A ALA 196.A N PRO 192.A O no hydrogen 2.987 N/A ALA 197.A N ALA 193.A O no hydrogen 2.897 N/A ALA 198.A N GLN 194.A O no hydrogen 2.839 N/A VAL 199.A N ALA 196.A O no hydrogen 3.408 N/A ALA 200.A N ALA 197.A O no hydrogen 2.995 N/A LEU 201.A N ALA 198.A O no hydrogen 3.261 N/A SER 202.A OG VAL 199.A O no hydrogen 3.118 N/A ALA 203.A N VAL 199.A O no hydrogen 2.929 N/A ALA 204.A N ALA 200.A O no hydrogen 2.839 N/A LEU 205.A N LEU 201.A O no hydrogen 3.093 N/A THR 206.A N SER 202.A O no hydrogen 2.857 N/A THR 206.A OG1 SER 202.A O no hydrogen 2.847 N/A ALA 207.A N ALA 203.A O no hydrogen 2.893 N/A ALA 208.A N ALA 204.A O no hydrogen 2.945 N/A ALA 209.A N LEU 205.A O no hydrogen 2.899 N/A HIS 210.A N THR 206.A O no hydrogen 3.176 N/A HIS 210.A ND1 THR 206.A O no hydrogen 2.980 N/A ALA 211.A N ALA 207.A O no hydrogen 2.820 N/A THR 213.A OG1 HIS 210.A O no hydrogen 3.450 N/A ALA 214.A N ALA 211.A O no hydrogen 2.879 N/A GLY 215.A N ALA 212.A O no hydrogen 2.983 N/A GLN 217.A NE2 ASP 221.A OD1 no hydrogen 2.895 N/A ALA 219.A N GLY 215.A O no hydrogen 3.107 N/A LEU 220.A N ALA 216.A O no hydrogen 2.961 N/A ASP 221.A N GLN 217.A O no hydrogen 2.828 N/A ALA 222.A N ALA 218.A O no hydrogen 2.890 N/A ALA 223.A N ALA 219.A O no hydrogen 3.115 N/A ARG 224.A N LEU 220.A O no hydrogen 2.910 N/A ALA 225.A N ASP 221.A O no hydrogen 2.922 N/A VAL 226.A N ALA 222.A O no hydrogen 3.094 N/A LEU 227.A N ALA 223.A O no hydrogen 3.007 N/A ASP 228.A N ARG 224.A O no hydrogen 2.759 N/A ALA 229.A N ALA 225.A O no hydrogen 3.019 N/A ALA 229.A N VAL 226.A O no hydrogen 3.082 N/A ALA 230.A N LEU 227.A O no hydrogen 3.150 N/A VAL 233.A N ALA 230.A O no hydrogen 3.189 N/A ALA 234.A N ARG 261.A O no hydrogen 2.976 N/A ASP 236.A N ALA 259.A O no hydrogen 2.766 N/A TYR 237.A N ALA 259.A O no hydrogen 3.269 N/A TYR 237.A OH GLU 116.A OE2 no hydrogen 2.496 N/A GLU 239.A N LEU 257.A O no hydrogen 2.934 N/A ARG 241.A N ARG 255.A O no hydrogen 2.873 N/A ARG 241.A NE.A GLU 239.A OE1.A no hydrogen 2.985 N/A ARG 241.A NH1.A GLU 114.A OE2 no hydrogen 2.572 N/A ARG 241.A NH1.A LEU 245.A O no hydrogen 2.863 N/A ARG 241.A NH1.B GLU 239.A OE1.B no hydrogen 2.685 N/A ARG 241.A NH1.B LEU 240.A O no hydrogen 3.203 N/A ARG 241.A NH2.A GLU 114.A OE2 no hydrogen 2.714 N/A ARG 241.A NH2.A GLU 239.A OE1.A no hydrogen 2.963 N/A ARG 241.A NH2.B GLU 239.A OE1.B no hydrogen 2.707 N/A ASP 242.A N GLY 246.A O no hydrogen 2.812 N/A GLY 244.A N ASP 242.A OD2 no hydrogen 2.812 N/A LEU 245.A N ASP 242.A O no hydrogen 2.904 N/A GLY 246.A N ASP 242.A OD2 no hydrogen 2.857 N/A GLY 252.A N ILE 275.A O no hydrogen 2.555 N/A SER 253.A OG GLU 274.A OE1 no hydrogen 2.541 N/A SER 253.A OG GLU 274.A OE2 no hydrogen 3.523 N/A GLY 254.A N ILE 273.A O no hydrogen 2.795 N/A ARG 255.A N ARG 241.A O no hydrogen 2.790 N/A ARG 255.A NE ASN 270.A OD1 no hydrogen 2.723 N/A ARG 255.A NH2 GLU 147.A OE1 no hydrogen 3.018 N/A ARG 255.A NH2 ASN 270.A OD1 no hydrogen 2.895 N/A LEU 256.A N ILE 271.A O no hydrogen 2.987 N/A LEU 257.A N GLU 239.A O no hydrogen 2.905 N/A VAL 258.A N ASP 269.A O no hydrogen 2.936 N/A ALA 259.A N TYR 237.A O no hydrogen 3.049 N/A ALA 260.A N LEU 267.A O no hydrogen 2.938 N/A ARG 261.A N ALA 234.A O no hydrogen 2.831 N/A LEU 262.A N THR 265.A O no hydrogen 2.780 N/A THR 265.A N LEU 262.A O no hydrogen 3.072 N/A ARG 266.A NH1 GLU 116.A OE1 no hydrogen 2.770 N/A ARG 266.A NH1 GLU 116.A OE2 no hydrogen 3.359 N/A ARG 266.A NH2 GLU 116.A OE2 no hydrogen 2.880 N/A ARG 266.A NH2 ASP 236.A OD2 no hydrogen 2.843 N/A LEU 267.A N ALA 260.A O no hydrogen 2.740 N/A ASP 269.A N VAL 258.A O no hydrogen 3.046 N/A ASN 270.A N ASP 269.A OD1 no hydrogen 2.734 N/A ASN 270.A ND2 GLU 147.A O no hydrogen 2.853 N/A ILE 271.A N LEU 256.A O no hydrogen 2.928 N/A ILE 273.A N GLY 254.A O no hydrogen 2.945 N/A ILE 275.A N GLY 252.A O no hydrogen 2.758 N/A