Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qlj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N GLU 29.A OE1 no hydrogen 2.841 N/A VAL 4.A N GLU 29.A O no hydrogen 3.107 N/A ASP 5.A N GLY 2.A O no hydrogen 3.174 N/A GLY 6.A N GLY 30.A O no hydrogen 3.069 N/A ARG 7.A N VAL 4.A O no hydrogen 3.029 N/A ARG 7.A NH1 ASP 150.A O no hydrogen 2.998 N/A ARG 7.A NH2 ASP 150.A OD2 no hydrogen 2.781 N/A VAL 8.A N ASP 95.A OD2 no hydrogen 2.782 N/A VAL 9.A N ARG 32.A O no hydrogen 2.896 N/A ILE 10.A N VAL 96.A O no hydrogen 2.886 N/A VAL 11.A N VAL 34.A O no hydrogen 3.043 N/A THR 12.A N VAL 98.A O no hydrogen 3.037 N/A ALA 14.A N ASN 36.A O no hydrogen 2.786 N/A GLY 15.A N ASP 37.A OD2 no hydrogen 2.902 N/A ARG 20.A N GLY 16.A O no hydrogen 3.118 N/A ARG 20.A NE GLU 59.A OE2 no hydrogen 2.855 N/A ARG 20.A NH2 GLU 59.A OE1 no hydrogen 2.716 N/A ARG 20.A NH2 GLU 59.A OE2 no hydrogen 3.517 N/A ALA 21.A N GLY 17.A O no hydrogen 3.084 N/A HIS 22.A N ILE 18.A O no hydrogen 2.832 N/A HIS 22.A ND1 SER 224.A OG no hydrogen 2.869 N/A ALA 23.A N GLY 19.A O no hydrogen 2.955 N/A LEU 24.A N ARG 20.A O no hydrogen 3.024 N/A ALA 25.A N ALA 21.A O no hydrogen 2.917 N/A PHE 26.A N HIS 22.A O no hydrogen 2.908 N/A ALA 27.A N ALA 23.A O no hydrogen 3.072 N/A ALA 28.A N LEU 24.A O no hydrogen 2.890 N/A GLU 29.A N PHE 26.A O no hydrogen 3.027 N/A GLY 30.A N ALA 27.A O no hydrogen 3.023 N/A ALA 31.A N PHE 26.A O no hydrogen 3.058 N/A ARG 32.A N ARG 7.A O no hydrogen 2.849 N/A ARG 32.A NH2 GLY 6.A O no hydrogen 2.758 N/A VAL 33.A N GLU 66.A O no hydrogen 3.073 N/A VAL 34.A N VAL 9.A O no hydrogen 2.744 N/A VAL 35.A N VAL 68.A O no hydrogen 2.815 N/A ASN 36.A N VAL 11.A O no hydrogen 3.059 N/A ASN 36.A ND2 ASP 70.A O no hydrogen 3.373 N/A ASN 36.A ND2 ASP 70.A OD2 no hydrogen 3.051 N/A ASN 36.A ND2 SER 72.A O no hydrogen 2.824 N/A ASP 37.A N ASP 70.A O no hydrogen 2.942 N/A GLY 39.A N ASP 37.A OD1 no hydrogen 2.906 N/A GLY 41.A N SER 45.A O no hydrogen 2.947 N/A LEU 42.A N GLY 49.A O no hydrogen 2.774 N/A GLY 44.A N GLY 41.A O no hydrogen 2.919 N/A SER 45.A N ASP 43.A OD1 no hydrogen 2.908 N/A SER 45.A OG ASP 43.A OD1 no hydrogen 2.852 N/A ALA 47.A N GLY 39.A O no hydrogen 2.823 N/A SER 48.A OG ASP 43.A OD1 no hydrogen 2.816 N/A SER 48.A OG SER 45.A O no hydrogen 2.990 N/A SER 48.A OG SER 45.A OG no hydrogen 3.342 N/A SER 51.A N SER 48.A O no hydrogen 3.046 N/A SER 51.A OG SER 48.A O no hydrogen 2.638 N/A GLN 54.A N SER 51.A OG no hydrogen 3.042 N/A GLN 54.A NE2 ASP 58.A OD1 no hydrogen 2.883 N/A SER 55.A N SER 51.A O no hydrogen 2.986 N/A SER 55.A OG.A SER 51.A O no hydrogen 3.316 N/A VAL 56.A N ALA 52.A O no hydrogen 3.031 N/A VAL 57.A N ALA 53.A O no hydrogen 2.947 N/A ASP 58.A N GLN 54.A O no hydrogen 2.777 N/A GLU 59.A N SER 55.A O no hydrogen 3.004 N/A ILE 60.A N VAL 56.A O no hydrogen 2.978 N/A THR 61.A N VAL 57.A O no hydrogen 2.869 N/A THR 61.A OG1 VAL 57.A O no hydrogen 3.406 N/A THR 61.A OG1 ASP 58.A O no hydrogen 3.223 N/A ALA 62.A N ASP 58.A O no hydrogen 2.866 N/A ALA 63.A N GLU 59.A O no hydrogen 3.156 N/A GLY 64.A N THR 61.A O no hydrogen 2.959 N/A GLY 65.A N ILE 60.A O no hydrogen 2.975 N/A VAL 68.A N VAL 33.A O no hydrogen 2.929 N/A ASP 70.A N VAL 35.A O no hydrogen 2.894 N/A SER 72.A N ASP 70.A OD2 no hydrogen 2.801 N/A SER 72.A OG ASP 70.A OD1 no hydrogen 3.426 N/A SER 72.A OG ASP 70.A OD2 no hydrogen 2.651 N/A SER 72.A OG GLN 79.A O no hydrogen 3.334 N/A ASN 73.A N GLN 79.A OE1 no hydrogen 2.848 N/A ALA 75.A N ASN 73.A OD1 no hydrogen 2.994 N/A ASP 76.A N ASN 73.A O no hydrogen 2.923 N/A GLN 79.A N ASP 76.A OD1 no hydrogen 3.006 N/A ALA 80.A N ASP 76.A O no hydrogen 2.910 N/A ALA 81.A N TRP 77.A O no hydrogen 3.197 N/A GLY 82.A N ASP 78.A O no hydrogen 3.025 N/A LEU 83.A N GLN 79.A O no hydrogen 2.882 N/A ILE 84.A N ALA 80.A O no hydrogen 3.412 N/A GLN 85.A N ALA 81.A O no hydrogen 3.229 N/A THR 86.A N GLY 82.A O no hydrogen 2.848 N/A THR 86.A OG1 ASP 70.A OD1 no hydrogen 2.840 N/A THR 86.A OG1 GLY 82.A O no hydrogen 3.257 N/A ALA 87.A N LEU 83.A O no hydrogen 3.352 N/A VAL 88.A N ILE 84.A O no hydrogen 3.149 N/A GLU 89.A N GLN 85.A O no hydrogen 2.743 N/A THR 90.A N THR 86.A O no hydrogen 2.942 N/A THR 90.A OG1 THR 86.A O no hydrogen 2.722 N/A PHE 91.A N ALA 87.A O no hydrogen 2.920 N/A GLY 92.A N VAL 88.A O no hydrogen 2.752 N/A ASP 95.A N VAL 8.A O no hydrogen 2.873 N/A VAL 96.A N VAL 8.A O no hydrogen 2.987 N/A LEU 97.A N ARG 152.A O no hydrogen 2.819 N/A VAL 98.A N ILE 10.A O no hydrogen 2.801 N/A ASN 99.A N ILE 154.A O no hydrogen 2.808 N/A ASN 99.A ND2 HIS 128.A O no hydrogen 3.508 N/A ASN 99.A ND2 ASN 155.A OD1 no hydrogen 2.984 N/A ASN 100.A N THR 12.A OG1 no hydrogen 2.810 N/A ASN 100.A ND2 THR 12.A O no hydrogen 3.054 N/A ALA 101.A N THR 12.A OG1 no hydrogen 2.919 N/A ILE 103.A N HIS 124.A NE2 no hydrogen 3.240 N/A ARG 105.A NH1 VAL 104.A O no hydrogen 2.816 N/A ARG 107.A NE GLU 116.A OE2 no hydrogen 2.991 N/A ARG 107.A NH2 GLU 116.A OE2 no hydrogen 3.499 N/A ASN 111.A N MET 108.A O no hydrogen 2.901 N/A THR 112.A N ILE 109.A O no hydrogen 3.280 N/A THR 112.A OG1 MET 108.A O no hydrogen 2.746 N/A THR 112.A OG1 ILE 109.A O no hydrogen 3.546 N/A SER 113.A N GLU 116.A OE1 no hydrogen 2.841 N/A GLU 116.A N SER 113.A OG no hydrogen 3.014 N/A PHE 117.A N SER 113.A O no hydrogen 3.008 N/A ASP 118.A N GLU 114.A O no hydrogen 2.818 N/A ALA 119.A N GLU 115.A O no hydrogen 2.909 N/A ILE 121.A N PHE 117.A O no hydrogen 3.068 N/A ALA 122.A N ASP 118.A O no hydrogen 2.847 N/A VAL 123.A N ALA 119.A O no hydrogen 3.013 N/A HIS 124.A N VAL 120.A O no hydrogen 3.127 N/A HIS 124.A NE2 ILE 103.A O no hydrogen 2.741 N/A LEU 125.A N ILE 121.A O no hydrogen 2.921 N/A LYS 126.A N ILE 121.A O no hydrogen 3.022 N/A GLY 127.A N ALA 122.A O no hydrogen 2.912 N/A HIS 128.A N HIS 124.A O no hydrogen 2.998 N/A PHE 129.A N LEU 125.A O no hydrogen 2.924 N/A ALA 130.A N LYS 126.A O no hydrogen 2.817 N/A THR 131.A N GLY 127.A O no hydrogen 3.190 N/A THR 131.A OG1 ASN 99.A OD1 no hydrogen 2.610 N/A THR 131.A OG1 GLY 127.A O no hydrogen 3.359 N/A THR 131.A OG1 HIS 128.A O no hydrogen 3.167 N/A MET 132.A N HIS 128.A O no hydrogen 3.059 N/A ARG 133.A N PHE 129.A O no hydrogen 2.805 N/A ARG 133.A NH1 ARG 133.A O no hydrogen 3.273 N/A HIS 134.A N ALA 130.A O no hydrogen 3.073 N/A ALA 135.A N THR 131.A O no hydrogen 2.858 N/A ALA 136.A N MET 132.A O no hydrogen 2.851 N/A ALA 137.A N ARG 133.A O no hydrogen 3.184 N/A TYR 138.A N HIS 134.A O no hydrogen 3.111 N/A TRP 139.A N ALA 135.A O no hydrogen 2.877 N/A TRP 139.A NE1 LEU 94.A O no hydrogen 2.813 N/A ARG 140.A N ALA 136.A O no hydrogen 2.777 N/A GLY 141.A N ALA 137.A O no hydrogen 2.987 N/A LEU 142.A N TYR 138.A O no hydrogen 3.019 N/A SER 143.A N TRP 139.A O no hydrogen 2.958 N/A LYS 144.A N ARG 140.A O no hydrogen 2.840 N/A ALA 145.A N GLY 141.A O no hydrogen 3.078 N/A GLY 146.A N SER 143.A O no hydrogen 3.021 N/A LYS 147.A N LEU 142.A O no hydrogen 2.890 N/A GLY 151.A N GLY 193.A O no hydrogen 2.859 N/A ARG 152.A NE SER 232.A O no hydrogen 3.039 N/A ARG 152.A NH1 ASP 150.A OD1 no hydrogen 2.934 N/A ARG 152.A NH1 GLY 151.A O no hydrogen 2.932 N/A ARG 152.A NH2 ASP 150.A OD1 no hydrogen 2.869 N/A ARG 152.A NH2 SER 232.A O no hydrogen 2.913 N/A ARG 152.A NH2 ALA 233.A O no hydrogen 3.317 N/A ILE 153.A N THR 195.A O no hydrogen 2.818 N/A ILE 154.A N LEU 97.A O no hydrogen 2.795 N/A ASN 155.A N ASN 197.A O no hydrogen 2.871 N/A ASN 155.A ND2 THR 182.A OG1 no hydrogen 3.022 N/A THR 156.A N HIS 128.A NE2 no hydrogen 2.992 N/A THR 156.A OG1 ASN 99.A O no hydrogen 2.660 N/A SER 157.A N ILE 199.A O no hydrogen 2.788 N/A SER 157.A OG LYS 175.A O no hydrogen 2.758 N/A ALA 160.A N SER 158.A OG no hydrogen 2.946 N/A GLY 161.A N SER 158.A O no hydrogen 2.822 N/A LEU 162.A N SER 158.A O no hydrogen 3.147 N/A GLN 163.A N GLY 159.A O no hydrogen 2.946 N/A SER 165.A N SER 172.A OG no hydrogen 3.070 N/A SER 165.A OG GLN 168.A OE1 no hydrogen 2.729 N/A VAL 166.A N TYR 291.A O no hydrogen 2.845 N/A GLN 168.A N SER 165.A O no hydrogen 2.970 N/A GLN 168.A NE2 ASP 106.A OD1 no hydrogen 3.013 N/A GLN 168.A NE2 ASP 106.A OD2 no hydrogen 3.366 N/A ASN 170.A ND2 ARG 105.A O no hydrogen 2.926 N/A ASN 170.A ND2 GLU 116.A O no hydrogen 3.092 N/A TYR 171.A N ASN 170.A OD1 no hydrogen 2.785 N/A SER 172.A N GLN 168.A O no hydrogen 2.707 N/A SER 172.A OG ALA 160.A O no hydrogen 3.291 N/A SER 172.A OG GLN 168.A O no hydrogen 2.804 N/A ALA 173.A N GLY 169.A O no hydrogen 2.921 N/A ALA 174.A N ASN 170.A O no hydrogen 2.996 N/A LYS 175.A N TYR 171.A O no hydrogen 2.849 N/A LYS 175.A NZ HIS 124.A ND1 no hydrogen 3.146 N/A LYS 175.A NZ THR 156.A O no hydrogen 2.759 N/A ALA 176.A N SER 172.A O no hydrogen 2.847 N/A GLY 177.A N ALA 173.A O no hydrogen 2.954 N/A ILE 178.A N ALA 174.A O no hydrogen 2.989 N/A ALA 179.A N LYS 175.A O no hydrogen 3.010 N/A THR 180.A N ALA 176.A O no hydrogen 3.122 N/A LEU 181.A N GLY 177.A O no hydrogen 2.889 N/A THR 182.A N ILE 178.A O no hydrogen 2.939 N/A THR 182.A OG1 ILE 178.A O no hydrogen 2.825 N/A LEU 183.A N ALA 179.A O no hydrogen 3.247 N/A VAL 184.A N THR 180.A O no hydrogen 2.956 N/A GLY 185.A N LEU 181.A O no hydrogen 2.784 N/A ALA 186.A N THR 182.A O no hydrogen 2.952 N/A ALA 187.A N LEU 183.A O no hydrogen 3.227 N/A GLU 188.A N VAL 184.A O no hydrogen 2.962 N/A MET 189.A N GLY 185.A O no hydrogen 2.871 N/A TYR 192.A N MET 189.A O no hydrogen 3.131 N/A GLY 193.A N GLY 190.A O no hydrogen 3.072 N/A VAL 194.A N MET 189.A O no hydrogen 3.157 N/A THR 195.A N GLY 151.A O no hydrogen 3.057 N/A VAL 196.A N THR 239.A OG1 no hydrogen 2.972 N/A ASN 197.A N ILE 153.A O no hydrogen 2.988 N/A ASN 197.A ND2 VAL 238.A O no hydrogen 3.007 N/A ALA 198.A N LYS 241.A O no hydrogen 2.861 N/A ILE 199.A N ASN 155.A O no hydrogen 2.893 N/A ALA 200.A N PHE 243.A O no hydrogen 2.817 N/A SER 202.A N VAL 245.A O no hydrogen 3.011 N/A SER 202.A OG THR 205.A OG1 no hydrogen 2.933 N/A SER 202.A OG GLU 246.A OE1 no hydrogen 2.538 N/A THR 205.A N SER 202.A O no hydrogen 3.104 N/A THR 205.A OG1 SER 202.A OG no hydrogen 2.933 N/A ARG 206.A N MET 218.A O no hydrogen 2.814 N/A ARG 206.A NE ASP 216.A OD2 no hydrogen 3.010 N/A ARG 206.A NH2 ASP 216.A OD1 no hydrogen 2.930 N/A ARG 206.A NH2 ASP 216.A OD2 no hydrogen 3.387 N/A MET 218.A N ASP 216.A OD1 no hydrogen 3.126 N/A ALA 219.A N ASP 216.A O no hydrogen 3.213 N/A ASN 222.A N ALA 219.A O no hydrogen 3.106 N/A ASN 222.A ND2 ASP 216.A O no hydrogen 2.847 N/A ASN 222.A ND2 ALA 217.A O no hydrogen 3.073 N/A VAL 223.A N PRO 220.A O no hydrogen 2.955 N/A SER 224.A OG HIS 22.A ND1 no hydrogen 2.869 N/A VAL 228.A N SER 224.A O no hydrogen 2.981 N/A TRP 229.A N PRO 225.A O no hydrogen 2.902 N/A TRP 229.A NE1 GLU 234.A OE1 no hydrogen 2.853 N/A LEU 230.A N LEU 226.A O no hydrogen 2.898 N/A GLY 231.A N VAL 227.A O no hydrogen 3.002 N/A SER 232.A N TRP 229.A O no hydrogen 2.928 N/A SER 232.A OG TRP 229.A O no hydrogen 2.693 N/A ALA 235.A N SER 232.A O no hydrogen 3.170 N/A ARG 236.A N ALA 233.A O no hydrogen 3.217 N/A VAL 238.A N ALA 235.A O no hydrogen 3.056 N/A THR 239.A OG1 VAL 196.A O no hydrogen 3.551 N/A GLY 240.A N VAL 196.A O no hydrogen 2.699 N/A LYS 241.A N ASN 197.A OD1 no hydrogen 2.951 N/A PHE 243.A N ALA 198.A O no hydrogen 2.958 N/A GLU 244.A N ARG 251.A O no hydrogen 2.751 N/A VAL 245.A N ALA 200.A O no hydrogen 3.069 N/A GLU 246.A N LYS 249.A O no hydrogen 3.284 N/A LYS 249.A N GLU 246.A O no hydrogen 2.792 N/A ARG 251.A N GLU 244.A O no hydrogen 2.867 N/A ARG 251.A NE GLU 244.A OE2 no hydrogen 3.028 N/A ARG 251.A NH2 GLU 244.A OE1 no hydrogen 3.157 N/A ARG 251.A NH2 GLU 244.A OE2 no hydrogen 3.545 N/A ALA 253.A N VAL 242.A O no hydrogen 2.947 N/A LYS 264.A NZ ARG 267.A O no hydrogen 2.983 N/A LYS 264.A NZ GLU 272.A OE2 no hydrogen 2.534 N/A GLY 265.A N ASP 263.A OD1 no hydrogen 2.920 N/A ASP 269.A N GLU 272.A OE2 no hydrogen 2.885 N/A ALA 271.A N ASP 269.A OD1 no hydrogen 3.004 N/A GLU 272.A N ASP 269.A O no hydrogen 2.940 N/A LEU 273.A N PRO 270.A O no hydrogen 3.384 N/A VAL 277.A N LEU 273.A O no hydrogen 2.746 N/A ALA 278.A N GLY 274.A O no hydrogen 2.937 N/A ASP 279.A N PRO 275.A O no hydrogen 2.936 N/A LEU 280.A N VAL 276.A O no hydrogen 3.180 N/A LEU 281.A N VAL 277.A O no hydrogen 2.959 N/A GLY 282.A N ALA 278.A O no hydrogen 3.128 N/A LYS 283.A N LEU 280.A O no hydrogen 3.159 N/A LYS 283.A NZ ASP 279.A OD1 no hydrogen 2.952 N/A LYS 283.A NZ ASP 279.A OD2 no hydrogen 3.526 N/A ALA 284.A N LEU 281.A O no hydrogen 3.345 N/A TYR 291.A N GLY 164.A O no hydrogen 2.952 N/A ALA 293.A N VAL 290.A O no hydrogen 3.304 N/A