Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3m3p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG SER 1.A O no hydrogen 2.385 N/A LYS 3.A NZ ARG 44.A O no hydrogen 2.879 N/A VAL 5.A N PRO 28.A O no hydrogen 2.920 N/A ILE 7.A N ALA 50.A O no hydrogen 2.822 N/A GLN 8.A N LEU 32.A O no hydrogen 2.916 N/A GLN 8.A NE2 SER 10.A O no hydrogen 2.927 N/A HIS 17.A N GLU 170.A O no hydrogen 2.790 N/A HIS 17.A NE2 GLU 219.A OE2 no hydrogen 2.809 N/A GLY 19.A N PRO 15.A O no hydrogen 3.473 N/A ASP 20.A N GLY 16.A O no hydrogen 3.299 N/A PHE 21.A N HIS 17.A O no hydrogen 2.876 N/A LEU 22.A N PHE 18.A O no hydrogen 2.966 N/A ALA 23.A N GLY 19.A O no hydrogen 2.982 N/A GLY 24.A N ASP 20.A O no hydrogen 2.949 N/A GLU 25.A N PHE 21.A O no hydrogen 3.030 N/A HIS 26.A N ALA 23.A O no hydrogen 3.008 N/A ILE 27.A N LEU 22.A O no hydrogen 2.956 N/A GLN 30.A N VAL 5.A O no hydrogen 2.859 N/A LEU 32.A N ILE 6.A O no hydrogen 2.914 N/A ARG 33.A N ASP 37.A OD2 no hydrogen 2.836 N/A ARG 33.A NE ASP 34.A OD1 no hydrogen 2.755 N/A ARG 33.A NH2 ASP 34.A OD2 no hydrogen 2.833 N/A ARG 35.A N ARG 33.A O no hydrogen 3.176 N/A ASP 37.A N ARG 33.A O no hydrogen 3.103 N/A ARG 44.A N GLU 42.A OE1 no hydrogen 2.917 N/A ARG 44.A NH1 GLN 74.A OE1 no hydrogen 3.469 N/A ASP 45.A N GLU 42.A O no hydrogen 3.005 N/A CYS 46.A N ILE 43.A O no hydrogen 2.967 N/A CYS 46.A SG.A ILE 43.A O no hydrogen 3.374 N/A CYS 46.A SG.A GLY 48.A O no hydrogen 3.131 N/A CYS 46.A SG.B ILE 43.A O no hydrogen 3.470 N/A SER 47.A N PRO 4.A O no hydrogen 2.961 N/A SER 47.A OG LYS 3.A O no hydrogen 2.785 N/A LEU 49.A N PRO 77.A O no hydrogen 2.848 N/A SER 54.A N ASP 57.A OD2 no hydrogen 2.982 N/A SER 54.A OG GLN 134.A OE1 no hydrogen 2.731 N/A ASN 56.A N SER 54.A OG no hydrogen 2.987 N/A ASN 56.A ND2 VAL 95.A O no hydrogen 2.900 N/A ASP 57.A N SER 54.A O no hydrogen 2.949 N/A LEU 64.A N TRP 61.A O no hydrogen 2.870 N/A ALA 66.A N PRO 62.A O no hydrogen 3.020 N/A LEU 67.A N THR 63.A O no hydrogen 2.987 N/A ILE 68.A N LEU 64.A O no hydrogen 2.891 N/A ARG 69.A N LEU 65.A O no hydrogen 3.059 N/A ARG 69.A NH1 ALA 91.A O no hydrogen 3.179 N/A ASP 70.A N ALA 66.A O no hydrogen 2.845 N/A ALA 71.A N LEU 67.A O no hydrogen 2.888 N/A VAL 72.A N ILE 68.A O no hydrogen 3.051 N/A ALA 73.A N ARG 69.A O no hydrogen 2.914 N/A GLN 74.A N ASP 70.A O no hydrogen 2.832 N/A ARG 75.A N VAL 72.A O no hydrogen 3.295 N/A VAL 76.A N ALA 71.A O no hydrogen 2.891 N/A VAL 78.A N HIS 162.A ND1 no hydrogen 2.947 N/A ILE 79.A N LEU 49.A O no hydrogen 2.921 N/A GLY 80.A N ILE 163.A O no hydrogen 2.995 N/A HIS 81.A NE2 TYR 222.A OH no hydrogen 2.800 N/A CYS 82.A N PHE 165.A O no hydrogen 2.806 N/A CYS 82.A SG GLN 166.A O no hydrogen 3.693 N/A CYS 82.A SG HIS 168.A NE2 no hydrogen 3.697 N/A GLY 84.A N HIS 81.A O no hydrogen 3.005 N/A GLN 86.A N CYS 82.A O no hydrogen 2.990 N/A GLN 86.A NE2 GLN 166.A OE1 no hydrogen 3.024 N/A LEU 87.A N LEU 83.A O no hydrogen 2.771 N/A LEU 88.A N GLY 84.A O no hydrogen 3.017 N/A ALA 89.A N GLY 85.A O no hydrogen 3.210 N/A LYS 90.A N GLN 86.A O no hydrogen 2.883 N/A LYS 90.A NZ ASN 56.A OD1 no hydrogen 2.871 N/A ALA 91.A N LEU 87.A O no hydrogen 2.860 N/A GLY 93.A N ALA 89.A O no hydrogen 2.785 N/A GLU 94.A N SER 137.A OG no hydrogen 2.931 N/A THR 96.A N THR 135.A O no hydrogen 2.968 N/A SER 98.A N TYR 133.A O no hydrogen 2.902 N/A SER 98.A OG TYR 133.A O no hydrogen 3.364 N/A ALA 101.A N GLN 195.A OE1 no hydrogen 3.005 N/A GLU 102.A N HIS 132.A O no hydrogen 3.074 N/A GLY 104.A N GLU 130.A O no hydrogen 2.829 N/A TRP 105.A N GLN 198.A OE1 no hydrogen 2.848 N/A TRP 105.A NE1 ILE 203.A O no hydrogen 2.858 N/A VAL 106.A N LEU 128.A O no hydrogen 2.861 N/A ARG 107.A NE GLU 125.A OE2 no hydrogen 2.759 N/A ARG 107.A NH2 GLU 125.A OE1 no hydrogen 2.887 N/A ALA 108.A N LEU 126.A O no hydrogen 2.940 N/A TRP 109.A N ARG 147.A O no hydrogen 2.890 N/A GLN 111.A N ILE 145.A O no hydrogen 2.948 N/A VAL 113.A N GLN 111.A O no hydrogen 2.900 N/A GLN 115.A N GLN 115.A OE1 no hydrogen 2.743 N/A ALA 116.A N VAL 113.A O no hydrogen 3.050 N/A GLU 118.A N PRO 114.A O no hydrogen 2.991 N/A TRP 119.A N GLN 115.A O no hydrogen 2.990 N/A LEU 120.A N ALA 116.A O no hydrogen 2.861 N/A GLY 121.A N LEU 117.A O no hydrogen 2.889 N/A TRP 123.A NE1 VAL 113.A O no hydrogen 3.023 N/A ASP 124.A N THR 122.A OG1 no hydrogen 2.887 N/A LEU 126.A N ALA 108.A O no hydrogen 2.882 N/A LEU 128.A N VAL 106.A O no hydrogen 2.864 N/A GLU 130.A N GLY 104.A O no hydrogen 2.874 N/A TRP 131.A NE1 GLU 184.A OE1 no hydrogen 2.921 N/A HIS 132.A N GLU 102.A O no hydrogen 2.966 N/A HIS 132.A ND1 GLN 134.A O no hydrogen 2.699 N/A HIS 132.A NE2 GLU 102.A OE1 no hydrogen 2.648 N/A TYR 133.A OH GLU 184.A OE1 no hydrogen 2.600 N/A GLN 134.A NE2 ASP 97.A OD1 no hydrogen 2.889 N/A THR 135.A N THR 96.A O no hydrogen 2.877 N/A THR 135.A OG1 PHE 136.A O no hydrogen 3.321 N/A SER 137.A N GLU 94.A O no hydrogen 2.846 N/A ALA 142.A N PRO 139.A O no hydrogen 3.023 N/A VAL 143.A N VAL 157.A O no hydrogen 2.832 N/A HIS 144.A NE2 ALA 152.A O no hydrogen 2.779 N/A ILE 145.A N ALA 155.A O no hydrogen 2.993 N/A ARG 147.A N TRP 109.A O no hydrogen 3.094 N/A SER 148.A N CYS 151.A O no hydrogen 2.965 N/A SER 148.A OG GLU 102.A OE2 no hydrogen 2.651 N/A SER 148.A OG CYS 151.A O no hydrogen 3.039 N/A CYS 151.A N SER 148.A O no hydrogen 3.395 N/A CYS 151.A N SER 148.A OG no hydrogen 3.096 N/A CYS 151.A SG THR 135.A OG1 no hydrogen 3.738 N/A CYS 151.A SG ASN 153.A O no hydrogen 3.750 N/A ASN 153.A ND2 PHE 136.A O no hydrogen 2.890 N/A GLN 154.A N LEU 146.A O no hydrogen 2.999 N/A GLN 154.A NE2 GLU 102.A OE1 no hydrogen 2.938 N/A GLN 154.A NE2 SER 148.A OG no hydrogen 2.835 N/A GLN 154.A NE2 CYS 151.A O no hydrogen 3.442 N/A TYR 156.A N GLY 164.A O no hydrogen 3.071 N/A TYR 156.A OH GLY 85.A O no hydrogen 2.711 N/A VAL 157.A N VAL 143.A O no hydrogen 2.942 N/A LEU 158.A N HIS 162.A O no hydrogen 2.864 N/A LEU 161.A N LEU 158.A O no hydrogen 2.976 N/A HIS 162.A N LEU 158.A O no hydrogen 3.021 N/A ILE 163.A N VAL 78.A O no hydrogen 3.003 N/A GLY 164.A N TYR 156.A O no hydrogen 3.067 N/A PHE 165.A N GLY 80.A O no hydrogen 2.875 N/A GLN 166.A N GLN 154.A O no hydrogen 2.778 N/A GLN 166.A NE2 GLN 166.A O no hydrogen 3.043 N/A HIS 168.A N PHE 129.A O no hydrogen 2.921 N/A HIS 168.A ND1 GLU 170.A OE2 no hydrogen 2.693 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.705 N/A GLN 171.A NE2 HIS 17.A ND1 no hydrogen 3.147 N/A GLN 171.A NE2 ASP 20.A OD2 no hydrogen 2.826 N/A ARG 175.A N ALA 172.A O no hydrogen 3.071 N/A GLU 176.A N HIS 173.A O no hydrogen 2.890 N/A TRP 177.A NE1 SER 12.A O no hydrogen 3.086 N/A CYS 178.A N VAL 174.A O no hydrogen 3.045 N/A CYS 178.A SG VAL 174.A O no hydrogen 3.408 N/A SER 179.A N ARG 175.A O no hydrogen 3.070 N/A SER 179.A OG ARG 175.A O no hydrogen 3.264 N/A ILE 180.A N GLU 176.A O no hydrogen 2.839 N/A SER 181.A N TRP 177.A O no hydrogen 3.082 N/A SER 181.A OG GLU 184.A OE2 no hydrogen 2.660 N/A GLU 184.A N SER 181.A O no hydrogen 3.465 N/A LEU 185.A N PRO 182.A O no hydrogen 3.185 N/A LYS 186.A N GLN 198.A O no hydrogen 2.920 N/A GLY 188.A N LEU 185.A O no hydrogen 2.783 N/A ALA 189.A N GLU 183.A OE2 no hydrogen 2.829 N/A GLU 190.A N GLU 183.A O no hydrogen 2.946 N/A ALA 194.A N ASP 192.A OD1 no hydrogen 2.917 N/A GLN 195.A N ASP 192.A O no hydrogen 2.996 N/A GLN 198.A N ILE 103.A O no hydrogen 2.905 N/A SER 199.A N GLU 202.A OE1 no hydrogen 3.029 N/A GLU 202.A N SER 199.A OG no hydrogen 3.010 N/A ILE 203.A N SER 199.A O no hydrogen 2.930 N/A LEU 204.A N ALA 200.A O no hydrogen 2.924 N/A ARG 205.A N GLU 202.A O no hydrogen 3.384 N/A LEU 207.A N LEU 204.A O no hydrogen 3.192 N/A ARG 210.A N ASP 206.A O no hydrogen 3.017 N/A ARG 210.A NE GLU 127.A OE1 no hydrogen 2.942 N/A ARG 210.A NH1 GLU 127.A OE1 no hydrogen 3.548 N/A ARG 210.A NH1 GLU 127.A OE2 no hydrogen 2.860 N/A ARG 210.A NH2 ARG 205.A O no hydrogen 2.852 N/A ILE 211.A N LEU 207.A O no hydrogen 2.836 N/A ALA 212.A N ASP 208.A O no hydrogen 3.004 N/A THR 213.A N VAL 209.A O no hydrogen 3.075 N/A THR 213.A OG1 VAL 209.A O no hydrogen 3.199 N/A LEU 214.A N ARG 210.A O no hydrogen 3.023 N/A ASN 215.A N ILE 211.A O no hydrogen 2.811 N/A ARG 216.A N ALA 212.A O no hydrogen 3.111 N/A ARG 216.A NE GLU 219.A OE1 no hydrogen 2.803 N/A ARG 216.A NH1 GLU 219.A OE2 no hydrogen 2.914 N/A ALA 218.A N LEU 214.A O no hydrogen 2.922 N/A GLU 219.A N ASN 215.A O no hydrogen 2.893 N/A HIS 220.A N ARG 216.A O no hydrogen 3.309 N/A HIS 220.A ND1 TRP 119.A O no hydrogen 3.040 N/A VAL 221.A N TRP 217.A O no hydrogen 3.039 N/A TYR 222.A N ALA 218.A O no hydrogen 2.876 N/A TYR 222.A OH HIS 81.A NE2 no hydrogen 2.800 N/A ALA 223.A N GLU 219.A O no hydrogen 2.863 N/A ARG 224.A N HIS 220.A O no hydrogen 3.060 N/A ARG 224.A NE GLU 118.A OE2 no hydrogen 2.681 N/A ARG 224.A NH1 ARG 224.A O no hydrogen 2.966 N/A ARG 224.A NH2 GLU 118.A OE2 no hydrogen 2.916 N/A ARG 224.A NH2 ASP 160.A O.A no hydrogen 3.301 N/A ARG 224.A NH2 ASP 160.A O.B no hydrogen 3.280 N/A TRP 225.A N VAL 221.A O no hydrogen 2.891 N/A ILE 226.A N TYR 222.A O no hydrogen 2.988 N/A LYS 227.A N ARG 224.A O no hydrogen 3.136 N/A GLY 228.A N TRP 225.A O no hydrogen 3.047 N/A LEU 229.A N ILE 226.A O no hydrogen 3.127 N/A GLN 230.A N SER 47.A O no hydrogen 2.888 N/A GLN 230.A NE2 ARG 75.A O no hydrogen 2.912 N/A HIS 236.A ND1 HIS 237.A O no hydrogen 2.786 N/A HIS 239.A N HIS 237.A ND1 no hydrogen 2.863 N/A