Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5m51_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 5.A OD2 no hydrogen 2.648 N/A ARG 2.A N ASP 5.A OD2 no hydrogen 2.798 N/A ASP 5.A N ARG 2.A O no hydrogen 3.163 N/A TYR 6.A N ALA 3.A O no hydrogen 3.082 N/A TYR 6.A OH ASP 70.A OD2 no hydrogen 3.381 N/A GLU 7.A N ARG 24.A O no hydrogen 2.968 N/A LEU 9.A N LYS 22.A O no hydrogen 2.947 N/A TYR 10.A N LYS 22.A O no hydrogen 3.472 N/A ILE 12.A N CYS 20.A O no hydrogen 3.025 N/A GLY 13.A N CYS 20.A O no hydrogen 3.343 N/A GLY 15.A N GLY 18.A O no hydrogen 2.910 N/A TYR 17.A OH ASP 157.A OD2 no hydrogen 3.220 N/A ARG 19.A NE GLU 36.A OE2 no hydrogen 2.774 N/A ARG 19.A NH1 GLU 36.A OE1 no hydrogen 2.833 N/A ARG 19.A NH1 GLU 36.A OE2 no hydrogen 2.964 N/A CYS 20.A N GLY 13.A O no hydrogen 2.772 N/A CYS 20.A SG TRP 34.A O no hydrogen 3.950 N/A GLN 21.A N TRP 34.A O no hydrogen 3.159 N/A GLN 21.A NE2 THR 11.A OG1 no hydrogen 2.792 N/A LYS 22.A N TYR 10.A O no hydrogen 2.962 N/A ILE 23.A N LEU 32.A O no hydrogen 2.873 N/A ARG 24.A N GLU 7.A O no hydrogen 2.970 N/A ARG 24.A NE GLU 7.A OE1 no hydrogen 3.210 N/A ARG 24.A NH2 GLU 7.A OE1 no hydrogen 3.285 N/A ARG 25.A N LYS 30.A O no hydrogen 2.927 N/A ARG 25.A NE ASP 28.A OD1 no hydrogen 2.981 N/A ARG 25.A NH2 ASP 28.A OD1 no hydrogen 3.542 N/A ARG 25.A NH2 ASP 28.A OD2 no hydrogen 2.934 N/A LYS 26.A N ASP 5.A O no hydrogen 3.002 N/A SER 27.A OG ASP 28.A OD1 no hydrogen 3.226 N/A ASP 28.A N ARG 25.A O no hydrogen 3.380 N/A GLY 29.A N ARG 25.A O no hydrogen 2.693 N/A LYS 30.A N ASP 28.A OD1 no hydrogen 3.257 N/A LEU 32.A N ILE 23.A O no hydrogen 2.958 N/A VAL 33.A N MET 84.A O no hydrogen 2.899 N/A TRP 34.A N GLN 21.A O no hydrogen 3.028 N/A TRP 34.A NE1 GLN 21.A OE1 no hydrogen 3.144 N/A LYS 35.A N ILE 82.A O no hydrogen 2.834 N/A LYS 35.A NZ TYR 17.A OH no hydrogen 2.449 N/A LYS 35.A NZ ASP 157.A OD1 no hydrogen 3.003 N/A LYS 35.A NZ ASP 157.A OD2 no hydrogen 3.473 N/A GLU 36.A N ARG 19.A O no hydrogen 2.876 N/A LEU 37.A N LEU 80.A O no hydrogen 2.884 N/A TYR 39.A N THR 78.A O no hydrogen 3.047 N/A GLY 40.A N ASP 38.A OD2 no hydrogen 2.710 N/A MET 42.A N TYR 39.A O no hydrogen 3.034 N/A THR 43.A N GLU 46.A OE1 no hydrogen 3.051 N/A GLU 46.A N THR 43.A OG1 no hydrogen 2.781 N/A LYS 47.A N THR 43.A O no hydrogen 3.288 N/A GLN 48.A N GLU 44.A O no hydrogen 3.038 N/A LEU 50.A N LYS 47.A O no hydrogen 2.645 N/A VAL 51.A N LYS 47.A O no hydrogen 3.037 N/A SER 52.A OG GLN 48.A O no hydrogen 3.014 N/A VAL 54.A N LEU 50.A O no hydrogen 3.026 N/A ASN 55.A N VAL 51.A O no hydrogen 3.287 N/A LEU 56.A N SER 52.A O no hydrogen 3.080 N/A LEU 57.A N GLU 53.A O no hydrogen 3.112 N/A ARG 58.A N VAL 54.A O no hydrogen 3.099 N/A ARG 58.A N ASN 55.A O no hydrogen 3.270 N/A GLU 59.A N LEU 56.A O no hydrogen 3.245 N/A LEU 60.A N LEU 57.A O no hydrogen 3.230 N/A ASN 64.A N HIS 62.A ND1 no hydrogen 2.999 N/A ASN 64.A ND2 VAL 153.A O no hydrogen 3.077 N/A ILE 65.A N HIS 62.A O no hydrogen 3.008 N/A VAL 66.A N LEU 155.A O no hydrogen 2.905 N/A ARG 67.A N GLU 85.A OE1 no hydrogen 2.927 N/A TYR 69.A N VAL 83.A O no hydrogen 2.868 N/A ASP 70.A N VAL 83.A O no hydrogen 3.270 N/A ILE 72.A N TYR 81.A O no hydrogen 2.742 N/A ASP 74.A N THR 79.A O no hydrogen 2.822 N/A ASN 77.A N ASP 74.A OD2 no hydrogen 2.842 N/A ASN 77.A ND2 TYR 81.A OH no hydrogen 3.218 N/A THR 78.A N ARG 75.A O no hydrogen 2.944 N/A THR 79.A N ASP 74.A O no hydrogen 3.074 N/A THR 79.A OG1 ASN 77.A O no hydrogen 2.815 N/A LEU 80.A N LEU 37.A O no hydrogen 2.697 N/A TYR 81.A N ILE 72.A O no hydrogen 2.786 N/A ILE 82.A N LYS 35.A O no hydrogen 2.963 N/A VAL 83.A N ASP 70.A O no hydrogen 2.708 N/A MET 84.A N VAL 33.A O no hydrogen 2.801 N/A GLU 85.A N ARG 67.A O no hydrogen 2.882 N/A GLY 89.A N LEU 147.A O no hydrogen 2.798 N/A GLY 90.A N CYS 87.A O no hydrogen 3.223 N/A LEU 92.A N VAL 145.A O no hydrogen 2.845 N/A SER 94.A N ASP 91.A OD1 no hydrogen 2.980 N/A SER 94.A OG ASP 91.A OD1 no hydrogen 3.034 N/A ILE 96.A N LEU 92.A O no hydrogen 2.980 N/A THR 97.A N ALA 93.A O no hydrogen 2.955 N/A THR 97.A OG1 ALA 93.A O no hydrogen 2.925 N/A LYS 98.A N SER 94.A O no hydrogen 2.948 N/A GLY 99.A N VAL 95.A O no hydrogen 3.061 N/A THR 100.A N ILE 96.A O no hydrogen 3.087 N/A THR 100.A OG1 ILE 96.A O no hydrogen 3.304 N/A LYS 101.A N THR 97.A O no hydrogen 2.961 N/A GLU 102.A N LYS 98.A O no hydrogen 2.852 N/A ARG 103.A N THR 100.A O no hydrogen 3.229 N/A GLN 104.A N GLY 99.A O no hydrogen 3.192 N/A VAL 111.A N ASP 107.A O no hydrogen 3.191 N/A LEU 112.A N GLU 108.A O no hydrogen 2.904 N/A ARG 113.A N GLU 109.A O no hydrogen 3.075 N/A ARG 113.A NH2 GLN 151.A O no hydrogen 2.758 N/A VAL 114.A N PHE 110.A O no hydrogen 3.070 N/A MET 115.A N VAL 111.A O no hydrogen 2.853 N/A THR 116.A N LEU 112.A O no hydrogen 2.892 N/A THR 116.A OG1 LEU 112.A O no hydrogen 2.732 N/A GLN 117.A N ARG 113.A O no hydrogen 2.934 N/A GLN 117.A NE2 ASN 152.A OD1 no hydrogen 3.111 N/A GLN 117.A NE2 HIS 258.A O no hydrogen 3.105 N/A LEU 118.A N VAL 114.A O no hydrogen 2.974 N/A THR 119.A N MET 115.A O no hydrogen 3.097 N/A THR 119.A OG1 MET 115.A O no hydrogen 2.756 N/A LEU 120.A N THR 116.A O no hydrogen 2.970 N/A ALA 121.A N GLN 117.A O no hydrogen 2.988 N/A LEU 122.A N LEU 118.A O no hydrogen 2.857 N/A LYS 123.A N THR 119.A O no hydrogen 2.847 N/A GLU 124.A N LEU 120.A O no hydrogen 3.158 N/A CYS 125.A N ALA 121.A O no hydrogen 3.249 N/A CYS 125.A SG ALA 121.A O no hydrogen 3.470 N/A HIS 126.A N LEU 122.A O no hydrogen 2.645 N/A HIS 126.A NE2 ASP 180.A OD2 no hydrogen 2.877 N/A ARG 127.A N LYS 123.A O no hydrogen 2.658 N/A ARG 127.A NE GLU 245.A OE1 no hydrogen 3.495 N/A ARG 127.A NE GLU 245.A OE2 no hydrogen 2.623 N/A ARG 127.A NH1 GLU 177.A OE1 no hydrogen 3.544 N/A ARG 127.A NH1 GLU 245.A OE1 no hydrogen 3.108 N/A ARG 127.A NH2 GLU 177.A OE1 no hydrogen 2.722 N/A ARG 128.A NH1 HIS 133.A O no hydrogen 2.042 N/A SER 129.A OG GLU 124.A OE1 no hydrogen 2.345 N/A SER 129.A OG GLU 124.A OE2 no hydrogen 3.335 N/A VAL 135.A N CYS 125.A O no hydrogen 2.897 N/A HIS 137.A N ASP 180.A OD2 no hydrogen 2.819 N/A HIS 137.A NE2 GLY 156.A O no hydrogen 2.901 N/A ARG 138.A N ASP 180.A OD1 no hydrogen 3.193 N/A ASP 139.A N HIS 137.A ND1 no hydrogen 3.077 N/A ASN 144.A N LYS 141.A O no hydrogen 2.932 N/A ASN 144.A ND2 ASP 139.A OD2 no hydrogen 2.985 N/A ASN 144.A ND2 ASP 157.A O no hydrogen 2.998 N/A VAL 145.A N PRO 142.A O no hydrogen 3.142 N/A PHE 146.A N LYS 154.A O no hydrogen 2.747 N/A LEU 147.A N GLY 90.A O no hydrogen 2.736 N/A ASP 148.A N ASN 152.A O no hydrogen 3.119 N/A LYS 150.A N ASP 148.A OD1 no hydrogen 2.859 N/A GLN 151.A N ASP 148.A O no hydrogen 2.958 N/A ASN 152.A N ASP 148.A OD1 no hydrogen 2.911 N/A ASN 152.A ND2 ASP 148.A OD1 no hydrogen 3.346 N/A ASN 152.A ND2 ASP 148.A OD2 no hydrogen 3.218 N/A ASN 152.A ND2 HIS 260.A O no hydrogen 3.538 N/A VAL 153.A N GLN 117.A OE1 no hydrogen 2.667 N/A LYS 154.A N PHE 146.A O no hydrogen 2.654 N/A LYS 154.A NZ PRO 63.A O no hydrogen 2.932 N/A LYS 154.A NZ GLU 85.A OE2 no hydrogen 3.208 N/A LEU 155.A N ASN 64.A O no hydrogen 2.855 N/A GLY 156.A N ASN 144.A O no hydrogen 3.032 N/A TYR 163.A N THR 161.A O no hydrogen 3.155 N/A TYR 164.A OH GLU 190.A OE1 no hydrogen 2.577 N/A MET 165.A N PRO 162.A O no hydrogen 2.963 N/A SER 166.A OG GLU 168.A OE1 no hydrogen 3.426 N/A GLN 169.A N SER 166.A OG no hydrogen 3.378 N/A MET 170.A N SER 166.A O no hydrogen 3.144 N/A ASN 171.A N GLU 168.A O no hydrogen 2.846 N/A ASN 171.A ND2 PRO 167.A O no hydrogen 2.814 N/A ARG 172.A N GLN 169.A O no hydrogen 3.419 N/A MET 173.A N GLU 168.A O no hydrogen 2.814 N/A TYR 175.A OH ASP 180.A OD1 no hydrogen 2.422 N/A ASN 176.A N SER 179.A OG no hydrogen 2.976 N/A ASN 176.A ND2 ASP 238.A OD1 no hydrogen 3.101 N/A LYS 178.A NZ ASP 238.A O no hydrogen 3.493 N/A LYS 178.A NZ ARG 241.A O no hydrogen 2.911 N/A SER 179.A N ASN 176.A O no hydrogen 2.915 N/A SER 179.A N ASN 176.A OD1 no hydrogen 3.010 N/A SER 179.A OG GLU 168.A OE1 no hydrogen 2.734 N/A SER 179.A OG ASN 176.A OD1 no hydrogen 3.217 N/A ASP 180.A N ASN 176.A O no hydrogen 3.406 N/A ILE 181.A N GLU 177.A O no hydrogen 3.257 N/A TRP 182.A N LYS 178.A O no hydrogen 2.952 N/A SER 183.A N SER 179.A O no hydrogen 3.160 N/A SER 183.A OG SER 179.A O no hydrogen 3.446 N/A LEU 184.A N ASP 180.A O no hydrogen 2.941 N/A GLY 185.A N ILE 181.A O no hydrogen 2.896 N/A CYS 186.A N TRP 182.A O no hydrogen 2.994 N/A CYS 186.A SG TRP 182.A O no hydrogen 3.500 N/A LEU 187.A N SER 183.A O no hydrogen 2.920 N/A LEU 188.A N LEU 184.A O no hydrogen 2.880 N/A TYR 189.A N GLY 185.A O no hydrogen 2.934 N/A TYR 189.A OH ARG 216.A O no hydrogen 2.705 N/A GLU 190.A N CYS 186.A O no hydrogen 2.983 N/A LEU 191.A N LEU 187.A O no hydrogen 2.859 N/A CYS 192.A N LEU 188.A O no hydrogen 3.083 N/A CYS 192.A N TYR 189.A O no hydrogen 3.093 N/A CYS 192.A SG LEU 188.A O no hydrogen 3.439 N/A ALA 193.A N TYR 189.A O no hydrogen 2.783 N/A LEU 194.A N GLU 190.A O no hydrogen 2.790 N/A PHE 201.A N GLU 205.A OE1 no hydrogen 2.591 N/A LEU 206.A N SER 202.A O no hydrogen 2.965 N/A ALA 207.A N GLN 203.A O no hydrogen 2.782 N/A GLY 208.A N LYS 204.A O no hydrogen 3.121 N/A LYS 209.A N GLU 205.A O no hydrogen 3.120 N/A ILE 210.A N LEU 206.A O no hydrogen 2.968 N/A ARG 211.A N ALA 207.A O no hydrogen 2.988 N/A ARG 211.A NH2 MET 170.A O no hydrogen 3.542 N/A ARG 211.A NH2 ASN 171.A OD1 no hydrogen 2.154 N/A GLU 212.A N GLY 208.A O no hydrogen 3.255 N/A GLY 213.A N LYS 209.A O no hydrogen 3.172 N/A GLY 213.A N ILE 210.A O no hydrogen 3.228 N/A ARG 217.A NH1 ILE 218.A O no hydrogen 2.849 N/A ARG 217.A NH1 TYR 222.A O no hydrogen 3.191 N/A ARG 217.A NH2 TYR 222.A O no hydrogen 2.915 N/A ARG 217.A NH2 ASP 224.A OD1 no hydrogen 2.800 N/A ILE 218.A N ASN 227.A OD1 no hydrogen 3.442 N/A ARG 221.A NE LEU 106.A O no hydrogen 3.430 N/A TYR 222.A N PRO 219.A O no hydrogen 2.806 N/A TYR 222.A OH LEU 106.A O no hydrogen 2.580 N/A SER 223.A N GLU 108.A OE1 no hydrogen 2.957 N/A SER 223.A OG GLU 108.A OE2 no hydrogen 2.657 N/A GLU 225.A N GLU 225.A OE1 no hydrogen 2.728 N/A LEU 226.A N SER 223.A OG no hydrogen 3.116 N/A ASN 227.A N SER 223.A O no hydrogen 3.026 N/A GLU 228.A N ASP 224.A O no hydrogen 2.889 N/A ILE 229.A N GLU 225.A O no hydrogen 3.226 N/A ILE 230.A N LEU 226.A O no hydrogen 3.193 N/A THR 231.A N ASN 227.A O no hydrogen 2.892 N/A THR 231.A OG1 ASN 227.A O no hydrogen 2.867 N/A ARG 232.A N GLU 228.A O no hydrogen 2.869 N/A ARG 232.A NH2 GLU 228.A OE2 no hydrogen 3.111 N/A MET 233.A N ILE 229.A O no hydrogen 3.154 N/A LEU 234.A N THR 231.A O no hydrogen 3.039 N/A ASN 235.A N ARG 232.A O no hydrogen 3.229 N/A ASN 235.A ND2 ARG 232.A O no hydrogen 3.087 N/A HIS 240.A N LYS 237.A O no hydrogen 3.006 N/A ARG 241.A N ASP 238.A O no hydrogen 3.092 N/A ARG 241.A NE ASN 235.A O no hydrogen 2.880 N/A ARG 241.A NH1 GLU 168.A OE1 no hydrogen 2.964 N/A ARG 241.A NH1 GLU 168.A OE2 no hydrogen 3.218 N/A ARG 241.A NH1 LYS 178.A O no hydrogen 2.852 N/A ARG 241.A NH2 GLU 168.A OE2 no hydrogen 2.561 N/A ARG 241.A NH2 ASN 235.A O no hydrogen 3.491 N/A ARG 241.A NH2 LEU 236.A O no hydrogen 3.303 N/A SER 243.A N GLU 246.A OE2 no hydrogen 3.013 N/A SER 243.A OG GLU 245.A OE1 no hydrogen 3.397 N/A SER 243.A OG GLU 246.A OE2 no hydrogen 3.407 N/A GLU 245.A N GLU 245.A OE1 no hydrogen 2.933 N/A GLU 246.A N SER 243.A OG no hydrogen 3.211 N/A ILE 247.A N SER 243.A O no hydrogen 3.012 N/A LEU 248.A N VAL 244.A O no hydrogen 3.109 N/A GLU 249.A N GLU 245.A O no hydrogen 3.062 N/A ASN 250.A N ILE 247.A O no hydrogen 2.961 N/A LEU 252.A N ASN 250.A OD1 no hydrogen 2.977 N/A ILE 253.A N ASN 250.A O no hydrogen 3.010 N/A LEU 254.A N HIS 257.A ND1 no hydrogen 2.968 N/A HIS 256.A NE2 GLU 109.A OE1 no hydrogen 2.619 N/A HIS 257.A N LEU 254.A O no hydrogen 3.201 N/A HIS 257.A NE2 GLU 109.A OE2 no hydrogen 3.005 N/A HIS 258.A N GLU 255.A O no hydrogen 3.041 N/A HIS 258.A ND1 LEU 254.A O no hydrogen 2.993 N/A HIS 260.A N ASN 152.A OD1 no hydrogen 2.763 N/A HIS 260.A ND1 LYS 150.A O no hydrogen 2.979 N/A