Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3o4f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 4.A N PHE 16.A O no hydrogen 2.836 N/A GLU 6.A N GLN 14.A O no hydrogen 2.924 N/A THR 7.A N GLY 45.A O no hydrogen 2.673 N/A GLN 14.A NE2 GLU 6.A OE1 no hydrogen 3.009 N/A GLN 14.A NE2 THR 219.A O no hydrogen 2.687 N/A PHE 16.A N TRP 4.A O no hydrogen 2.895 N/A VAL 18.A N LYS 2.A O no hydrogen 2.671 N/A ASP 19.A N GLU 33.A O no hydrogen 3.056 N/A LEU 22.A N ILE 31.A O no hydrogen 2.800 N/A TYR 23.A N ILE 31.A O no hydrogen 3.058 N/A GLU 25.A N LEU 29.A O no hydrogen 2.876 N/A ASP 28.A N ASP 44.A OD1 no hydrogen 2.947 N/A LEU 29.A N GLU 25.A O no hydrogen 2.924 N/A ILE 30.A N ALA 42.A O no hydrogen 2.983 N/A ILE 31.A N TYR 23.A O no hydrogen 2.909 N/A PHE 32.A N VAL 40.A O no hydrogen 3.207 N/A GLU 33.A N ASN 20.A O no hydrogen 2.852 N/A ASN 34.A N GLY 38.A O no hydrogen 2.841 N/A ASN 34.A ND2 ALA 17.A O no hydrogen 2.918 N/A ALA 36.A N ASN 34.A OD1 no hydrogen 2.749 N/A PHE 37.A N ASN 34.A OD1 no hydrogen 2.798 N/A ARG 39.A N GLU 51.A OE1 no hydrogen 3.102 N/A ARG 39.A NE TYR 114.A O no hydrogen 2.865 N/A VAL 40.A N PHE 32.A O no hydrogen 2.835 N/A MET 41.A N THR 49.A O no hydrogen 3.004 N/A ALA 42.A N ILE 30.A O no hydrogen 2.991 N/A LEU 43.A N VAL 46.A O no hydrogen 2.966 N/A ASP 44.A N ASP 28.A O no hydrogen 2.706 N/A VAL 46.A N LEU 43.A O no hydrogen 3.094 N/A VAL 47.A N GLU 6.A OE2 no hydrogen 3.083 N/A GLN 48.A N MET 41.A O no hydrogen 2.916 N/A THR 49.A OG1 HIS 118.A NE2 no hydrogen 2.685 N/A GLU 51.A N ARG 39.A O no hydrogen 2.811 N/A ARG 52.A N PHE 37.A O no hydrogen 3.231 N/A ARG 52.A NH1 ARG 52.A O no hydrogen 2.785 N/A GLU 54.A N THR 50.A O no hydrogen 3.191 N/A ILE 56.A N ASP 53.A O no hydrogen 3.100 N/A HIS 58.A N GLU 54.A O no hydrogen 2.904 N/A HIS 58.A ND1 GLU 54.A O no hydrogen 2.903 N/A HIS 58.A ND1 GLU 54.A OE1 no hydrogen 2.869 N/A GLU 59.A N PHE 55.A O no hydrogen 2.683 N/A MET 60.A N ILE 56.A O no hydrogen 3.076 N/A MET 61.A N TYR 57.A O no hydrogen 2.986 N/A THR 62.A N GLU 59.A O no hydrogen 3.034 N/A HIS 63.A N GLU 59.A O no hydrogen 2.961 N/A HIS 63.A ND1 HIS 92.A NE2 no hydrogen 2.933 N/A HIS 63.A NE2 GLU 88.A OE1 no hydrogen 2.835 N/A LEU 66.A N THR 62.A O no hydrogen 3.157 N/A LEU 67.A N HIS 63.A O no hydrogen 2.882 N/A ALA 68.A N VAL 64.A O no hydrogen 2.939 N/A HIS 69.A N PRO 65.A O no hydrogen 2.774 N/A HIS 71.A N HIS 69.A ND1 no hydrogen 3.053 N/A LYS 73.A N ASP 147.A OD2 no hydrogen 3.152 N/A HIS 74.A N ASP 147.A OD2 no hydrogen 3.431 N/A HIS 74.A ND1 SER 97.A OG no hydrogen 2.713 N/A VAL 75.A N SER 97.A O no hydrogen 3.031 N/A LEU 76.A N VAL 148.A O no hydrogen 2.891 N/A ILE 77.A N THR 99.A O no hydrogen 2.694 N/A ILE 78.A N ILE 150.A O no hydrogen 2.782 N/A GLY 79.A N VAL 101.A O no hydrogen 3.207 N/A GLY 80.A N ASP 152.A OD2 no hydrogen 2.504 N/A GLY 83.A N GLY 80.A O no hydrogen 3.355 N/A ALA 84.A N ASP 82.A OD2 no hydrogen 2.926 N/A ARG 87.A N GLY 83.A O no hydrogen 2.927 N/A ARG 87.A NE GLU 88.A OE2 no hydrogen 3.066 N/A ARG 87.A NH1 GLU 54.A OE2 no hydrogen 2.989 N/A ARG 87.A NH1 ASN 117.A O no hydrogen 3.219 N/A ARG 87.A NH1 HIS 118.A O no hydrogen 2.761 N/A ARG 87.A NH2 GLU 54.A OE1 no hydrogen 2.980 N/A ARG 87.A NH2 GLU 54.A OE2 no hydrogen 3.239 N/A ARG 87.A NH2 GLU 88.A OE2 no hydrogen 3.016 N/A GLU 88.A N ALA 84.A O no hydrogen 3.094 N/A VAL 89.A N MET 85.A O no hydrogen 2.946 N/A THR 90.A N LEU 86.A O no hydrogen 2.912 N/A THR 90.A OG1 LEU 86.A O no hydrogen 2.859 N/A THR 90.A OG1 SER 122.A OG no hydrogen 3.275 N/A ARG 91.A N GLU 88.A O no hydrogen 2.825 N/A HIS 92.A N VAL 89.A O no hydrogen 3.106 N/A HIS 92.A NE2 HIS 63.A ND1 no hydrogen 2.933 N/A VAL 95.A N HIS 92.A O no hydrogen 3.129 N/A GLU 96.A N LYS 73.A O no hydrogen 2.757 N/A SER 97.A N LYS 73.A O no hydrogen 3.049 N/A SER 97.A OG HIS 74.A ND1 no hydrogen 2.713 N/A ILE 98.A N ARG 127.A O no hydrogen 3.024 N/A THR 99.A N VAL 75.A O no hydrogen 2.878 N/A MET 100.A N LYS 129.A O no hydrogen 2.860 N/A VAL 101.A N ILE 77.A O no hydrogen 2.953 N/A GLU 102.A N VAL 131.A O no hydrogen 2.958 N/A ILE 103.A N GLU 102.A OE2 no hydrogen 3.041 N/A SER 109.A N ALA 105.A O no hydrogen 3.507 N/A PHE 110.A N GLY 106.A O no hydrogen 2.959 N/A CYS 111.A N VAL 107.A O no hydrogen 3.372 N/A CYS 111.A SG VAL 107.A O no hydrogen 3.454 N/A ARG 112.A N VAL 108.A O no hydrogen 2.787 N/A GLN 113.A N SER 109.A O no hydrogen 3.089 N/A GLN 113.A N PHE 110.A O no hydrogen 2.959 N/A TYR 114.A N PHE 110.A O no hydrogen 3.043 N/A LEU 115.A N CYS 111.A O no hydrogen 2.727 N/A ASN 117.A ND2 GLU 51.A OE2 no hydrogen 3.299 N/A HIS 118.A N LEU 115.A O no hydrogen 3.278 N/A HIS 118.A NE2 THR 49.A OG1 no hydrogen 2.685 N/A ALA 120.A N PRO 116.A O no hydrogen 2.872 N/A SER 122.A N ASN 119.A O no hydrogen 3.124 N/A SER 122.A OG THR 90.A OG1 no hydrogen 3.275 N/A TYR 123.A OH GLY 81.A O no hydrogen 2.889 N/A ASP 124.A N GLY 121.A O no hydrogen 3.164 N/A ASP 125.A N SER 122.A O no hydrogen 3.084 N/A ARG 127.A N ASP 125.A OD2 no hydrogen 2.891 N/A ARG 127.A NE ASP 125.A OD2 no hydrogen 2.994 N/A ARG 127.A NH1 HIS 92.A O no hydrogen 3.105 N/A ARG 127.A NH1 VAL 95.A O no hydrogen 2.716 N/A ARG 127.A NH2 THR 90.A O no hydrogen 2.996 N/A ARG 127.A NH2 ASP 125.A OD1 no hydrogen 2.903 N/A PHE 128.A N ASP 125.A O no hydrogen 3.288 N/A LYS 129.A N ILE 98.A O no hydrogen 2.858 N/A VAL 131.A N MET 100.A O no hydrogen 2.686 N/A ASP 133.A N GLU 102.A O no hydrogen 2.892 N/A ASP 134.A N ASP 133.A OD1 no hydrogen 2.614 N/A VAL 136.A N ASP 134.A OD1 no hydrogen 3.272 N/A ASN 137.A ND2 ASP 133.A OD1 no hydrogen 3.304 N/A PHE 138.A N ASP 134.A O no hydrogen 3.331 N/A ASN 140.A N ASN 137.A O no hydrogen 2.958 N/A ASN 140.A ND2 ASN 137.A O no hydrogen 3.075 N/A GLN 144.A NE2 THR 99.A OG1 no hydrogen 3.340 N/A THR 145.A OG1 ASN 177.A OD1 no hydrogen 2.484 N/A PHE 146.A N CYS 175.A O no hydrogen 2.936 N/A ASP 147.A N HIS 74.A O no hydrogen 2.767 N/A VAL 148.A N HIS 74.A O no hydrogen 3.360 N/A ILE 149.A N ILE 181.A O no hydrogen 2.922 N/A ILE 150.A N LEU 76.A O no hydrogen 2.834 N/A SER 151.A N VAL 183.A O no hydrogen 3.006 N/A SER 151.A OG CYS 153.A O no hydrogen 2.929 N/A ASP 152.A N ILE 78.A O no hydrogen 2.846 N/A CYS 153.A N SER 151.A OG no hydrogen 2.810 N/A THR 154.A OG1 ASN 186.A OD1 no hydrogen 3.541 N/A ASP 155.A N TYR 169.A OH no hydrogen 3.048 N/A GLU 161.A N GLY 158.A O no hydrogen 3.495 N/A SER 166.A N TYR 206.A OH no hydrogen 2.612 N/A TYR 169.A N SER 166.A OG no hydrogen 2.857 N/A GLU 170.A N SER 166.A O no hydrogen 3.243 N/A GLY 171.A N ALA 167.A O no hydrogen 2.985 N/A CYS 172.A N PHE 168.A O no hydrogen 2.870 N/A CYS 172.A SG PHE 168.A O no hydrogen 3.568 N/A LYS 173.A N TYR 169.A O no hydrogen 3.022 N/A LYS 173.A NZ TYR 206.A O no hydrogen 2.905 N/A LYS 173.A NZ ASP 232.A OD2 no hydrogen 2.678 N/A ARG 174.A N GLU 170.A O no hydrogen 2.804 N/A CYS 175.A N GLY 171.A O no hydrogen 3.181 N/A CYS 175.A SG GLY 171.A O no hydrogen 3.141 N/A CYS 175.A SG CYS 172.A O no hydrogen 3.540 N/A LEU 176.A N LYS 173.A O no hydrogen 3.127 N/A ASN 177.A N PHE 146.A O no hydrogen 2.646 N/A ILE 181.A N ASP 147.A O no hydrogen 3.103 N/A PHE 182.A N ALA 230.A O no hydrogen 2.758 N/A VAL 183.A N ILE 149.A O no hydrogen 2.999 N/A ALA 184.A N ALA 228.A O no hydrogen 3.173 N/A GLN 185.A N SER 151.A O no hydrogen 3.330 N/A GLN 185.A NE2 ASP 152.A O no hydrogen 2.906 N/A ASN 186.A N THR 226.A O no hydrogen 2.736 N/A CYS 189.A N ILE 224.A O no hydrogen 3.131 N/A CYS 189.A SG THR 226.A OG1 no hydrogen 2.765 N/A GLN 192.A NE2 GLU 195.A OE2 no hydrogen 3.218 N/A GLN 193.A NE2 CYS 189.A O no hydrogen 2.809 N/A GLU 195.A N GLN 192.A OE1 no hydrogen 3.168 N/A ILE 197.A N GLN 193.A O no hydrogen 2.916 N/A ASP 198.A N GLU 194.A O no hydrogen 2.798 N/A SER 199.A N GLU 195.A O no hydrogen 3.045 N/A SER 199.A OG ASN 186.A OD1 no hydrogen 2.799 N/A SER 199.A OG GLU 195.A O no hydrogen 3.280 N/A HIS 200.A N ALA 196.A O no hydrogen 2.906 N/A ARG 201.A N ILE 197.A O no hydrogen 2.942 N/A ARG 201.A NE LEU 163.A O no hydrogen 2.921 N/A ARG 201.A NH2 ASP 198.A OD1 no hydrogen 2.762 N/A LYS 202.A N ASP 198.A O no hydrogen 2.913 N/A LYS 202.A NZ ASP 155.A O no hydrogen 2.892 N/A LYS 202.A NZ ASP 155.A OD1 no hydrogen 3.188 N/A LYS 202.A NZ PRO 156.A O no hydrogen 3.066 N/A LYS 202.A NZ ASP 198.A OD2 no hydrogen 2.688 N/A LEU 203.A N SER 199.A O no hydrogen 2.868 N/A SER 204.A N HIS 200.A O no hydrogen 2.912 N/A SER 204.A OG HIS 200.A O no hydrogen 3.051 N/A HIS 205.A N LYS 202.A O no hydrogen 2.861 N/A HIS 205.A ND1 PHE 164.A O no hydrogen 3.100 N/A TYR 206.A N LEU 203.A O no hydrogen 3.257 N/A PHE 207.A N LEU 203.A O no hydrogen 2.911 N/A SER 208.A N ASP 232.A OD1 no hydrogen 2.936 N/A SER 208.A OG ASP 232.A O no hydrogen 3.173 N/A SER 208.A OG ASP 232.A OD1 no hydrogen 3.499 N/A ASP 209.A N THR 231.A O no hydrogen 2.798 N/A GLY 211.A N TRP 229.A O no hydrogen 2.784 N/A TYR 213.A N PHE 227.A O no hydrogen 2.924 N/A TYR 213.A OH MET 60.A O no hydrogen 2.759 N/A GLN 214.A N ALA 266.A O no hydrogen 2.964 N/A GLN 214.A NE2 ALA 268.A O no hydrogen 3.272 N/A ALA 215.A N MET 225.A O no hydrogen 3.321 N/A THR 219.A N ASP 53.A OD1 no hydrogen 3.116 N/A THR 219.A OG1 ASP 53.A OD1 no hydrogen 2.546 N/A TYR 220.A N ILE 217.A O no hydrogen 2.876 N/A TYR 220.A OH GLN 48.A O no hydrogen 2.674 N/A MET 225.A N ALA 215.A O no hydrogen 2.839 N/A THR 226.A N GLY 187.A O no hydrogen 2.968 N/A PHE 227.A N TYR 213.A O no hydrogen 2.758 N/A ALA 228.A N ALA 184.A O no hydrogen 2.644 N/A TRP 229.A N GLY 211.A O no hydrogen 2.709 N/A ALA 230.A N PHE 182.A O no hydrogen 2.905 N/A THR 231.A N ASP 209.A O no hydrogen 2.932 N/A THR 231.A OG1 GLY 180.A O no hydrogen 2.883 N/A THR 231.A OG1 ASN 233.A O no hydrogen 3.507 N/A ASN 233.A N THR 231.A OG1 no hydrogen 2.908 N/A ALA 235.A N ASN 233.A OD1 no hydrogen 3.364 N/A ARG 237.A NE ASP 209.A OD1 no hydrogen 3.430 N/A ARG 237.A NE ASP 209.A OD2 no hydrogen 3.114 N/A ARG 237.A NH1 ASP 209.A OD1 no hydrogen 3.223 N/A HIS 238.A N ALA 235.A O no hydrogen 2.986 N/A THR 241.A OG1 PRO 260.A O no hydrogen 3.486 N/A ILE 243.A N SER 240.A O no hydrogen 3.228 N/A ILE 243.A N SER 240.A OG no hydrogen 3.128 N/A ILE 244.A N SER 240.A O no hydrogen 3.476 N/A GLN 245.A N THR 241.A O no hydrogen 2.814 N/A ALA 246.A N GLU 242.A O no hydrogen 2.895 N/A ARG 247.A N ILE 243.A O no hydrogen 2.983 N/A ARG 247.A NH1 LEU 67.A O no hydrogen 2.795 N/A ARG 247.A NH1 ALA 68.A O no hydrogen 2.686 N/A PHE 248.A N ILE 244.A O no hydrogen 2.758 N/A LEU 249.A N GLN 245.A O no hydrogen 2.832 N/A LEU 249.A N ALA 246.A O no hydrogen 3.102 N/A LEU 253.A N SER 251.A O no hydrogen 3.275 N/A ARG 256.A N GLU 59.A OE1 no hydrogen 3.287 N/A ARG 256.A N GLU 59.A OE2 no hydrogen 2.926 N/A TYR 257.A N GLU 59.A OE1 no hydrogen 2.725 N/A TYR 258.A N GLU 59.A OE1 no hydrogen 2.766 N/A TYR 258.A OH HIS 263.A ND1 no hydrogen 2.661 N/A ILE 262.A N ASN 259.A OD1 no hydrogen 2.839 N/A HIS 263.A N ASN 259.A O no hydrogen 2.805 N/A HIS 263.A ND1 TYR 258.A OH no hydrogen 2.661 N/A THR 264.A N PRO 260.A O no hydrogen 3.124 N/A THR 264.A OG1 PRO 260.A O no hydrogen 3.524 N/A ALA 265.A N ALA 261.A O no hydrogen 3.011 N/A ALA 266.A N ILE 262.A O no hydrogen 2.735 N/A ALA 266.A N HIS 263.A O no hydrogen 3.200 N/A PHE 267.A N THR 264.A O no hydrogen 3.202 N/A ALA 268.A N ALA 265.A O no hydrogen 2.771 N/A GLN 271.A NE2 ASP 275.A OD1 no hydrogen 2.670 N/A GLN 271.A NE2 ASP 275.A OD2 no hydrogen 3.454 N/A LEU 273.A N PRO 270.A O no hydrogen 2.969 N/A GLN 274.A N PRO 270.A O no hydrogen 3.310 N/A GLN 274.A N GLN 271.A O no hydrogen 2.900 N/A GLN 274.A NE2 LEU 269.A O no hydrogen 2.762 N/A ASP 275.A N GLN 271.A O no hydrogen 2.939 N/A ALA 276.A N TYR 272.A O no hydrogen 3.023 N/A LEU 277.A N LEU 273.A O no hydrogen 3.057 N/A ALA 278.A N ASP 275.A O no hydrogen 3.139 N/A