Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vpd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLY 48.A O no hydrogen 3.047 N/A LEU 2.A N PRO 26.A O no hydrogen 2.778 N/A ALA 3.A N VAL 51.A O no hydrogen 2.882 N/A ILE 4.A N LYS 28.A O no hydrogen 2.844 N/A LEU 5.A N LEU 53.A O no hydrogen 2.883 N/A TYR 6.A N VAL 30.A O no hydrogen 2.937 N/A ARG 8.A N ASP 7.A OD2 no hydrogen 2.763 N/A ARG 10.A N GLU 13.A OE1 no hydrogen 2.920 N/A ARG 10.A NE GLU 13.A OE1 no hydrogen 3.029 N/A ARG 10.A NH2 GLU 13.A OE2 no hydrogen 3.014 N/A ARG 14.A N ARG 10.A O no hydrogen 3.231 N/A MET 15.A N PRO 11.A O no hydrogen 3.006 N/A LEU 16.A N ASP 12.A O no hydrogen 3.094 N/A PHE 17.A N GLU 13.A O no hydrogen 3.015 N/A GLU 18.A N ARG 14.A O no hydrogen 3.058 N/A ARG 19.A N MET 15.A O no hydrogen 2.983 N/A ARG 19.A NE ASP 266.A OD1 no hydrogen 3.275 N/A ARG 19.A NE ASP 266.A OD2 no hydrogen 2.884 N/A ARG 19.A NH2 ASP 266.A OD1 no hydrogen 2.915 N/A ALA 20.A N LEU 16.A O no hydrogen 2.976 N/A GLU 21.A N PHE 17.A O no hydrogen 3.151 N/A ALA 22.A N GLU 18.A O no hydrogen 3.015 N/A LEU 23.A N ARG 19.A O no hydrogen 2.818 N/A GLY 24.A N GLU 21.A O no hydrogen 2.951 N/A LEU 25.A N ALA 20.A O no hydrogen 2.937 N/A TYR 27.A OH GLU 21.A OE2.A no hydrogen 2.797 N/A LYS 28.A N LEU 2.A O no hydrogen 2.782 N/A LYS 28.A NZ ALA 45.A O no hydrogen 2.798 N/A VAL 30.A N ILE 4.A O no hydrogen 2.809 N/A VAL 32.A N TYR 6.A O no hydrogen 2.818 N/A ALA 34.A N TYR 31.A O no hydrogen 3.137 N/A LEU 35.A N VAL 32.A O no hydrogen 2.943 N/A GLU 41.A N VAL 38.A O no hydrogen 3.161 N/A ARG 42.A NH1 LEU 46.A O no hydrogen 2.695 N/A ARG 42.A NH1 VAL 49.A O no hydrogen 3.259 N/A LEU 46.A N PRO 43.A O no hydrogen 3.085 N/A GLU 47.A N GLU 44.A O no hydrogen 3.205 N/A VAL 49.A N LEU 46.A O no hydrogen 3.092 N/A THR 50.A N MET 1.A O no hydrogen 2.735 N/A VAL 51.A N MET 1.A O no hydrogen 3.343 N/A ALA 52.A N PRO 75.A O no hydrogen 2.856 N/A LEU 53.A N ALA 3.A O no hydrogen 2.834 N/A GLU 54.A N VAL 77.A O no hydrogen 2.848 N/A ARG 55.A N LEU 5.A O no hydrogen 2.815 N/A ARG 55.A NE GLU 13.A OE2 no hydrogen 2.857 N/A ARG 55.A NH1 GLU 13.A OE2 no hydrogen 3.047 N/A ARG 55.A NH1 MET 254.A O no hydrogen 2.956 N/A ARG 55.A NH2 MET 254.A O no hydrogen 2.933 N/A CYS 56.A N GLU 54.A OE2 no hydrogen 2.829 N/A VAL 57.A N ASP 7.A OD2 no hydrogen 2.718 N/A SER 58.A N ASP 7.A OD1 no hydrogen 3.065 N/A GLN 59.A NE2 GLY 87.A O no hydrogen 3.684 N/A ARG 61.A N SER 58.A OG no hydrogen 3.093 N/A ARG 61.A NH2 ASP 7.A OD1 no hydrogen 3.027 N/A GLY 62.A N SER 58.A O no hydrogen 2.897 N/A LEU 63.A N GLN 59.A O no hydrogen 2.932 N/A ALA 64.A N SER 60.A O no hydrogen 3.088 N/A ALA 65.A N ARG 61.A O no hydrogen 2.950 N/A ALA 66.A N GLY 62.A O no hydrogen 2.846 N/A ARG 67.A N LEU 63.A O no hydrogen 2.887 N/A ARG 67.A NH1 GLU 84.A OE2 no hydrogen 3.353 N/A ARG 67.A NH2 GLU 84.A OE2 no hydrogen 2.585 N/A TYR 68.A N ALA 64.A O no hydrogen 3.002 N/A TYR 68.A OH VAL 38.A O no hydrogen 2.644 N/A LEU 69.A N ALA 65.A O no hydrogen 2.937 N/A THR 70.A N ALA 66.A O no hydrogen 3.128 N/A THR 70.A OG1 ARG 67.A O no hydrogen 2.668 N/A ALA 71.A N ARG 67.A O no hydrogen 3.126 N/A LEU 72.A N TYR 68.A O no hydrogen 3.085 N/A LEU 72.A N LEU 69.A O no hydrogen 3.065 N/A GLY 73.A N THR 70.A O no hydrogen 3.143 N/A ILE 74.A N LEU 69.A O no hydrogen 2.937 N/A VAL 77.A N ALA 52.A O no hydrogen 2.858 N/A ASN 78.A ND2 VAL 233.A O no hydrogen 2.731 N/A ASN 78.A ND2 HIS 252.A O no hydrogen 2.808 N/A ARG 79.A NH1 GLY 230.A O no hydrogen 2.799 N/A GLU 81.A N GLU 81.A OE2 no hydrogen 2.773 N/A ILE 83.A N ARG 79.A O no hydrogen 3.088 N/A GLU 84.A N PRO 80.A O no hydrogen 2.790 N/A ALA 85.A N GLU 81.A O no hydrogen 3.078 N/A CYS 86.A N VAL 82.A O no hydrogen 2.902 N/A CYS 86.A SG VAL 82.A O no hydrogen 3.435 N/A GLY 87.A N ILE 83.A O no hydrogen 2.899 N/A LYS 89.A N VAL 131.A O no hydrogen 2.770 N/A LYS 89.A NZ PRO 130.A O no hydrogen 2.657 N/A ALA 91.A N ASP 88.A OD2 no hydrogen 2.940 N/A THR 92.A N ASP 88.A O no hydrogen 2.946 N/A THR 92.A OG1 ALA 85.A O no hydrogen 2.641 N/A THR 92.A OG1 ASP 88.A O no hydrogen 3.294 N/A SER 93.A N LYS 89.A O no hydrogen 2.895 N/A SER 93.A OG LYS 89.A O no hydrogen 3.180 N/A SER 93.A OG TYR 167.A OH no hydrogen 2.525 N/A VAL 94.A N TRP 90.A O no hydrogen 2.807 N/A ALA 95.A N ALA 91.A O no hydrogen 3.015 N/A LEU 96.A N THR 92.A O no hydrogen 2.892 N/A ALA 97.A N SER 93.A O no hydrogen 2.911 N/A LYS 98.A N VAL 94.A O no hydrogen 2.933 N/A ALA 99.A N ALA 95.A O no hydrogen 3.011 N/A GLY 100.A N ALA 97.A O no hydrogen 2.969 N/A LEU 101.A N LEU 96.A O no hydrogen 2.990 N/A LYS 105.A N GLU 170.A OE2 no hydrogen 2.715 N/A THR 106.A OG1 PRO 104.A O no hydrogen 2.689 N/A ALA 107.A N ILE 168.A O no hydrogen 2.849 N/A ALA 109.A N PHE 166.A O no hydrogen 2.926 N/A ARG 112.A NH2 GLU 156.A OE1 no hydrogen 3.408 N/A GLU 114.A N ASP 111.A OD2 no hydrogen 2.880 N/A ALA 115.A N ASP 111.A O no hydrogen 3.010 N/A LEU 116.A N ARG 112.A O no hydrogen 2.900 N/A ARG 117.A N GLU 113.A O no hydrogen 3.041 N/A ARG 117.A NE GLU 114.A OE1 no hydrogen 3.029 N/A ARG 117.A NH2 GLU 114.A OE2 no hydrogen 2.874 N/A LEU 118.A N GLU 114.A O no hydrogen 2.937 N/A MET 119.A N ALA 115.A O no hydrogen 3.125 N/A GLU 120.A N LEU 116.A O no hydrogen 2.987 N/A ALA 121.A N ARG 117.A O no hydrogen 2.814 N/A PHE 122.A N LEU 118.A O no hydrogen 2.722 N/A GLY 123.A N MET 119.A O no hydrogen 2.794 N/A TYR 124.A OH GLU 120.A OE1 no hydrogen 3.212 N/A VAL 126.A N VAL 142.A O no hydrogen 2.991 N/A VAL 127.A N GLN 169.A O no hydrogen 2.759 N/A LEU 128.A N ALA 140.A O no hydrogen 2.956 N/A LYS 129.A N TYR 167.A O no hydrogen 2.937 N/A LYS 129.A NZ GLN 169.A OE1 no hydrogen 3.014 N/A TRP 135.A NE1 GLU 255.A OE1 no hydrogen 3.051 N/A ARG 137.A NH2 TRP 135.A O no hydrogen 3.553 N/A ALA 140.A N LEU 128.A O no hydrogen 2.922 N/A LYS 141.A NZ TYR 171.A OH no hydrogen 3.317 N/A VAL 142.A N VAL 126.A O no hydrogen 2.832 N/A ARG 145.A NE GLU 149.A OE2 no hydrogen 3.240 N/A ARG 145.A NH1 GLU 120.A OE1 no hydrogen 2.520 N/A ALA 147.A N ASP 144.A OD2 no hydrogen 2.941 N/A ALA 148.A N ASP 144.A O no hydrogen 3.050 N/A GLU 149.A N ARG 145.A O no hydrogen 2.820 N/A ALA 150.A N ALA 146.A O no hydrogen 3.098 N/A LEU 151.A N ALA 147.A O no hydrogen 2.996 N/A LEU 152.A N ALA 148.A O no hydrogen 3.045 N/A GLU 153.A N GLU 149.A O no hydrogen 3.023 N/A HIS 154.A N ALA 150.A O no hydrogen 3.014 N/A LYS 155.A N LEU 151.A O no hydrogen 2.996 N/A GLU 156.A N LEU 152.A O no hydrogen 2.957 N/A VAL 157.A N GLU 153.A O no hydrogen 2.847 N/A LEU 158.A N HIS 154.A O no hydrogen 2.928 N/A GLY 159.A N LYS 155.A O no hydrogen 2.897 N/A HIS 163.A N GLY 160.A O no hydrogen 3.006 N/A GLN 164.A N PHE 161.A O no hydrogen 3.104 N/A GLN 164.A NE2 LYS 155.A O no hydrogen 3.052 N/A GLN 164.A NE2 GLY 160.A O no hydrogen 2.836 N/A LEU 165.A N GLN 162.A O no hydrogen 3.398 N/A PHE 166.A N ALA 109.A O no hydrogen 2.772 N/A TYR 167.A N LYS 129.A O no hydrogen 3.417 N/A TYR 167.A OH SER 93.A OG no hydrogen 2.525 N/A ILE 168.A N ALA 107.A O no hydrogen 2.861 N/A GLN 169.A N VAL 127.A O no hydrogen 2.823 N/A GLN 169.A NE2 THR 106.A OG1 no hydrogen 3.229 N/A GLU 170.A N LYS 105.A O no hydrogen 2.936 N/A LYS 174.A NZ TRP 199.A O no hydrogen 2.864 N/A ARG 177.A NE GLU 240.A OE1 no hydrogen 2.771 N/A ARG 177.A NH2 GLU 240.A OE1 no hydrogen 3.492 N/A ARG 177.A NH2 GLU 240.A OE2 no hydrogen 2.783 N/A ASP 178.A N ARG 194.A O no hydrogen 3.015 N/A ILE 179.A N LEU 238.A O no hydrogen 2.964 N/A ARG 180.A N ILE 192.A O no hydrogen 2.923 N/A ARG 180.A NE ASP 237.A OD1 no hydrogen 2.750 N/A ARG 180.A NH2 ASP 237.A OD1 no hydrogen 3.385 N/A ARG 180.A NH2 ASP 237.A OD2 no hydrogen 2.920 N/A VAL 181.A N VAL 236.A O no hydrogen 2.783 N/A PHE 182.A N ALA 190.A O no hydrogen 2.824 N/A VAL 183.A N VAL 234.A O no hydrogen 2.835 N/A VAL 184.A N ARG 187.A O no hydrogen 2.879 N/A GLY 185.A N GLY 232.A O no hydrogen 2.810 N/A ARG 187.A N VAL 184.A O no hydrogen 3.188 N/A ARG 187.A NH1 GLU 270.A OE2 no hydrogen 3.462 N/A ARG 187.A NH2 GLU 270.A OE1 no hydrogen 2.453 N/A ILE 189.A N PHE 182.A O no hydrogen 2.926 N/A ILE 192.A N ARG 180.A O no hydrogen 2.855 N/A TYR 193.A N GLU 210.A O no hydrogen 2.733 N/A ARG 194.A N ASP 178.A O no hydrogen 2.849 N/A ARG 194.A NE ASP 178.A OD1 no hydrogen 3.070 N/A ARG 195.A N GLN 208.A O no hydrogen 2.759 N/A SER 196.A N GLY 176.A O no hydrogen 2.977 N/A HIS 198.A N SER 196.A OG no hydrogen 3.023 N/A ILE 200.A N HIS 198.A ND1 no hydrogen 3.191 N/A THR 201.A OG1 ASP 178.A OD1 no hydrogen 2.862 N/A THR 201.A OG1 ASP 178.A OD2 no hydrogen 3.093 N/A ARG 205.A N ASN 202.A O no hydrogen 3.302 N/A GLY 206.A N THR 203.A O no hydrogen 3.223 N/A GLY 207.A N THR 203.A O no hydrogen 3.327 N/A GLN 208.A N ARG 195.A O no hydrogen 2.770 N/A GLU 210.A N TYR 193.A O no hydrogen 3.003 N/A CYS 212.A N ALA 191.A O no hydrogen 2.895 N/A CYS 212.A SG PRO 213.A O no hydrogen 3.669 N/A ILE 218.A N THR 215.A OG1 no hydrogen 3.084 N/A ALA 219.A N THR 215.A O no hydrogen 3.001 N/A ARG 220.A N GLU 216.A O no hydrogen 3.040 N/A ARG 220.A NH2 GLU 216.A OE1 no hydrogen 3.124 N/A LEU 221.A N GLU 217.A O no hydrogen 2.951 N/A SER 222.A N ILE 218.A O no hydrogen 3.059 N/A SER 222.A OG ILE 218.A O no hydrogen 2.755 N/A VAL 223.A N ALA 219.A O no hydrogen 3.000 N/A GLY 224.A N ARG 220.A O no hydrogen 2.984 N/A ALA 225.A N LEU 221.A O no hydrogen 2.811 N/A ALA 226.A N SER 222.A O no hydrogen 2.869 N/A GLU 227.A N VAL 223.A O no hydrogen 2.833 N/A ALA 228.A N GLY 224.A O no hydrogen 2.899 N/A VAL 229.A N ALA 225.A O no hydrogen 3.226 N/A VAL 229.A N ALA 226.A O no hydrogen 3.320 N/A GLY 230.A N GLU 227.A O no hydrogen 3.005 N/A GLY 231.A N ALA 226.A O no hydrogen 2.820 N/A VAL 233.A N ASN 78.A OD1 no hydrogen 2.924 N/A VAL 234.A N VAL 183.A O no hydrogen 2.946 N/A ALA 235.A N ASN 251.A O no hydrogen 3.040 N/A VAL 236.A N VAL 181.A O no hydrogen 2.739 N/A ASP 237.A N GLU 249.A O no hydrogen 2.863 N/A LEU 238.A N ILE 179.A O no hydrogen 2.800 N/A PHE 239.A N LEU 246.A O no hydrogen 2.813 N/A SER 241.A N GLY 244.A O no hydrogen 3.003 N/A SER 241.A OG GLY 244.A O no hydrogen 2.622 N/A GLU 242.A N GLU 242.A OE2 no hydrogen 2.624 N/A ARG 243.A N SER 241.A OG no hydrogen 3.072 N/A ARG 243.A NH1 GLN 103.A O no hydrogen 3.567 N/A ARG 243.A NH2 GLN 103.A O no hydrogen 3.212 N/A ARG 243.A NH2 GLU 170.A OE2 no hydrogen 2.606 N/A GLY 244.A N SER 241.A O no hydrogen 3.187 N/A LEU 246.A N PHE 239.A O no hydrogen 2.803 N/A VAL 247.A N PRO 102.A O no hydrogen 2.833 N/A ASN 248.A N ASP 237.A O no hydrogen 2.775 N/A GLU 249.A N ASP 237.A O no hydrogen 3.483 N/A ASN 251.A N ALA 235.A O no hydrogen 2.768 N/A ASN 251.A ND2 ALA 235.A O no hydrogen 3.075 N/A ASN 251.A ND2 ASP 237.A OD2 no hydrogen 3.263 N/A HIS 252.A ND1 THR 253.A OG1 no hydrogen 2.691 N/A HIS 252.A NE2 GLN 59.A OE1 no hydrogen 2.745 N/A THR 253.A OG1 HIS 252.A ND1 no hydrogen 2.691 N/A PHE 256.A N ASP 12.A OD1 no hydrogen 2.875 N/A LYS 257.A N ASP 12.A OD1 no hydrogen 3.149 N/A VAL 260.A N PHE 256.A O no hydrogen 3.150 N/A THR 262.A N ASN 258.A O no hydrogen 3.102 N/A THR 262.A OG1 ASN 258.A O no hydrogen 3.185 N/A THR 263.A N SER 259.A O no hydrogen 2.837 N/A THR 263.A OG1 SER 259.A O no hydrogen 2.826 N/A GLY 264.A N VAL 260.A O no hydrogen 2.803 N/A VAL 265.A N THR 263.A OG1 no hydrogen 3.108 N/A ILE 267.A N VAL 265.A O no hydrogen 2.900 N/A GLY 269.A N ASP 266.A OD2 no hydrogen 3.086 N/A GLU 270.A N ASP 266.A O no hydrogen 2.979 N/A ILE 271.A N ILE 267.A O no hydrogen 2.992 N/A LEU 272.A N PRO 268.A O no hydrogen 2.898 N/A ARG 273.A N GLY 269.A O no hydrogen 2.997 N/A ARG 273.A NH1.B ASP 266.A OD1 no hydrogen 3.477 N/A ARG 273.A NH2.A GLU 270.A OE1 no hydrogen 2.664 N/A TYR 274.A N GLU 270.A O no hydrogen 3.030 N/A ALA 275.A N ILE 271.A O no hydrogen 3.039 N/A TRP 276.A N LEU 272.A O no hydrogen 2.853 N/A GLU 277.A N ARG 273.A O no hydrogen 2.736 N/A VAL 278.A N TYR 274.A O no hydrogen 3.007 N/A ALA 279.A N TYR 274.A O no hydrogen 3.058 N/A ARG 280.A N ALA 275.A O no hydrogen 3.043 N/A